0 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.34 C#CC(C)C(=O)c1ccccc1 Amb27861418 [0,0,0,0,0,0|1,0,3]=4 2 B12R1.34 C#CC(C)C(C)c1ccccc1 Amb33081864 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.34 C#CC(C)C(N)c1ccccc1 Amb28254509 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.34 C#CC(Cl)C(O)c1ccccc1 Amb27878811 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.34 C#CC(O)C(N)c1ccccc1 Amb29875675 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.34 C#C[C@@H](C)[C@@H](O)c1ccccc1 Amb27757239 [0,0,0,0,0,0|1,0,1]=2 7 B12R1.34 C#C[C@@H](C)[C@H](O)c1ccccc1 Amb27405268 [0,0,0,0,0,0|1,0,1]=2 8 B12R1.34 C#C[C@@H](O)C(C)c1ccccc1 Amb29852035 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.34 C#C[C@H](C)[C@@H](O)c1ccccc1 Amb27650164 [0,0,0,0,0,0|1,0,1]=2 10 B12R1.34 C#C[C@H](O)C(C)c1ccccc1 Amb29852036 [0,0,0,0,0,0|3,0,1]=4 11 B12R1.34 C=C(C#N)C(O)c1ccccc1 Amb6670930 [0,0,0,0,0,0|2,0,2]=4 12 B12R1.34 C=C(C#N)[C@@H](O)c1ccccc1 Amb27981884 [0,0,0,0,0,0|2,0,2]=4 13 B12R1.34 C=C(CC)[C@H](O)c1ccccc1 Amb28460718 [0,0,0,0,0,0|1,0,2]=3 14 B12R1.34 C=C(CN)C(O)c1ccccc1 Amb28185879 [0,0,0,0,0,0|2,0,2]=4 15 B12R1.34 C=C(OC)C(O)c1ccccc1 Amb27652842 [0,0,0,0,0,0|1,0,2]=3 16 B12R1.34 C=C(SC)C(O)c1ccccc1 Amb28242432 [0,0,0,0,0,0|1,0,2]=3 17 B12R1.34 C=C(c1ccccc1)C(O)CC Amb27431432 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.34 C=C=C(C)C(N)c1ccccc1 Amb27984710 [0,0,0,0,0,0|2,0,2]=4 19 B12R1.34 C=CC(=C)[C@H](O)c1ccccc1 Amb28138679 [0,0,0,0,0,0|1,0,3]=4 20 B12R1.34 C=CC(C)C(=O)c1ccccc1 Amb27749794 [0,0,0,0,0,0|1,0,3]=4 21 B12R1.34 C=CC(C)C(N)c1ccccc1 Amb27392398 [0,0,0,0,0,0|2,0,1]=3 22 B12R1.34 C=CC(C)C(O)c1ccccn1 Amb28190323 [0,0,0,0,0,0|2,0,1]=3 23 B12R1.34 C=CC(C)N(C)c1ccccc1 Amb27979353 [0,0,0,0,0,0|3,0,1]=4 24 B12R1.34 C=CC(N)C(N)c1ccccc1 Amb27390654 [0,0,0,0,0,0|3,0,1]=4 25 B12R1.34 C=CC(O)C(C)c1ccccc1 Amb25310831 [0,0,0,0,0,0|3,0,1]=4 26 B12R1.34 C=CC(O)C(O)c1ccncc1 Amb28206049 [0,0,0,0,0,0|3,0,1]=4 27 B12R1.34 C=C[C@@H](C)[C@@H](N)c1ccccn1 Amb27790727 [0,0,0,0,0,0|3,0,1]=4 28 B12R1.34 C=C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27232990 [0,0,0,0,0,0|2,0,1]=3 29 B12R1.34 C=C[C@@H](O)[C@H](O)c1ccccc1 Amb27615222 [0,0,0,0,0,0|2,0,1]=3 30 B12R1.34 C=C[C@H](C)[C@@H](O)c1ccccc1 Amb25071531 [0,0,0,0,0,0|1,0,1]=2 31 B12R1.34 C=C[C@H](C)[C@@H](O)c1ccncc1 Amb28242271 [0,0,0,0,0,0|2,0,1]=3 32 B12R1.34 C=C[C@H](N)[C@H](O)c1ccccc1 Amb27876610 [0,0,0,0,0,0|2,0,1]=3 33 B12R1.34 C=C[C@H](O)[C@@H](C)c1ccccc1 Amb27169905 [0,0,0,0,0,0|3,0,1]=4 34 B12R1.34 CC(C#N)C(=O)c1ccccc1 Amb33529617 [0,0,0,0,0,0|2,0,2]=4 35 B12R1.34 CC(C#N)C(C)c1ccccc1 Amb33081594 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.34 CC(C#N)C(O)c1ccccn1 Amb27222172 [0,0,0,0,0,0|3,0,0]=3 37 B12R1.34 CC(C#N)C(O)c1cnccn1 Amb35602904 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.34 CC(C#N)S(=O)c1ccccc1 Amb28188974 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.34 CC(C(=O)NN)c1ccccc1 Amb28120718 [0,0,0,0,0,0|3,0,1]=4 40 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,0,0,0,0,0|2,0,2]=4 41 B12R1.34 CC(C=O)C(C)c1ccccc1 Amb24065337 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.34 CC(C=O)C(O)c1ccccc1 Amb28397488 [0,0,0,0,0,0|2,0,0]=2 43 B12R1.34 CC(C=O)S(=O)c1ccccc1 Amb27224791 [0,0,0,0,0,0|3,0,1]=4 44 B12R1.34 CC(CBr)C(C)c1ccccc1 Amb33081859 [0,0,0,0,0,0|3,0,0]=3 45 B12R1.34 CC(CCl)C(=O)c1ccccc1 Amb4006275 [0,0,0,0,0,0|2,0,2]=4 46 B12R1.34 CC(CCl)C(C)c1ccccc1 Amb27592178 [0,0,0,0,0,0|3,0,0]=3 47 B12R1.34 CC(CN)C(C)c1ccccc1 Amb18829124 [0,0,0,0,0,0|3,0,0]=3 48 B12R1.34 CC(CN)C(C)c1cccnc1 Amb18828712 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.34 CC(CN)C(F)c1ccccc1 Amb28048144 [0,0,0,0,0,0|3,0,0]=3 50 B12R1.34 CC(CN)C(F)c1cccnc1 Amb28241615 [0,0,0,0,0,0|4,0,0]=4 51 B12R1.34 CC(CN)C(N)c1ccccc1 Amb28066263 [0,0,0,0,0,0|3,0,0]=3 52 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,0,0,0,0,0|2,0,0]=2 53 B12R1.34 CC(CN)C(O)c1ccccn1 Amb25380785 [0,0,0,0,0,0|3,0,0]=3 54 B12R1.34 CC(CN)C(O)c1cccnc1 Amb25762523 [0,0,0,0,0,0|3,0,0]=3 55 B12R1.34 CC(CN)C(O)c1ccncc1 Amb26933547 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.34 CC(CN)C(O)c1ccncn1 Amb24539872 [0,0,0,0,0,0|4,0,0]=4 57 B12R1.34 CC(CN)C(O)c1cnccn1 Amb27454318 [0,0,0,0,0,0|4,0,0]=4 58 B12R1.34 CC(CN)C(O)c1cncnc1 Amb27399164 [0,0,0,0,0,0|4,0,0]=4 59 B12R1.34 CC(CN)N(C)c1ccccc1 Amb1128364 [0,0,0,0,0,0|4,0,0]=4 60 B12R1.34 CC(CN)N(C)c1ccccc1 Amb13949221 [0,0,0,0,0,0|4,0,0]=4 61 B12R1.34 CC(CO)C(=O)c1ccccc1 Amb8392341 [0,0,0,0,0,0|2,0,2]=4 62 B12R1.34 CC(CO)C(C)c1ccccc1 Amb26375616 [0,0,0,0,0,0|3,0,0]=3 63 B12R1.34 CC(CO)C(C)c1cccnc1 Amb33745857 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.34 CC(CO)C(O)c1ccccn1 Amb27835987 [0,0,0,0,0,0|3,0,0]=3 65 B12R1.34 CC(CO)N(O)c1ccccc1 Amb28065271 [0,0,0,0,0,0|3,0,0]=3 66 B12R1.34 CC(CO)[C@H](C)c1ccccc1 Amb28207416 [0,0,0,0,0,0|3,0,0]=3 67 B12R1.34 CC(NN)C(O)c1ccccc1 Amb27867037 [0,0,0,0,0,0|1,0,0]=1 68 B12R1.34 CC(ON)C(C)c1ccccc1 Amb33081868 [0,0,0,0,0,0|3,0,0]=3 69 B12R1.34 CC(c1ccccc1)C(Br)C#N Amb26043284 [0,0,0,0,0,0|4,0,0]=4 70 B12R1.34 CC(c1ccccc1)C(Cl)C#N Amb18791080 [0,0,0,0,0,0|4,0,0]=4 71 B12R1.34 CC(c1ccccc1)C(Cl)C=O Amb18648719 [0,0,0,0,0,0|4,0,0]=4 72 B12R1.34 CC(c1ccccc1)C(F)C=O Amb27413171 [0,0,0,0,0,0|4,0,0]=4 73 B12R1.34 CC(c1ccccc1)C(F)CN Amb33082393 [0,0,0,0,0,0|4,0,0]=4 74 B12R1.34 CC(c1ccccc1)C(N)C#N Amb18953074 [0,0,0,0,0,0|4,0,0]=4 75 B12R1.34 CC(c1ccccc1)C(N)CN Amb18972125 [0,0,0,0,0,0|4,0,0]=4 76 B12R1.34 CC(c1ccccc1)C(N)CN Amb33537059 [0,0,0,0,0,0|4,0,0]=4 77 B12R1.34 CC(c1ccccc1)C(N)CO Amb18975503 [0,0,0,0,0,0|4,0,0]=4 78 B12R1.34 CC(c1ccccc1)C(N)CO Amb19349648 [0,0,0,0,0,0|4,0,0]=4 79 B12R1.34 CC(c1ccccc1)C(O)CBr Amb33081873 [0,0,0,0,0,0|4,0,0]=4 80 B12R1.34 CC(c1ccccc1)C(O)CCl Amb33081872 [0,0,0,0,0,0|4,0,0]=4 81 B12R1.34 CC(c1ccccc1)C(O)CF Amb27416766 [0,0,0,0,0,0|4,0,0]=4 82 B12R1.34 CC(c1ccccc1)C(O)CN Amb17232553 [0,0,0,0,0,0|4,0,0]=4 83 B12R1.34 CC(c1ccccc1)C(O)CO Amb26021855 [0,0,0,0,0,0|4,0,0]=4 84 B12R1.34 CC(c1ccccc1)N(C)C#N Amb28190109 [0,0,0,0,0,0|4,0,0]=4 85 B12R1.34 CC(c1ccccc1)[C@@H](C)CN Amb33738459 [0,0,0,0,0,0|3,0,0]=3 86 B12R1.34 CC(c1ccccc1)[C@@H](C)CO Amb33746406 [0,0,0,0,0,0|3,0,0]=3 87 B12R1.34 CC(c1ccccc1)[C@@H](N)CO Amb33081836 [0,0,0,0,0,0|4,0,0]=4 88 B12R1.34 CC(c1ccccc1)[C@@H](O)CN Amb33081825 [0,0,0,0,0,0|4,0,0]=4 89 B12R1.34 CC(c1ccccc1)[C@H](C)CN Amb33746913 [0,0,0,0,0,0|3,0,0]=3 90 B12R1.34 CC(c1ccccc1)[C@H](C)CO Amb33727265 [0,0,0,0,0,0|3,0,0]=3 91 B12R1.34 CC(c1ccccc1)[C@H](N)CO Amb33081833 [0,0,0,0,0,0|4,0,0]=4 92 B12R1.34 CC(c1ccccc1)[C@H](O)CN Amb33081831 [0,0,0,0,0,0|4,0,0]=4 93 B12R1.34 CC(c1cccnc1)[C@@H](C)CN Amb33744945 [0,0,0,0,0,0|4,0,0]=4 94 B12R1.34 CC(c1cccnc1)[C@@H](C)CO Amb33736432 [0,0,0,0,0,0|4,0,0]=4 95 B12R1.34 CC(c1cccnc1)[C@H](C)CN Amb33730038 [0,0,0,0,0,0|4,0,0]=4 96 B12R1.34 CC(c1cccnc1)[C@H](C)CO Amb33743120 [0,0,0,0,0,0|4,0,0]=4 97 B12R1.34 CCC(=O)C(Br)c1ccccc1 Amb17596238 [0,0,0,0,0,0|3,0,1]=4 98 B12R1.34 CCC(=O)C(C)c1ccccc1 Amb3940841 [0,0,0,0,0,0|3,0,1]=4 99 B12R1.34 CCC(=O)C(Cl)c1ccccc1 Amb27477956 [0,0,0,0,0,0|3,0,1]=4 100 B12R1.34 CCC(=O)C(F)c1ccccc1 Amb27668940 [0,0,0,0,0,0|3,0,1]=4 101 B12R1.34 CCC(=O)C(N)c1ccccc1 Amb27244834 [0,0,0,0,0,0|3,0,1]=4 102 B12R1.34 CCC(=O)C(O)c1ccccc1 Amb28201072 [0,0,0,0,0,0|2,0,1]=3 103 B12R1.34 CCC(Br)C(=O)c1ccccc1 Amb6673863 [0,0,0,0,0,0|2,0,2]=4 104 B12R1.34 CCC(Br)C(C)c1ccncc1 Amb28399518 [0,0,0,0,0,0|4,0,0]=4 105 B12R1.34 CCC(C)C(=O)c1ccccc1 Amb8850439 [0,0,0,0,0,0|1,0,2]=3 106 B12R1.34 CCC(C)C(=O)c1ccccn1 Amb24649735 [0,0,0,0,0,0|2,0,2]=4 107 B12R1.34 CCC(C)C(Cl)c1cncnc1 Amb27589212 [0,0,0,0,0,0|4,0,0]=4 108 B12R1.34 CCC(C)C(N)c1ccccc1 Amb30628584 [0,0,0,0,0,0|2,0,0]=2 109 B12R1.34 CCC(C)C(N)c1cccnc1 Amb27804504 [0,0,0,0,0,0|3,0,0]=3 110 B12R1.34 CCC(C)C(N)c1ncccn1 Amb25882338 [0,0,0,0,0,0|4,0,0]=4 111 B12R1.34 CCC(C)[C@@H](N)c1ccccn1 Amb28140785 [0,0,0,0,0,0|3,0,0]=3 112 B12R1.34 CCC(C)[C@H](N)c1ccccc1 Amb27430422 [0,0,0,0,0,0|2,0,0]=2 113 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,0,0,0,0,0|2,0,2]=4 114 B12R1.34 CCC(Cl)C(C)c1ccccn1 Amb27776061 [0,0,0,0,0,0|4,0,0]=4 115 B12R1.34 CCC(F)C(=O)c1ccccc1 Amb26600904 [0,0,0,0,0,0|2,0,2]=4 116 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb17138555 [0,0,0,0,0,0|2,0,2]=4 117 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,0,0,0,0,0|2,0,2]=4 118 B12R1.34 CCC(N)C(C)c1ccccc1 Amb18829127 [0,0,0,0,0,0|3,0,0]=3 119 B12R1.34 CCC(N)C(C)c1ccccc1 Amb20623710 [0,0,0,0,0,0|3,0,0]=3 120 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,0,0,0,0,0|2,0,0]=2 121 B12R1.34 CCC(N)C(O)c1ccccc1 Amb9428998 [0,0,0,0,0,0|2,0,0]=2 122 B12R1.34 CCC(N)C(O)c1cccnc1 Amb9429025 [0,0,0,0,0,0|3,0,0]=3 123 B12R1.34 CCC(N)C(O)c1cnccn1 Amb29875500 [0,0,0,0,0,0|4,0,0]=4 124 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,0,0,0,0,0|2,0,2]=4 125 B12R1.34 CCC(O)C(C)c1ccncc1 Amb27647403 [0,0,0,0,0,0|4,0,0]=4 126 B12R1.34 CCC(O)C(N)c1ccccn1 Amb27857528 [0,0,0,0,0,0|4,0,0]=4 127 B12R1.34 CCC(O)C(N)c1ccncc1 Amb27763667 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.34 CCC(O)C(O)c1ccccc1 Amb27163573 [0,0,0,0,0,0|2,0,0]=2 129 B12R1.34 CCC(O)[C@H](C)c1ccccc1 Amb27981671 [0,0,0,0,0,0|3,0,0]=3 130 B12R1.34 CCN(C)C(=N)c1ccccc1 Amb28253999 [0,0,0,0,0,0|3,0,1]=4 131 B12R1.34 CCS(=O)C(C)c1ccccc1 Amb28063578 [0,0,0,0,0,0|4,0,0]=4 132 B12R1.34 CC[C@@H](C)[C@@H](N)c1ncccn1 Amb32716288 [0,0,0,0,0,0|4,0,0]=4 133 B12R1.34 CC[C@@H](C)[C@H](O)c1ccccc1 Amb28321457 [0,0,0,0,0,0|1,0,0]=1 134 B12R1.34 CC[C@@H](N)C(C)c1ccccc1 Amb29867804 [0,0,0,0,0,0|3,0,0]=3 135 B12R1.34 CC[C@@H](N)C(O)c1ccccc1 Amb35602701 [0,0,0,0,0,0|2,0,0]=2 136 B12R1.34 CC[C@@H](N)C(O)c1cccnc1 Amb35602697 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.34 CC[C@@H](N)C(O)c1cnccn1 Amb30038882 [0,0,0,0,0,0|4,0,0]=4 138 B12R1.34 CC[C@@H](N)C(O)c1cncnc1 Amb35659326 [0,0,0,0,0,0|4,0,0]=4 139 B12R1.34 CC[C@@H](N)[C@@H](O)c1ccccc1 Amb27760494 [0,0,0,0,0,0|2,0,0]=2 140 B12R1.34 CC[C@@H](N)[C@@H](O)c1cccnc1 Amb27626980 [0,0,0,0,0,0|3,0,0]=3 141 B12R1.34 CC[C@@H](N)[C@@H](O)c1cncnc1 Amb27252275 [0,0,0,0,0,0|4,0,0]=4 142 B12R1.34 CC[C@@H](N)[C@H](O)c1ccncc1 Amb27233986 [0,0,0,0,0,0|3,0,0]=3 143 B12R1.34 CC[C@@H](O)C(C)c1ccccc1 Amb29852038 [0,0,0,0,0,0|3,0,0]=3 144 B12R1.34 CC[C@@H](O)[C@@H](C)c1ccccc1 Amb27766563 [0,0,0,0,0,0|3,0,0]=3 145 B12R1.34 CC[C@@H](O)[C@@H](O)c1ccccc1 Amb28293390 [0,0,0,0,0,0|2,0,0]=2 146 B12R1.34 CC[C@@H](O)[C@H](O)c1ccccc1 Amb27835137 [0,0,0,0,0,0|2,0,0]=2 147 B12R1.34 CC[C@H](C)[C@H](N)c1ncccn1 Amb32716255 [0,0,0,0,0,0|4,0,0]=4 148 B12R1.34 CC[C@H](N)C(C)c1ccccc1 Amb29867785 [0,0,0,0,0,0|3,0,0]=3 149 B12R1.34 CC[C@H](N)C(O)c1ccccc1 Amb35601261 [0,0,0,0,0,0|2,0,0]=2 150 B12R1.34 CC[C@H](N)C(O)c1cccnc1 Amb35601299 [0,0,0,0,0,0|3,0,0]=3 151 B12R1.34 CC[C@H](N)C(O)c1cnccn1 Amb35596797 [0,0,0,0,0,0|4,0,0]=4 152 B12R1.34 CC[C@H](N)C(O)c1cncnc1 Amb35601438 [0,0,0,0,0,0|4,0,0]=4 153 B12R1.34 CC[C@H](N)[C@@H](N)c1cccnc1 Amb27489089 [0,0,0,0,0,0|4,0,0]=4 154 B12R1.34 CC[C@H](N)[C@@H](O)c1cccnc1 Amb27776956 [0,0,0,0,0,0|3,0,0]=3 155 B12R1.34 CC[C@H](N)[C@@H](O)c1ncccn1 Amb28245428 [0,0,0,0,0,0|4,0,0]=4 156 B12R1.34 CC[C@H](N)[C@H](O)c1ccccc1 Amb28121117 [0,0,0,0,0,0|2,0,0]=2 157 B12R1.34 CC[C@H](O)C(C)c1ccccc1 Amb29852039 [0,0,0,0,0,0|3,0,0]=3 158 B12R1.34 CC[C@H](O)[C@H](N)c1ccccc1 Amb28292456 [0,0,0,0,0,0|3,0,0]=3 159 B12R1.34 CC[C@H](O)[C@H](O)c1ccccc1 Amb27835888 [0,0,0,0,0,0|2,0,0]=2 160 B12R1.34 CNC(=N)C(C)c1ccccc1 Amb35715674 [0,0,0,0,0,0|2,0,1]=3 161 B12R1.34 CNC(=N)N(C)c1ccccc1 Amb18798220 [0,0,0,0,0,0|3,0,1]=4 162 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,0,0,0,0,0|1,0,3]=4 163 B12R1.34 CNC(=O)C(Br)c1ccccc1 Amb8631535 [0,0,0,0,0,0|2,0,1]=3 164 B12R1.34 CNC(=O)C(C)c1ccccc1 Amb28325026 [0,0,0,0,0,0|2,0,1]=3 165 B12R1.34 CNC(=O)C(Cl)c1ccccc1 Amb9209230 [0,0,0,0,0,0|2,0,1]=3 166 B12R1.34 CNC(=O)C(F)c1ccccc1 Amb27660594 [0,0,0,0,0,0|2,0,1]=3 167 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb33549035 [0,0,0,0,0,0|2,0,1]=3 168 B12R1.34 CNC(=O)C(N)c1ccccc1 Amb9726565 [0,0,0,0,0,0|2,0,1]=3 169 B12R1.34 CNC(=O)C(N)c1ccccn1 Amb26346573 [0,0,0,0,0,0|3,0,1]=4 170 B12R1.34 CNC(=O)C(N)c1cccnc1 Amb27615584 [0,0,0,0,0,0|3,0,1]=4 171 B12R1.34 CNC(=O)C(N)c1ccncc1 Amb24396250 [0,0,0,0,0,0|3,0,1]=4 172 B12R1.34 CNC(=O)C(O)c1ccccc1 Amb17400179 [0,0,0,0,0,0|1,0,1]=2 173 B12R1.34 CNC(=O)C(O)c1ccccn1 Amb27411454 [0,0,0,0,0,0|2,0,1]=3 174 B12R1.34 CNC(=O)C(O)c1cccnc1 Amb26883806 [0,0,0,0,0,0|2,0,1]=3 175 B12R1.34 CNC(=O)C(O)c1ccncc1 Amb24497547 [0,0,0,0,0,0|2,0,1]=3 176 B12R1.34 CNC(=O)N(O)c1ccccc1 Amb4136448 [0,0,0,0,0,0|2,0,1]=3 177 B12R1.34 CNC(=O)[C@@H](N)c1ccccc1 Amb17232478 [0,0,0,0,0,0|2,0,1]=3 178 B12R1.34 CNC(=O)[C@@H](O)c1ccccc1 Amb28398484 [0,0,0,0,0,0|1,0,1]=2 179 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,0,0,0,0,0|2,0,1]=3 180 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb32686954 [0,0,0,0,0,0|2,0,1]=3 181 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,0,0,0,0,0|1,0,1]=2 182 B12R1.34 CNC(=S)N(C)c1ccccc1 Amb2682774 [0,0,0,0,0,0|3,0,1]=4 183 B12R1.34 CNC(=S)P(C)c1ccccc1 Amb27789599 [0,0,0,0,0,0|3,0,1]=4 184 B12R1.34 CNC(C)C(=O)c1ccccc1 Amb8384820 [0,0,0,0,0,0|0,0,2]=2 185 B12R1.34 CNC(C)C(=O)c1ccccn1 Amb27172409 [0,0,0,0,0,0|1,0,2]=3 186 B12R1.34 CNC(C)C(=O)c1cccnc1 Amb26392364 [0,0,0,0,0,0|1,0,2]=3 187 B12R1.34 CNC(C)C(=O)c1ccncc1 Amb25381151 [0,0,0,0,0,0|1,0,2]=3 188 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,0,0,0,0,0|1,0,0]=1 189 B12R1.34 CNC(C)C(C)c1ccccc1 Amb33276248 [0,0,0,0,0,0|1,0,0]=1 190 B12R1.34 CNC(C)C(F)c1ccccc1 Amb27392376 [0,0,0,0,0,0|1,0,0]=1 191 B12R1.34 CNC(C)C(O)C1=CCCCC1 Amb35621619 [0,0,0,0,0,0|0,0,4]=4 192 B12R1.34 CNC(C)C(O)C1=CCCCO1 Amb29875927 [0,0,0,0,0,0|1,0,3]=4 193 B12R1.34 CNC(C)C(O)C1=COCCC1 Amb35621242 [0,0,0,0,0,0|1,0,3]=4 194 B12R1.34 CNC(C)C(O)c1ccccc1 Amb8629224 [0,0,0,0,0,0|0,0,0]=0 195 B12R1.34 CNC(C)C(O)c1cnccn1 Amb35621613 [0,0,0,0,0,0|2,0,0]=2 196 B12R1.34 CNC(C)C(O)c1cncnc1 Amb35741308 [0,0,0,0,0,0|2,0,0]=2 197 B12R1.34 CN[C@@H](C)C(=O)c1cccnc1 Amb35659710 [0,0,0,0,0,0|1,0,2]=3 198 B12R1.34 CN[C@@H](C)C(=O)c1cnccn1 Amb35659711 [0,0,0,0,0,0|2,0,2]=4 199 B12R1.34 CN[C@@H](C)C(=O)c1cncnc1 Amb35659712 [0,0,0,0,0,0|2,0,2]=4 200 B12R1.34 CN[C@@H](C)C(O)C1=CCCCC1 Amb29889813 [0,0,0,0,0,0|0,0,4]=4 201 B12R1.34 CN[C@@H](C)C(O)C1=CCCCO1 Amb30039216 [0,0,0,0,0,0|1,0,3]=4 202 B12R1.34 CN[C@@H](C)C(O)C1=COCCC1 Amb29891596 [0,0,0,0,0,0|1,0,3]=4 203 B12R1.34 CN[C@@H](C)C(O)c1cccnc1 Amb35662448 [0,0,0,0,0,0|1,0,0]=1 204 B12R1.34 CN[C@@H](C)C(O)c1cnccn1 Amb29891487 [0,0,0,0,0,0|2,0,0]=2 205 B12R1.34 CN[C@@H](C)C(O)c1cncnc1 Amb35662597 [0,0,0,0,0,0|2,0,0]=2 206 B12R1.34 CN[C@@H](C)[C@@H](F)c1ccccc1 Amb27400552 [0,0,0,0,0,0|1,0,0]=1 207 B12R1.34 CN[C@@H](C)[C@@H](O)c1ccccc1 Amb533737 [0,0,0,0,0,0|0,0,0]=0 208 B12R1.34 CN[C@@H](C)[C@H](F)c1ccccc1 Amb27441123 [0,0,0,0,0,0|1,0,0]=1 209 B12R1.34 CN[C@@H](C)[C@H](O)c1ccccc1 Amb3939358 [0,0,0,0,0,0|0,0,0]=0 210 B12R1.34 CN[C@@H](O)[C@@H](O)c1ccccc1 Amb27190916 [0,0,0,0,0,0|1,0,0]=1 211 B12R1.34 CN[C@H](C)C(=O)c1ccccc1 Amb28129791 [0,0,0,0,0,0|0,0,2]=2 212 B12R1.34 CN[C@H](C)[C@@H](F)c1ccccc1 Amb27393978 [0,0,0,0,0,0|1,0,0]=1 213 B12R1.34 CN[C@H](C)[C@H](Cl)c1ccccc1 Amb28184716 [0,0,0,0,0,0|1,0,0]=1 214 B12R1.34 CN[C@H](C)[C@H](O)c1ccccc1 Amb19133732 [0,0,0,0,0,0|0,0,0]=0 215 B12R1.34 CN[C@H](C)[C@H](O)c1ccccc1 Amb3939359 [0,0,0,0,0,0|0,0,0]=0 216 B12R1.34 CN[C@H](C)[C@H](S)c1ccccc1 Amb27430364 [0,0,0,0,0,0|0,1,0]=1 217 B12R1.34 COC(=N)C(O)c1ccccc1 Amb27953078 [0,0,0,0,0,0|2,0,1]=3 218 B12R1.34 COC(=O)C(Br)c1ccccc1 Amb3939722 [0,0,0,0,0,0|3,0,1]=4 219 B12R1.34 COC(=O)C(C)c1ccccc1 Amb16185437 [0,0,0,0,0,0|3,0,1]=4 220 B12R1.34 COC(=O)C(Cl)c1ccccc1 Amb1212399 [0,0,0,0,0,0|3,0,1]=4 221 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,0,0,0,0,0|3,0,1]=4 222 B12R1.34 COC(=O)C(N)c1ccccc1 Amb1196141 [0,0,0,0,0,0|3,0,1]=4 223 B12R1.34 COC(=O)C(N)c1ccccc1 Amb1911591 [0,0,0,0,0,0|3,0,1]=4 224 B12R1.34 COC(=O)C(O)c1ccccc1 Amb3939682 [0,0,0,0,0,0|2,0,1]=3 225 B12R1.34 COC(=O)C(O)c1ccccn1 Amb28289655 [0,0,0,0,0,0|3,0,1]=4 226 B12R1.34 COC(=O)C(O)c1cccnc1 Amb18805578 [0,0,0,0,0,0|3,0,1]=4 227 B12R1.34 COC(=O)C(O)c1cccnc1 Amb19351687 [0,0,0,0,0,0|3,0,1]=4 228 B12R1.34 COC(=O)C(O)c1ccncc1 Amb23580591 [0,0,0,0,0,0|3,0,1]=4 229 B12R1.34 COC(=O)C([NH-])c1ccccc1 Amb8439013 [0,0,0,0,0,0|3,0,1]=4 230 B12R1.34 COC(=O)C([NH3+])c1ccccc1 Amb4006043 [0,0,0,0,0,0|3,0,1]=4 231 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,0,0,0,0,0|3,0,1]=4 232 B12R1.34 COC(=O)[C@@H](Cl)c1ccccc1 Amb27984727 [0,0,0,0,0,0|3,0,1]=4 233 B12R1.34 COC(=O)[C@@H](N)c1ccccc1 Amb3941407 [0,0,0,0,0,0|3,0,1]=4 234 B12R1.34 COC(=O)[C@@H](N)c1ccccc1 Amb8627870 [0,0,0,0,0,0|3,0,1]=4 235 B12R1.34 COC(=O)[C@@H](O)c1ccccc1 Amb3939704 [0,0,0,0,0,0|2,0,1]=3 236 B12R1.34 COC(=O)[C@H](C)c1ccccc1 Amb28244200 [0,0,0,0,0,0|3,0,1]=4 237 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,0,0,0,0,0|3,0,1]=4 238 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb3940044 [0,0,0,0,0,0|3,0,1]=4 239 B12R1.34 COC(=O)[C@H](O)c1ccccc1 Amb3939671 [0,0,0,0,0,0|2,0,1]=3 240 B12R1.34 COC(C)C(O)c1cnccn1 Amb27260595 [0,0,0,0,0,0|3,0,0]=3 241 B12R1.34 COC(N)C(O)c1ccccc1 Amb28397502 [0,0,0,0,0,0|2,0,0]=2 242 B12R1.34 COC(O)[C@@H](N)c1ccccc1 Amb27625851 [0,0,0,0,0,0|3,0,0]=3 243 B12R1.34 CON(C)C(=O)c1ccccc1 Amb4037088 [0,0,0,0,0,0|2,0,2]=4 244 B12R1.34 CON(C)S(=O)c1ccccc1 Amb28383906 [0,0,0,0,0,0|3,0,1]=4 245 B12R1.34 CO[C@@H](C)[C@@H](O)c1ccccc1 Amb27615564 [0,0,0,0,0,0|1,0,0]=1 246 B12R1.34 CO[C@H](C)[C@H](N)c1ncccn1 Amb32716240 [0,0,0,0,0,0|4,0,0]=4 247 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,0,0,0,0,0|1,0,2]=3 248 B12R1.34 CSC(O)C(=O)c1ccccc1 Amb17594697 [0,0,0,0,0,0|2,0,2]=4 249 B12R1.34 C[C@@H](C#N)[C@@H](O)c1ccccc1 Amb27757193 [0,0,0,0,0,0|2,0,0]=2 250 B12R1.34 C[C@@H](CO)C(=O)c1ccccc1 Amb27599400 [0,0,0,0,0,0|2,0,2]=4 251 B12R1.34 C[C@@H](CO)N(O)c1ccccc1 Amb28188881 [0,0,0,0,0,0|3,0,0]=3 252 B12R1.34 C[C@@H](CO)[C@@H](C)c1ccccc1 Amb27178556 [0,0,0,0,0,0|3,0,0]=3 253 B12R1.34 C[C@@H](NO)[C@@H](O)c1ccccc1 Amb27770879 [0,0,0,0,0,0|1,0,0]=1 254 B12R1.34 C[C@@H](c1ccccc1)[C@@H](O)CO Amb27763660 [0,0,0,0,0,0|4,0,0]=4 255 B12R1.34 C[C@@H](c1ccccc1)[C@H](F)CO Amb27770738 [0,0,0,0,0,0|4,0,0]=4 256 B12R1.34 C[C@H](C#N)[C@@H](O)c1ccccc1 Amb27170255 [0,0,0,0,0,0|2,0,0]=2 257 B12R1.34 C[C@H](C=O)N(O)c1ccccc1 Amb27780818 [0,0,0,0,0,0|3,0,0]=3 258 B12R1.34 C[C@H](C=O)[C@@H](C)c1ccccc1 Amb28243965 [0,0,0,0,0,0|3,0,0]=3 259 B12R1.34 C[C@H](C=O)[C@H](O)c1ccccc1 Amb27873253 [0,0,0,0,0,0|2,0,0]=2 260 B12R1.34 C[C@H](CO)C(N)c1ccccc1 Amb27614720 [0,0,0,0,0,0|3,0,0]=3 261 B12R1.34 C[C@H](NN)[C@@H](O)c1ccccc1 Amb27662181 [0,0,0,0,0,0|1,0,0]=1 262 B12R1.34 C[C@H](NO)[C@@H](O)c1ccccc1 Amb28242677 [0,0,0,0,0,0|1,0,0]=1 263 B12R1.34 C[C@H](c1ccccc1)[C@@H](C)C=O Amb27193040 [0,0,0,0,0,0|3,0,0]=3 264 B12R1.34 C[C@H](c1ccccc1)[C@H](F)CO Amb27766616 [0,0,0,0,0,0|4,0,0]=4 265 B12R1.34 C[C@H](c1ccccc1)[C@H](O)C#N Amb27484775 [0,0,0,0,0,0|4,0,0]=4 266 B12R1.34 C\C(=N\O)C(Cl)c1ccccc1 Amb28436906 [0,0,0,0,0,0|2,0,2]=4 267 B12R1.34 C\C(=N\O)[C@H](O)c1ccccc1 Amb28246601 [0,0,0,0,0,0|1,0,2]=3 268 B12R1.34 C\C=C(\C)C(=O)c1ccccc1 Amb25730208 [0,0,0,0,0,0|1,0,3]=4 269 B12R1.34 C\C=C(\C)C(O)c1ccccc1 Amb27764784 [0,0,0,0,0,0|1,0,1]=2 270 B12R1.34 C\C=C(\C)C(O)c1ccccn1 Amb28188219 [0,0,0,0,0,0|2,0,1]=3 271 B12R1.34 C\N=C(/C)C(Cl)c1ccccc1 Amb28343046 [0,0,0,0,0,0|1,0,2]=3 272 B12R1.34 C\N=C(\C)C(O)c1ccccc1 Amb27761496 [0,0,0,0,0,0|0,0,2]=2 273 B12R1.34 N#CC(Br)C(Br)c1ccccc1 Amb4012475 [0,0,0,0,0,0|4,0,0]=4 274 B12R1.34 N#CC(O)C(F)c1ccccc1 Amb25320704 [0,0,0,0,0,0|4,0,0]=4 275 B12R1.34 N#CC(O)C(O)c1ccccc1 Amb27829928 [0,0,0,0,0,0|3,0,0]=3 276 B12R1.34 N#CC(O)[C@@H](N)c1ccccc1 Amb27400526 [0,0,0,0,0,0|4,0,0]=4 277 B12R1.34 N#C[C@@H](O)[C@@H](F)c1ccccc1 Amb27835111 [0,0,0,0,0,0|4,0,0]=4 278 B12R1.34 N#C[C@@H](O)[C@@H](O)c1ccccc1 Amb27651908 [0,0,0,0,0,0|3,0,0]=3 279 B12R1.34 N#C[C@H](N)[C@@H](F)c1ccccc1 Amb28135510 [0,0,0,0,0,0|4,0,0]=4 280 B12R1.34 NC(C(=O)NO)c1ccccc1 Amb2430893 [0,0,0,0,0,0|3,0,1]=4 281 B12R1.34 NC(C=O)C(O)c1cccnc1 Amb27814200 [0,0,0,0,0,0|4,0,0]=4 282 B12R1.34 NC(CO)C(N)c1ccccc1 Amb27430428 [0,0,0,0,0,0|4,0,0]=4 283 B12R1.34 NC(CO)C(O)c1ccccc1 Amb4034588 [0,0,0,0,0,0|3,0,0]=3 284 B12R1.34 NC(CO)C(O)c1ccccn1 Amb25736521 [0,0,0,0,0,0|4,0,0]=4 285 B12R1.34 NC(CO)C(O)c1ccccn1 Amb30584998 [0,0,0,0,0,0|4,0,0]=4 286 B12R1.34 NC(CO)C(O)c1cccnc1 Amb18826621 [0,0,0,0,0,0|4,0,0]=4 287 B12R1.34 NC(CO)C(O)c1cccnc1 Amb32655984 [0,0,0,0,0,0|4,0,0]=4 288 B12R1.34 NC(CO)C(O)c1ccncc1 Amb26322233 [0,0,0,0,0,0|4,0,0]=4 289 B12R1.34 NC(CO)C(O)c1ccncc1 Amb30584999 [0,0,0,0,0,0|4,0,0]=4 290 B12R1.34 NC(c1ccccc1)C(O)CO Amb18646773 [0,0,0,0,0,0|4,0,0]=4 291 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,0,0,0,0,0|3,0,0]=3 292 B12R1.34 NNC(=O)C(Cl)c1ccccc1 Amb27760517 [0,0,0,0,0,0|3,0,1]=4 293 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,0,0,0,0,0|3,0,1]=4 294 B12R1.34 NNC(=O)C(O)c1ccccc1 Amb9758540 [0,0,0,0,0,0|2,0,1]=3 295 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,0,0,0,0,0|2,0,1]=3 296 B12R1.34 NNC(=O)[C@H](N)c1ccccc1 Amb28458191 [0,0,0,0,0,0|3,0,1]=4 297 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,0,0,0,0,0|2,0,1]=3 298 B12R1.34 N[C@@H](CO)[C@@H](O)c1ccccc1 Amb6298328 [0,0,0,0,0,0|3,0,0]=3 299 B12R1.34 N[C@H](C(=O)NO)c1ccccc1 Amb27236809 [0,0,0,0,0,0|3,0,1]=4 300 B12R1.34 N[C@H](CO)[C@@H](Cl)c1ccccc1 Amb27791780 [0,0,0,0,0,0|4,0,0]=4 301 B12R1.34 N[C@H](CO)[C@H](O)c1ccccc1 Amb8515836 [0,0,0,0,0,0|3,0,0]=3 302 B12R1.34 N[C@H](c1ccccc1)[C@H](O)CO Amb27430365 [0,0,0,0,0,0|4,0,0]=4 303 B12R1.34 N\C(=N/O)C(O)c1ccccc1 Amb6371814 [0,0,0,0,0,0|2,0,2]=4 304 B12R1.34 N\C(=N\O)C(O)c1ccccc1 Amb22052910 [0,0,0,0,0,0|2,0,2]=4 305 B12R1.34 O=C(CCl)C(O)c1ccccc1 Amb27165696 [0,0,0,0,0,0|3,0,1]=4 306 B12R1.34 O=C(NCl)C(Cl)c1ccccc1 Amb27799831 [0,0,0,0,0,0|3,0,1]=4 307 B12R1.34 O=C(OS)C(O)c1ccccc1 Amb27593918 [0,0,0,0,0,0|3,0,1]=4 308 B12R1.34 O=CC(Cl)C(O)c1ccccc1 Amb27407093 [0,0,0,0,0,0|3,0,0]=3 309 B12R1.34 O=C[C@@H](O)[C@H](O)c1ccccc1 Amb27390110 [0,0,0,0,0,0|3,0,0]=3 310 B12R1.34 OC(CCl)C(F)c1ccccc1 Amb28343186 [0,0,0,0,0,0|4,0,0]=4 311 B12R1.34 OC(CF)C(F)c1ccccc1 Amb28127891 [0,0,0,0,0,0|4,0,0]=4 312 B12R1.34 OC(c1ccccc1)C(Cl)CCl Amb27623177 [0,0,0,0,0,0|3,0,0]=3 313 B12R1.34 OCC(Br)C(Br)c1ccccc1 Amb27393982 [0,0,0,0,0,0|4,0,0]=4 314 B12R1.34 OC[C@@H](Cl)[C@@H](O)c1ccccc1 Amb27983838 [0,0,0,0,0,0|3,0,0]=3 315 B12R1.34 OC[C@@H](O)[C@@H](O)c1ccccc1 Amb28244272 [0,0,0,0,0,0|3,0,0]=3 316 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,0,0,0,0,0|3,0,0]=3 317 B12R1.34 OC[C@H](O)[C@H](Cl)c1ccccc1 Amb27231781 [0,0,0,0,0,0|4,0,0]=4 318 B12R1.34 O[C@@H](CCl)[C@@H](F)c1ccccc1 Amb28343033 [0,0,0,0,0,0|4,0,0]=4 319 B12R1.34 O[C@@H](CF)[C@H](F)c1ccccc1 Amb27255180 [0,0,0,0,0,0|4,0,0]=4 320 B12R1.34 O[C@H](CCl)[C@H](O)c1ccccc1 Amb27657548 [0,0,0,0,0,0|3,0,0]=3 321 B12R1.34 [BH3-]NC(C)C(O)c1ccccc1 Amb28193544 [0,0,0,0,0,0|1,0,0]=1 322 B12R1.34 [C-]#[N+]C(C)C(C)c1ccccc1 Amb33081598 [0,0,0,0,0,0|1,0,2]=3 323 B12R1.34 [NH3+]C(CO)C(O)c1ccccc1 Amb33513059 [0,0,0,0,0,0|3,0,0]=3 324 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [1,0,0,0,0,0|3,0,0]=4 325 B11R1.16 C#CCC(Br)c1ccccc1 Amb27841700 [1,0,0,0,0,0|2,0,1]=4 326 B11R1.16 C#CCC(C)c1ccccc1 Amb18117214 [1,0,0,0,0,0|2,0,1]=4 327 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [1,0,0,0,0,0|2,0,1]=4 328 B11R1.16 C#CCC(N)c1ccccc1 Amb6752054 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.16 C#CCC(O)c1ccccc1 Amb2721611 [1,0,0,0,0,0|1,0,1]=3 330 B11R1.16 C#CCC(O)c1ccccn1 Amb19373060 [1,0,0,0,0,0|2,0,1]=4 331 B11R1.16 C#CCC(O)c1cccnc1 Amb22756005 [1,0,0,0,0,0|2,0,1]=4 332 B11R1.16 C#CCC(O)c1ccncc1 Amb27402292 [1,0,0,0,0,0|2,0,1]=4 333 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb28423448 [1,0,0,0,0,0|2,0,1]=4 334 B11R1.16 C#CC[C@@H](O)c1ccccn1 Amb27658831 [1,0,0,0,0,0|2,0,1]=4 335 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb33871477 [1,0,0,0,0,0|2,0,1]=4 336 B11R1.16 C=C(CCC)c1ccccc1 Amb24669524 [1,0,0,0,0,0|2,0,1]=4 337 B11R1.16 C=C(CNN)c1ccccc1 Amb27956116 [1,0,0,0,0,0|2,0,1]=4 338 B11R1.16 C=C(COC)c1ccccc1 Amb28188323 [1,0,0,0,0,0|2,0,1]=4 339 B11R1.16 C=C=C[C@H](O)c1ccccc1 Amb27207074 [1,0,0,0,0,0|1,0,2]=4 340 B11R1.16 C=CCC(Cl)c1ccccc1 Amb27232993 [1,0,0,0,0,0|2,0,1]=4 341 B11R1.16 C=CCC(N)c1ccccc1 Amb17226687 [1,0,0,0,0,0|2,0,1]=4 342 B11R1.16 C=CCC(O)c1ccccc1 Amb2389146 [1,0,0,0,0,0|1,0,1]=3 343 B11R1.16 C=CCC(O)c1ccccn1 Amb25735233 [1,0,0,0,0,0|2,0,1]=4 344 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [1,0,0,0,0,0|2,0,1]=4 345 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [1,0,0,0,0,0|2,0,1]=4 346 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [1,0,0,0,0,0|1,0,1]=3 347 B11R1.16 C=CC[C@@H](O)c1cccnc1 Amb26978853 [1,0,0,0,0,0|2,0,1]=4 348 B11R1.16 C=CC[C@@H](O)c1ccncc1 Amb27645293 [1,0,0,0,0,0|2,0,1]=4 349 B11R1.16 C=CC[C@H](N)c1ccccc1 Amb27253729 [1,0,0,0,0,0|2,0,1]=4 350 B11R1.16 C=CC[C@H](O)c1ccccc1 Amb8392356 [1,0,0,0,0,0|1,0,1]=3 351 B11R1.16 C=CC[C@H](O)c1ccccn1 Amb28139402 [1,0,0,0,0,0|2,0,1]=4 352 B11R1.16 C=CC[C@H](O)c1cccnc1 Amb25724316 [1,0,0,0,0,0|2,0,1]=4 353 B11R1.16 C=CC[C@H](O)c1ccncc1 Amb25854958 [1,0,0,0,0,0|2,0,1]=4 354 B11R1.16 CC#CC(Cl)c1ccccc1 Amb28365466 [1,0,0,0,0,0|2,0,1]=4 355 B11R1.16 CC#C[C@H](O)c1ccccc1 Amb27981913 [1,0,0,0,0,0|1,0,1]=3 356 B11R1.16 CC(CC#N)c1ccccc1 Amb17593643 [1,0,0,0,0,0|3,0,0]=4 357 B11R1.16 CC(CC=O)c1ccccc1 Amb3372078 [1,0,0,0,0,0|3,0,0]=4 358 B11R1.16 CC(CCBr)c1ccccc1 Amb857802 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.16 CC(CCCl)c1ccccc1 Amb17232691 [1,0,0,0,0,0|3,0,0]=4 360 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [1,0,0,0,0,0|3,0,0]=4 361 B11R1.16 CC(CCN)c1ccccc1 Amb5739006 [1,0,0,0,0,0|3,0,0]=4 362 B11R1.16 CC(CCO)c1ccccc1 Amb3938966 [1,0,0,0,0,0|3,0,0]=4 363 B11R1.16 CC(CCS)c1ccccc1 Amb25866017 [1,0,0,0,0,0|3,0,0]=4 364 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [1,0,0,0,0,0|2,0,0]=3 365 B11R1.16 CC(CNN)c1ccccn1 Amb30010191 [1,0,0,0,0,0|3,0,0]=4 366 B11R1.16 CC(CNO)c1ccccc1 Amb26657287 [1,0,0,0,0,0|2,0,0]=3 367 B11R1.16 CC(CON)c1ccccc1 Amb28144909 [1,0,0,0,0,0|3,0,0]=4 368 B11R1.16 CCCC(=O)c1ccccc1 Amb4605997 [1,0,0,0,0,0|1,0,2]=4 369 B11R1.16 CCCC(Br)c1ccccc1 Amb8835450 [1,0,0,0,0,0|2,0,0]=3 370 B11R1.16 CCCC(Br)c1ccccn1 Amb25675709 [1,0,0,0,0,0|3,0,0]=4 371 B11R1.16 CCCC(C)c1ccccc1 Amb4017935 [1,0,0,0,0,0|2,0,0]=3 372 B11R1.16 CCCC(Cl)c1ccccc1 Amb7766848 [1,0,0,0,0,0|2,0,0]=3 373 B11R1.16 CCCC(N)c1ccccc1 Amb8503301 [1,0,0,0,0,0|2,0,0]=3 374 B11R1.16 CCCC(N)c1ccccc1 Amb9729508 [1,0,0,0,0,0|2,0,0]=3 375 B11R1.16 CCCC(N)c1ccccn1 Amb18984959 [1,0,0,0,0,0|3,0,0]=4 376 B11R1.16 CCCC(N)c1cccnc1 Amb18984960 [1,0,0,0,0,0|3,0,0]=4 377 B11R1.16 CCCC(N)c1ccncc1 Amb18984961 [1,0,0,0,0,0|3,0,0]=4 378 B11R1.16 CCCC(N)c1ccncc1 Amb30982091 [1,0,0,0,0,0|3,0,0]=4 379 B11R1.16 CCCC(O)c1ccccc1 Amb9748221 [1,0,0,0,0,0|1,0,0]=2 380 B11R1.16 CCCC(O)c1ccccn1 Amb18179397 [1,0,0,0,0,0|2,0,0]=3 381 B11R1.16 CCCC(O)c1cccnc1 Amb17232090 [1,0,0,0,0,0|2,0,0]=3 382 B11R1.16 CCCC(O)c1ccnnc1 Amb27210620 [1,0,0,0,0,0|3,0,0]=4 383 B11R1.16 CCCC(S)c1ccccc1 Amb9208055 [1,0,0,0,0,0|1,1,0]=3 384 B11R1.16 CCCN(C)c1ccccc1 Amb27176635 [1,0,0,0,0,0|3,0,0]=4 385 B11R1.16 CCCS(=O)c1ccccc1 Amb4013577 [1,0,0,0,0,0|2,0,1]=4 386 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb16233791 [1,0,0,0,0,0|2,0,0]=3 387 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [1,0,0,0,0,0|2,0,0]=3 388 B11R1.16 CCC[C@@H](O)c1cccnc1 Amb28069903 [1,0,0,0,0,0|2,0,0]=3 389 B11R1.16 CCC[C@@H](O)c1ccncn1 Amb28285021 [1,0,0,0,0,0|3,0,0]=4 390 B11R1.16 CCC[C@@H](O)c1cnccn1 Amb27972763 [1,0,0,0,0,0|3,0,0]=4 391 B11R1.16 CCC[C@@H](O)c1ncccn1 Amb27196897 [1,0,0,0,0,0|3,0,0]=4 392 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [1,0,0,0,0,0|2,0,0]=3 393 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [1,0,0,0,0,0|2,0,0]=3 394 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [1,0,0,0,0,0|1,0,0]=2 395 B11R1.16 CCC[C@H](O)c1ccncn1 Amb27170118 [1,0,0,0,0,0|3,0,0]=4 396 B11R1.16 CCC[C@H](O)c1cnccn1 Amb27206223 [1,0,0,0,0,0|3,0,0]=4 397 B11R1.16 CCNC(C)c1ccccc1 Amb1771733 [1,0,0,0,0,0|3,0,0]=4 398 B11R1.16 CCNC(C)c1ccccc1 Amb6537886 [1,0,0,0,0,0|3,0,0]=4 399 B11R1.16 CCN[C@@H](C)c1ccccc1 Amb27175162 [1,0,0,0,0,0|3,0,0]=4 400 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [1,0,0,0,0,0|3,0,0]=4 401 B11R1.16 CCOC(O)c1ccccc1 Amb27399654 [1,0,0,0,0,0|2,0,0]=3 402 B11R1.16 CCOC(O)c1ccncc1 Amb28321304 [1,0,0,0,0,0|3,0,0]=4 403 B11R1.16 CCSC(C)c1ccccc1 Amb28145240 [1,0,0,0,0,0|3,0,0]=4 404 B11R1.16 CNCC(=O)c1ccccc1 Amb577810 [1,0,0,0,0,0|0,0,2]=3 405 B11R1.16 CNCC(=O)c1ccccn1 Amb31094252 [1,0,0,0,0,0|1,0,2]=4 406 B11R1.16 CNCC(=O)c1cccnc1 Amb27146952 [1,0,0,0,0,0|1,0,2]=4 407 B11R1.16 CNCC(=O)c1ccncc1 Amb31094250 [1,0,0,0,0,0|1,0,2]=4 408 B11R1.16 CNCC(C)c1ccccc1 Amb17619365 [1,0,0,0,0,0|1,0,0]=2 409 B11R1.16 CNCC(C)c1ccccc1 Amb6355911 [1,0,0,0,0,0|1,0,0]=2 410 B11R1.16 CNCC(C)c1ccncc1 Amb27199701 [1,0,0,0,0,0|2,0,0]=3 411 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [1,0,0,0,0,0|1,0,0]=2 412 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [1,0,0,0,0,0|1,0,0]=2 413 B11R1.16 CNCC(O)c1ccccc1 Amb32405137 [1,0,0,0,0,0|0,0,0]=1 414 B11R1.16 CNCC(O)c1ccccc1 Amb3939362 [1,0,0,0,0,0|0,0,0]=1 415 B11R1.16 CNCC(O)c1ccccn1 Amb17138440 [1,0,0,0,0,0|1,0,0]=2 416 B11R1.16 CNCC(O)c1cccnc1 Amb17138441 [1,0,0,0,0,0|1,0,0]=2 417 B11R1.16 CNCC(O)c1cccnc1 Amb19515701 [1,0,0,0,0,0|1,0,0]=2 418 B11R1.16 CNCC(O)c1ccncc1 Amb17138442 [1,0,0,0,0,0|1,0,0]=2 419 B11R1.16 CNCC(O)c1ccncn1 Amb33269068 [1,0,0,0,0,0|2,0,0]=3 420 B11R1.16 CNCC(O)c1cnccn1 Amb26476252 [1,0,0,0,0,0|2,0,0]=3 421 B11R1.16 CNCC(O)c1cncnc1 Amb25141262 [1,0,0,0,0,0|2,0,0]=3 422 B11R1.16 CNCC(O)c1ncccn1 Amb27199745 [1,0,0,0,0,0|2,0,0]=3 423 B11R1.16 CNC[C@@H](C)c1ccccc1 Amb27253876 [1,0,0,0,0,0|1,0,0]=2 424 B11R1.16 CNC[C@@H](O)c1ccccn1 Amb28119961 [1,0,0,0,0,0|1,0,0]=2 425 B11R1.16 CNC[C@@H](O)c1cccnc1 Amb28067718 [1,0,0,0,0,0|1,0,0]=2 426 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [1,0,0,0,0,0|1,0,2]=4 427 B11R1.16 CN\C=C(\C)c1ccccc1 Amb27468700 [1,0,0,0,0,0|1,0,2]=4 428 B11R1.16 CN\N=C(/N)c1ccccc1 Amb20623020 [1,0,0,0,0,0|2,0,1]=4 429 B11R1.16 COCC(=O)c1ccccc1 Amb4605981 [1,0,0,0,0,0|1,0,2]=4 430 B11R1.16 COCC(Br)c1ccccc1 Amb27797279 [1,0,0,0,0,0|2,0,0]=3 431 B11R1.16 COCC(N)c1ccccc1 Amb1134749 [1,0,0,0,0,0|2,0,0]=3 432 B11R1.16 COCC(N)c1ccccc1 Amb13952604 [1,0,0,0,0,0|2,0,0]=3 433 B11R1.16 COCC(N)c1ccccn1 Amb10607922 [1,0,0,0,0,0|3,0,0]=4 434 B11R1.16 COCC(N)c1ccccn1 Amb13949181 [1,0,0,0,0,0|3,0,0]=4 435 B11R1.16 COCC(N)c1ccncc1 Amb27168231 [1,0,0,0,0,0|3,0,0]=4 436 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [1,0,0,0,0,0|1,0,0]=2 437 B11R1.16 COCC(O)c1ccccn1 Amb27165137 [1,0,0,0,0,0|2,0,0]=3 438 B11R1.16 COCC(O)c1ccncn1 Amb27210130 [1,0,0,0,0,0|3,0,0]=4 439 B11R1.16 COCC(O)c1ccnnc1 Amb27196895 [1,0,0,0,0,0|3,0,0]=4 440 B11R1.16 COCC(O)c1cnccn1 Amb28122566 [1,0,0,0,0,0|3,0,0]=4 441 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [1,0,0,0,0,0|1,1,0]=3 442 B11R1.16 COC[C@@H](N)c1ccccc1 Amb17061641 [1,0,0,0,0,0|2,0,0]=3 443 B11R1.16 COC[C@@H](N)c1ccccn1 Amb25104762 [1,0,0,0,0,0|3,0,0]=4 444 B11R1.16 COC[C@@H](N)c1ccccn1 Amb33620942 [1,0,0,0,0,0|3,0,0]=4 445 B11R1.16 COC[C@@H](N)c1cccnc1 Amb24351094 [1,0,0,0,0,0|3,0,0]=4 446 B11R1.16 COC[C@@H](N)c1cccnc1 Amb33804039 [1,0,0,0,0,0|3,0,0]=4 447 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [1,0,0,0,0,0|2,0,0]=3 448 B11R1.16 COC[C@H](N)c1ccccn1 Amb27493999 [1,0,0,0,0,0|3,0,0]=4 449 B11R1.16 COC[C@H](N)c1cccnc1 Amb24533043 [1,0,0,0,0,0|3,0,0]=4 450 B11R1.16 COC[C@H](N)c1cccnc1 Amb33803139 [1,0,0,0,0,0|3,0,0]=4 451 B11R1.16 COC[C@H](N)c1ccncc1 Amb28250847 [1,0,0,0,0,0|3,0,0]=4 452 B11R1.16 COC[C@H](O)c1ccccc1 Amb27410269 [1,0,0,0,0,0|1,0,0]=2 453 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [1,0,0,0,0,0|3,0,0]=4 454 B11R1.16 CSCC(=O)c1ccccc1 Amb4034487 [1,0,0,0,0,0|1,0,2]=4 455 B11R1.16 CSCC(Cl)c1ccccc1 Amb27272993 [1,0,0,0,0,0|2,0,0]=3 456 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [1,0,0,0,0,0|2,0,0]=3 457 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [1,0,0,0,0,0|1,0,0]=2 458 B11R1.16 CSC[C@H](N)c1ccccc1 Amb28397956 [1,0,0,0,0,0|2,0,0]=3 459 B11R1.16 CSC[C@H](O)c1ccccc1 Amb28077783 [1,0,0,0,0,0|1,0,0]=2 460 B11R1.16 C[C@@H](CC=O)c1ccccc1 Amb27661808 [1,0,0,0,0,0|3,0,0]=4 461 B11R1.16 C[C@@H](CCN)c1ccccc1 Amb28285355 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [1,0,0,0,0,0|3,0,0]=4 463 B11R1.16 C\C=C\C(O)c1ccccc1 Amb25887104 [1,0,0,0,0,0|1,0,1]=3 464 B11R1.16 C\C=C\[C@H](N)c1ccccc1 Amb27163147 [1,0,0,0,0,0|2,0,1]=4 465 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [1,0,0,0,0,0|3,0,0]=4 466 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [1,0,0,0,0,0|3,0,0]=4 467 B11R1.16 N#CCC(N)c1ccccc1 Amb18964887 [1,0,0,0,0,0|3,0,0]=4 468 B11R1.16 N#CCC(N)c1ccccc1 Amb20632783 [1,0,0,0,0,0|3,0,0]=4 469 B11R1.16 N#CCC(N)c1ccccc1 Amb33068991 [1,0,0,0,0,0|3,0,0]=4 470 B11R1.16 N#CCC(O)c1ccccc1 Amb4407013 [1,0,0,0,0,0|2,0,0]=3 471 B11R1.16 N#CCC(O)c1cccnc1 Amb24062545 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.16 N#CCC(O)c1ccncc1 Amb25998513 [1,0,0,0,0,0|3,0,0]=4 473 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb26346763 [1,0,0,0,0,0|3,0,0]=4 474 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb32653409 [1,0,0,0,0,0|3,0,0]=4 475 B11R1.16 N#CC[C@@H](N)c1ccccc1 Amb33212393 [1,0,0,0,0,0|3,0,0]=4 476 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [1,0,0,0,0,0|2,0,0]=3 477 B11R1.16 N#CC[C@@H](O)c1ccncc1 Amb27456747 [1,0,0,0,0,0|3,0,0]=4 478 B11R1.16 N#CC[C@H](N)c1ccccc1 Amb28398545 [1,0,0,0,0,0|3,0,0]=4 479 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [1,0,0,0,0,0|2,0,0]=3 480 B11R1.16 N#CC[C@H](O)c1cccnc1 Amb27252164 [1,0,0,0,0,0|3,0,0]=4 481 B11R1.16 NC(CC=O)c1ccccc1 Amb28122676 [1,0,0,0,0,0|3,0,0]=4 482 B11R1.16 NC(CCCl)c1ccccc1 Amb27247405 [1,0,0,0,0,0|3,0,0]=4 483 B11R1.16 NC(CCO)c1ccccc1 Amb1993953 [1,0,0,0,0,0|3,0,0]=4 484 B11R1.16 NCCC(Br)c1ccccc1 Amb27643497 [1,0,0,0,0,0|3,0,0]=4 485 B11R1.16 NCCC(F)c1ccccc1 Amb27760515 [1,0,0,0,0,0|3,0,0]=4 486 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [1,0,0,0,0,0|3,0,0]=4 487 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [1,0,0,0,0,0|2,0,0]=3 488 B11R1.16 NCCC(O)c1ccccc1 Amb9782359 [1,0,0,0,0,0|2,0,0]=3 489 B11R1.16 NCCC(O)c1ccccn1 Amb18121017 [1,0,0,0,0,0|3,0,0]=4 490 B11R1.16 NCCC(O)c1cccnc1 Amb18639338 [1,0,0,0,0,0|3,0,0]=4 491 B11R1.16 NCCC(O)c1ccncc1 Amb18121042 [1,0,0,0,0,0|3,0,0]=4 492 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [1,0,0,0,0,0|2,0,0]=3 493 B11R1.16 NCC[C@@H](O)c1ccccn1 Amb33360784 [1,0,0,0,0,0|3,0,0]=4 494 B11R1.16 NCC[C@@H](O)c1cccnc1 Amb33360063 [1,0,0,0,0,0|3,0,0]=4 495 B11R1.16 NCC[C@@H](O)c1ccncc1 Amb33225169 [1,0,0,0,0,0|3,0,0]=4 496 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [1,0,0,0,0,0|2,0,0]=3 497 B11R1.16 NCC[C@H](O)c1ccccn1 Amb33360783 [1,0,0,0,0,0|3,0,0]=4 498 B11R1.16 NCC[C@H](O)c1cccnc1 Amb33360062 [1,0,0,0,0,0|3,0,0]=4 499 B11R1.16 NCC[C@H](O)c1ccncc1 Amb33380660 [1,0,0,0,0,0|3,0,0]=4 500 B11R1.16 NNCC(O)c1ccccc1 Amb17232104 [1,0,0,0,0,0|1,0,0]=2 501 B11R1.16 NNCC(O)c1ccccn1 Amb18065400 [1,0,0,0,0,0|2,0,0]=3 502 B11R1.16 NNCC(O)c1cccnc1 Amb17232118 [1,0,0,0,0,0|2,0,0]=3 503 B11R1.16 NNCC(O)c1ccncc1 Amb18065401 [1,0,0,0,0,0|2,0,0]=3 504 B11R1.16 NOCC(O)c1ccccc1 Amb17334342 [1,0,0,0,0,0|2,0,0]=3 505 B11R1.16 N[C@@H](CCO)c1ccccc1 Amb8384290 [1,0,0,0,0,0|3,0,0]=4 506 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [1,0,0,0,0,0|3,0,0]=4 507 B11R1.16 N[C@H](CCO)c1ccccc1 Amb8397180 [1,0,0,0,0,0|3,0,0]=4 508 B11R1.16 O=CCC(O)c1ccccn1 Amb26844000 [1,0,0,0,0,0|3,0,0]=4 509 B11R1.16 O=CCC(O)c1ccncc1 Amb24434533 [1,0,0,0,0,0|3,0,0]=4 510 B11R1.16 OC(C#CBr)c1ccccc1 Amb1083115 [1,0,0,0,0,0|2,0,1]=4 511 B11R1.16 OC(CCBr)c1ccccc1 Amb26365753 [1,0,0,0,0,0|2,0,0]=3 512 B11R1.16 OC(CCCl)c1ccccc1 Amb17611064 [1,0,0,0,0,0|2,0,0]=3 513 B11R1.16 OCCC(Cl)c1ccccc1 Amb27823326 [1,0,0,0,0,0|3,0,0]=4 514 B11R1.16 OCCC(F)c1ccccc1 Amb28460703 [1,0,0,0,0,0|3,0,0]=4 515 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [1,0,0,0,0,0|2,0,0]=3 516 B11R1.16 OCCC(O)c1ccccn1 Amb22756156 [1,0,0,0,0,0|3,0,0]=4 517 B11R1.16 OCCC(O)c1cccnc1 Amb27257189 [1,0,0,0,0,0|3,0,0]=4 518 B11R1.16 OCCC(O)c1ccncc1 Amb25760239 [1,0,0,0,0,0|3,0,0]=4 519 B11R1.16 OCC[C@@H](O)c1ccccc1 Amb8516760 [1,0,0,0,0,0|2,0,0]=3 520 B11R1.16 OCC[C@@H](O)c1ccncc1 Amb27668896 [1,0,0,0,0,0|3,0,0]=4 521 B11R1.16 OCC[C@H](O)c1ccccn1 Amb27394769 [1,0,0,0,0,0|3,0,0]=4 522 B11R1.16 ONCC(O)c1ccccc1 Amb4009046 [1,0,0,0,0,0|1,0,0]=2 523 B11R1.16 ONCC(O)c1ccccn1 Amb17334345 [1,0,0,0,0,0|2,0,0]=3 524 B11R1.16 ONCC(O)c1cccnc1 Amb17334346 [1,0,0,0,0,0|2,0,0]=3 525 B11R1.16 ONCC(O)c1ccncc1 Amb17334347 [1,0,0,0,0,0|2,0,0]=3 526 B11R1.16 O[C@@H](CCCl)c1ccccc1 Amb17611058 [1,0,0,0,0,0|2,0,0]=3 527 B11R1.16 O[C@H](CCBr)c1ccccc1 Amb27437857 [1,0,0,0,0,0|2,0,0]=3 528 B11R1.16 O[C@H](CCCl)c1ccccc1 Amb2779830 [1,0,0,0,0,0|2,0,0]=3 529 B11R1.16 O[C@H](CCI)c1ccccc1 Amb27603615 [1,0,0,0,0,0|2,0,0]=3 530 B11R1.16 [C-]#[N+]CC(C)c1ccccc1 Amb2684685 [1,0,0,0,0,0|1,0,2]=4 531 B11R1.16 [C-]#[N+]CC(F)c1ccccc1 Amb27441196 [1,0,0,0,0,0|1,0,2]=4 532 B11R1.36 C=C(C)C(C)c1ccccc1 Amb27633476 [1,0,0,0,0,0|1,0,2]=4 533 B11R1.36 C=C(C)C(O)c1ccccc1 Amb10807411 [1,0,0,0,0,0|0,0,2]=3 534 B11R1.36 C=C(C)C(O)c1ccccn1 Amb27490582 [1,0,0,0,0,0|1,0,2]=4 535 B11R1.36 C=C(C)[C@@H](O)c1ccncc1 Amb27775472 [1,0,0,0,0,0|1,0,2]=4 536 B11R1.36 C=C(C)[C@H](O)c1ccccc1 Amb27486178 [1,0,0,0,0,0|0,0,2]=3 537 B11R1.36 C=C(C)[C@H](O)c1ccncc1 Amb28249157 [1,0,0,0,0,0|1,0,2]=4 538 B11R1.36 C=C(Cl)C(O)c1ccccc1 Amb27801522 [1,0,0,0,0,0|1,0,2]=4 539 B11R1.36 C=C(c1ccccc1)C(C)C Amb27803525 [1,0,0,0,0,0|1,0,1]=3 540 B11R1.36 C=C(c1ccccc1)C(C)Cl Amb27407746 [1,0,0,0,0,0|2,0,1]=4 541 B11R1.36 CC(=O)C(Br)c1ccccc1 Amb16234147 [1,0,0,0,0,0|2,0,1]=4 542 B11R1.36 CC(=O)C(C)c1ccccc1 Amb17593697 [1,0,0,0,0,0|2,0,1]=4 543 B11R1.36 CC(=O)C(Cl)c1ccccc1 Amb387177 [1,0,0,0,0,0|2,0,1]=4 544 B11R1.36 CC(=O)C(F)c1ccccc1 Amb26477979 [1,0,0,0,0,0|2,0,1]=4 545 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [1,0,0,0,0,0|2,0,1]=4 546 B11R1.36 CC(=O)C(N)c1ccccc1 Amb2725723 [1,0,0,0,0,0|2,0,1]=4 547 B11R1.36 CC(=O)C(O)c1ccccc1 Amb17593725 [1,0,0,0,0,0|1,0,1]=3 548 B11R1.36 CC(=O)C(O)c1ccccn1 Amb24392468 [1,0,0,0,0,0|2,0,1]=4 549 B11R1.36 CC(=O)C(O)c1cccnc1 Amb24486339 [1,0,0,0,0,0|2,0,1]=4 550 B11R1.36 CC(=O)C(O)c1ccncc1 Amb26321275 [1,0,0,0,0,0|2,0,1]=4 551 B11R1.36 CC(=O)C(S)c1ccccc1 Amb17594139 [1,0,0,0,0,0|1,1,1]=4 552 B11R1.36 CC(=O)N(O)c1ccccc1 Amb9786754 [1,0,0,0,0,0|2,0,1]=4 553 B11R1.36 CC(=O)[C@@H](Br)c1ccccc1 Amb27176478 [1,0,0,0,0,0|2,0,1]=4 554 B11R1.36 CC(=O)[C@@H](O)c1ccccc1 Amb17619252 [1,0,0,0,0,0|1,0,1]=3 555 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [1,0,0,0,0,0|1,0,1]=3 556 B11R1.36 CC(Br)C(=O)c1ccccc1 Amb9732279 [1,0,0,0,0,0|1,0,2]=4 557 B11R1.36 CC(C(=N)N)c1ccccc1 Amb22886648 [1,0,0,0,0,0|2,0,1]=4 558 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [1,0,0,0,0,0|2,0,1]=4 559 B11R1.36 CC(C(N)=S)c1ccccc1 Amb17465747 [1,0,0,0,0,0|2,0,1]=4 560 B11R1.36 CC(C)=C(C)c1ccccc1 Amb2780673 [1,0,0,0,0,0|1,0,2]=4 561 B11R1.36 CC(C)C(=O)c1ccccc1 Amb4605986 [1,0,0,0,0,0|0,0,2]=3 562 B11R1.36 CC(C)C(=O)c1ccccn1 Amb534902 [1,0,0,0,0,0|1,0,2]=4 563 B11R1.36 CC(C)C(=O)c1cccnc1 Amb10607959 [1,0,0,0,0,0|1,0,2]=4 564 B11R1.36 CC(C)C(=O)c1ccncc1 Amb19374024 [1,0,0,0,0,0|1,0,2]=4 565 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [1,0,0,0,0,0|1,0,0]=2 566 B11R1.36 CC(C)C(Br)c1ccccn1 Amb24359282 [1,0,0,0,0,0|2,0,0]=3 567 B11R1.36 CC(C)C(C)c1ccccc1 Amb4017389 [1,0,0,0,0,0|1,0,0]=2 568 B11R1.36 CC(C)C(Cl)c1ccccc1 Amb17138646 [1,0,0,0,0,0|1,0,0]=2 569 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [1,0,0,0,0,0|1,0,0]=2 570 B11R1.36 CC(C)C(N)c1ccccc1 Amb9707459 [1,0,0,0,0,0|1,0,0]=2 571 B11R1.36 CC(C)C(N)c1ccccn1 Amb10607919 [1,0,0,0,0,0|2,0,0]=3 572 B11R1.36 CC(C)C(N)c1ccccn1 Amb13949179 [1,0,0,0,0,0|2,0,0]=3 573 B11R1.36 CC(C)C(N)c1cccnc1 Amb10607960 [1,0,0,0,0,0|2,0,0]=3 574 B11R1.36 CC(C)C(N)c1cccnc1 Amb13949194 [1,0,0,0,0,0|2,0,0]=3 575 B11R1.36 CC(C)C(N)c1ccncc1 Amb18949710 [1,0,0,0,0,0|2,0,0]=3 576 B11R1.36 CC(C)C(N)c1cncnc1 Amb18286383 [1,0,0,0,0,0|3,0,0]=4 577 B11R1.36 CC(C)C(N)c1ncccn1 Amb18281189 [1,0,0,0,0,0|3,0,0]=4 578 B11R1.36 CC(C)C(O)c1ccccc1 Amb9283581 [1,0,0,0,0,0|0,0,0]=1 579 B11R1.36 CC(C)C(O)c1ccccn1 Amb13952167 [1,0,0,0,0,0|1,0,0]=2 580 B11R1.36 CC(C)C(O)c1ccncc1 Amb18179396 [1,0,0,0,0,0|1,0,0]=2 581 B11R1.36 CC(C)C(O)c1ncccn1 Amb18179422 [1,0,0,0,0,0|2,0,0]=3 582 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [1,0,0,0,0,0|0,1,0]=2 583 B11R1.36 CC(C)N(N)c1ccccc1 Amb18125185 [1,0,0,0,0,0|2,0,0]=3 584 B11R1.36 CC(C)S(=O)c1ccccc1 Amb24484364 [1,0,0,0,0,0|1,0,1]=3 585 B11R1.36 CC(C)[C@@H](C)c1ccccc1 Amb27445308 [1,0,0,0,0,0|1,0,0]=2 586 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb10608147 [1,0,0,0,0,0|1,0,0]=2 587 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [1,0,0,0,0,0|1,0,0]=2 588 B11R1.36 CC(C)[C@@H](N)c1ccccn1 Amb24725608 [1,0,0,0,0,0|2,0,0]=3 589 B11R1.36 CC(C)[C@@H](N)c1cccnc1 Amb24538246 [1,0,0,0,0,0|2,0,0]=3 590 B11R1.36 CC(C)[C@@H](N)c1ccncc1 Amb27639215 [1,0,0,0,0,0|2,0,0]=3 591 B11R1.36 CC(C)[C@@H](N)c1cnccn1 Amb27630546 [1,0,0,0,0,0|3,0,0]=4 592 B11R1.36 CC(C)[C@@H](N)c1ncccn1 Amb32716267 [1,0,0,0,0,0|3,0,0]=4 593 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [1,0,0,0,0,0|0,0,0]=1 594 B11R1.36 CC(C)[C@@H](O)c1cncnc1 Amb26490105 [1,0,0,0,0,0|2,0,0]=3 595 B11R1.36 CC(C)[C@H](C)c1ccccc1 Amb27816366 [1,0,0,0,0,0|1,0,0]=2 596 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [1,0,0,0,0,0|1,0,0]=2 597 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [1,0,0,0,0,0|1,0,0]=2 598 B11R1.36 CC(C)[C@H](N)c1ccccn1 Amb25719548 [1,0,0,0,0,0|2,0,0]=3 599 B11R1.36 CC(C)[C@H](N)c1cccnc1 Amb24432837 [1,0,0,0,0,0|2,0,0]=3 600 B11R1.36 CC(C)[C@H](N)c1cccnc1 Amb31291079 [1,0,0,0,0,0|2,0,0]=3 601 B11R1.36 CC(C)[C@H](N)c1ccncc1 Amb27467693 [1,0,0,0,0,0|2,0,0]=3 602 B11R1.36 CC(C)[C@H](N)c1ncccn1 Amb32716257 [1,0,0,0,0,0|3,0,0]=4 603 B11R1.36 CC(C)[C@H](O)c1ccccn1 Amb27768999 [1,0,0,0,0,0|1,0,0]=2 604 B11R1.36 CC(C)[C@H](O)c1cncnc1 Amb27829881 [1,0,0,0,0,0|2,0,0]=3 605 B11R1.36 CC(Cl)C(=O)c1ccccc1 Amb477908 [1,0,0,0,0,0|1,0,2]=4 606 B11R1.36 CC(F)C(=O)c1ccccc1 Amb10603603 [1,0,0,0,0,0|1,0,2]=4 607 B11R1.36 CC(N)C(=O)c1ccccc1 Amb6543419 [1,0,0,0,0,0|0,0,2]=3 608 B11R1.36 CC(N)C(=O)c1ccccn1 Amb18201931 [1,0,0,0,0,0|1,0,2]=4 609 B11R1.36 CC(N)C(=O)c1cccnc1 Amb18201928 [1,0,0,0,0,0|1,0,2]=4 610 B11R1.36 CC(N)C(=O)c1ccncc1 Amb18201927 [1,0,0,0,0,0|1,0,2]=4 611 B11R1.36 CC(N)C(C)c1ccccc1 Amb18125050 [1,0,0,0,0,0|1,0,0]=2 612 B11R1.36 CC(N)C(C)c1cccnc1 Amb18201853 [1,0,0,0,0,0|2,0,0]=3 613 B11R1.36 CC(N)C(C)c1ccncc1 Amb18201858 [1,0,0,0,0,0|2,0,0]=3 614 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [1,0,0,0,0,0|1,0,0]=2 615 B11R1.36 CC(N)C(N)c1cccnc1 Amb27467935 [1,0,0,0,0,0|2,0,0]=3 616 B11R1.36 CC(N)C(N)c1ccncc1 Amb13953208 [1,0,0,0,0,0|2,0,0]=3 617 B11R1.36 CC(N)C(O)c1ccccc1 Amb3940169 [1,0,0,0,0,0|0,0,0]=1 618 B11R1.36 CC(N)C(O)c1ccccc1 Amb4037026 [1,0,0,0,0,0|0,0,0]=1 619 B11R1.36 CC(N)C(O)c1ccncc1 Amb19373096 [1,0,0,0,0,0|1,0,0]=2 620 B11R1.36 CC(N)C(O)c1ccncc1 Amb6740242 [1,0,0,0,0,0|1,0,0]=2 621 B11R1.36 CC(N)C(O)c1cnccn1 Amb35588611 [1,0,0,0,0,0|2,0,0]=3 622 B11R1.36 CC(N)[C@@H](O)c1ccccc1 Amb27242684 [1,0,0,0,0,0|0,0,0]=1 623 B11R1.36 CC(N)[C@H](O)c1ccccc1 Amb26057134 [1,0,0,0,0,0|0,0,0]=1 624 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [1,0,0,0,0,0|1,0,2]=4 625 B11R1.36 CC(O)C(Br)c1ccccc1 Amb28241304 [1,0,0,0,0,0|2,0,0]=3 626 B11R1.36 CC(O)C(C)c1ccccc1 Amb4020076 [1,0,0,0,0,0|2,0,0]=3 627 B11R1.36 CC(O)C(C)c1cccnc1 Amb27227517 [1,0,0,0,0,0|3,0,0]=4 628 B11R1.36 CC(O)C(N)c1ccccc1 Amb28960311 [1,0,0,0,0,0|2,0,0]=3 629 B11R1.36 CC(O)C(N)c1ccccc1 Amb8854990 [1,0,0,0,0,0|2,0,0]=3 630 B11R1.36 CC(O)C(N)c1ccncc1 Amb27168210 [1,0,0,0,0,0|3,0,0]=4 631 B11R1.36 CC(O)C(O)c1ccccn1 Amb28290888 [1,0,0,0,0,0|2,0,0]=3 632 B11R1.36 CC(O)C(O)c1ccncc1 Amb27208087 [1,0,0,0,0,0|2,0,0]=3 633 B11R1.36 CC(O)C(O)c1cncnc1 Amb27656498 [1,0,0,0,0,0|3,0,0]=4 634 B11R1.36 CC(O)[C@H](N)c1cccnc1 Amb27163039 [1,0,0,0,0,0|3,0,0]=4 635 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [1,0,0,0,0,0|1,0,2]=4 636 B11R1.36 CC(c1ccccc1)N(C)C Amb4034685 [1,0,0,0,0,0|2,0,0]=3 637 B11R1.36 CC(c1ccccc1)[C@@H](C)N Amb33081804 [1,0,0,0,0,0|1,0,0]=2 638 B11R1.36 CC(c1ccccc1)[C@@H](C)O Amb26461660 [1,0,0,0,0,0|2,0,0]=3 639 B11R1.36 CC(c1ccccc1)[C@H](C)N Amb29867823 [1,0,0,0,0,0|1,0,0]=2 640 B11R1.36 CC(c1ccccc1)[C@H](C)O Amb4018956 [1,0,0,0,0,0|2,0,0]=3 641 B11R1.36 CC(c1cccnc1)[C@@H](C)N Amb33731284 [1,0,0,0,0,0|2,0,0]=3 642 B11R1.36 CC(c1cccnc1)[C@H](C)N Amb33729328 [1,0,0,0,0,0|2,0,0]=3 643 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [1,0,0,0,0,0|2,0,1]=4 644 B11R1.36 CN(C)C(=O)c1ccccc1 Amb33513268 [1,0,0,0,0,0|1,0,2]=4 645 B11R1.36 CN(C)C(=O)c1ccccc1 Amb3886594 [1,0,0,0,0,0|1,0,2]=4 646 B11R1.36 CN(C)C(=S)c1ccccc1 Amb2733763 [1,0,0,0,0,0|1,1,1]=4 647 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [1,0,0,0,0,0|2,0,0]=3 648 B11R1.36 CN(N)C(=N)c1ccccc1 Amb10870953 [1,0,0,0,0,0|2,0,1]=4 649 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [1,0,0,0,0,0|1,0,2]=4 650 B11R1.36 CN(N)C(=S)c1ccccc1 Amb26880376 [1,0,0,0,0,0|1,1,1]=4 651 B11R1.36 CS(=O)[C@@H](Cl)c1ccccc1 Amb27401935 [1,0,0,0,0,0|3,0,0]=4 652 B11R1.36 C[C@@H](Br)C(=O)c1ccccc1 Amb27176347 [1,0,0,0,0,0|1,0,2]=4 653 B11R1.36 C[C@@H](C(N)=O)c1ccccc1 Amb4166308 [1,0,0,0,0,0|2,0,1]=4 654 B11R1.36 C[C@@H](Cl)[C@H](Cl)c1ccccc1 Amb28396543 [1,0,0,0,0,0|2,0,0]=3 655 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [1,0,0,0,0,0|0,0,2]=3 656 B11R1.36 C[C@@H](N)C(=O)c1cccnc1 Amb30024811 [1,0,0,0,0,0|1,0,2]=4 657 B11R1.36 C[C@@H](N)C(O)c1ccccc1 Amb27753037 [1,0,0,0,0,0|0,0,0]=1 658 B11R1.36 C[C@@H](N)C(O)c1cccnc1 Amb35618092 [1,0,0,0,0,0|1,0,0]=2 659 B11R1.36 C[C@@H](N)C(O)c1cnccn1 Amb35738153 [1,0,0,0,0,0|2,0,0]=3 660 B11R1.36 C[C@@H](N)C(O)c1cncnc1 Amb35624296 [1,0,0,0,0,0|2,0,0]=3 661 B11R1.36 C[C@@H](N)[C@@H](F)c1ccccc1 Amb27232785 [1,0,0,0,0,0|1,0,0]=2 662 B11R1.36 C[C@@H](N)[C@@H](O)c1ccccn1 Amb28368419 [1,0,0,0,0,0|1,0,0]=2 663 B11R1.36 C[C@@H](N)[C@@H](O)c1cccnc1 Amb28055264 [1,0,0,0,0,0|1,0,0]=2 664 B11R1.36 C[C@@H](N)[C@@H](O)c1ccncc1 Amb27882675 [1,0,0,0,0,0|1,0,0]=2 665 B11R1.36 C[C@@H](N)[C@@H](O)c1ncccn1 Amb28429593 [1,0,0,0,0,0|2,0,0]=3 666 B11R1.36 C[C@@H](N)[C@H](F)c1ccccc1 Amb27858730 [1,0,0,0,0,0|1,0,0]=2 667 B11R1.36 C[C@@H](N)[C@H](O)c1cncnc1 Amb27430439 [1,0,0,0,0,0|2,0,0]=3 668 B11R1.36 C[C@@H](N)[C@H](S)c1ccccc1 Amb27626864 [1,0,0,0,0,0|0,1,0]=2 669 B11R1.36 C[C@@H](O)[C@@H](F)c1ccccc1 Amb27664239 [1,0,0,0,0,0|2,0,0]=3 670 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccn1 Amb27823281 [1,0,0,0,0,0|3,0,0]=4 671 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [1,0,0,0,0,0|2,0,0]=3 672 B11R1.36 C[C@@H](c1ccccc1)[C@@H](C)N Amb27253730 [1,0,0,0,0,0|1,0,0]=2 673 B11R1.36 C[C@@H](c1ccccc1)[C@@H](C)O Amb28256055 [1,0,0,0,0,0|2,0,0]=3 674 B11R1.36 C[C@@H](c1ccccn1)N(C)C Amb25858370 [1,0,0,0,0,0|3,0,0]=4 675 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [1,0,0,0,0,0|1,0,2]=4 676 B11R1.36 C[C@H](C(N)=O)c1ccccc1 Amb4166312 [1,0,0,0,0,0|2,0,1]=4 677 B11R1.36 C[C@H](Cl)[C@@H](F)c1ccccc1 Amb27955187 [1,0,0,0,0,0|2,0,0]=3 678 B11R1.36 C[C@H](F)[C@@H](O)c1ccccc1 Amb27220177 [1,0,0,0,0,0|1,0,0]=2 679 B11R1.36 C[C@H](N)C(=O)c1cccnc1 Amb33131781 [1,0,0,0,0,0|1,0,2]=4 680 B11R1.36 C[C@H](N)C(O)c1ccccc1 Amb27659372 [1,0,0,0,0,0|0,0,0]=1 681 B11R1.36 C[C@H](N)C(O)c1cccnc1 Amb35738409 [1,0,0,0,0,0|1,0,0]=2 682 B11R1.36 C[C@H](N)C(O)c1cnccn1 Amb35738121 [1,0,0,0,0,0|2,0,0]=3 683 B11R1.36 C[C@H](N)C(O)c1cncnc1 Amb35618409 [1,0,0,0,0,0|2,0,0]=3 684 B11R1.36 C[C@H](N)[C@@H](Br)c1ccccc1 Amb27205248 [1,0,0,0,0,0|1,0,0]=2 685 B11R1.36 C[C@H](N)[C@@H](N)c1cccnc1 Amb27473649 [1,0,0,0,0,0|2,0,0]=3 686 B11R1.36 C[C@H](N)[C@@H](N)c1ccncc1 Amb28075271 [1,0,0,0,0,0|2,0,0]=3 687 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb17619646 [1,0,0,0,0,0|0,0,0]=1 688 B11R1.36 C[C@H](N)[C@@H](O)c1cncnc1 Amb28349342 [1,0,0,0,0,0|2,0,0]=3 689 B11R1.36 C[C@H](N)[C@@H](O)c1ncccn1 Amb28140779 [1,0,0,0,0,0|2,0,0]=3 690 B11R1.36 C[C@H](N)[C@H](C)c1ccccc1 Amb28365429 [1,0,0,0,0,0|1,0,0]=2 691 B11R1.36 C[C@H](N)[C@H](N)c1ccccc1 Amb27772031 [1,0,0,0,0,0|1,0,0]=2 692 B11R1.36 C[C@H](N)[C@H](O)c1ccccc1 Amb3939345 [1,0,0,0,0,0|0,0,0]=1 693 B11R1.36 C[C@H](N)[C@H](O)c1cccnc1 Amb28326046 [1,0,0,0,0,0|1,0,0]=2 694 B11R1.36 C[C@H](N)[C@H](O)c1ccncc1 Amb27430303 [1,0,0,0,0,0|1,0,0]=2 695 B11R1.36 C[C@H](N)[C@H](O)c1cncnc1 Amb27430532 [1,0,0,0,0,0|2,0,0]=3 696 B11R1.36 C[C@H](O)[C@@H](C)c1ccccc1 Amb16210577 [1,0,0,0,0,0|2,0,0]=3 697 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [1,0,0,0,0,0|2,0,0]=3 698 B11R1.36 C[C@H](O)[C@@H](N)c1cccnc1 Amb28046815 [1,0,0,0,0,0|3,0,0]=4 699 B11R1.36 C[C@H](O)[C@H](Br)c1ccccc1 Amb27390103 [1,0,0,0,0,0|2,0,0]=3 700 B11R1.36 C[C@H](O)[C@H](N)c1ccccc1 Amb33872242 [1,0,0,0,0,0|2,0,0]=3 701 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [1,0,0,0,0,0|1,0,0]=2 702 B11R1.36 C[C@H](c1ccccc1)N(C)C Amb8516299 [1,0,0,0,0,0|2,0,0]=3 703 B11R1.36 ClC(Cl)C(Cl)c1ccccc1 Amb17835935 [1,0,0,0,0,0|3,0,0]=4 704 B11R1.36 FC(F)C(Br)c1ccccc1 Amb24664987 [1,0,0,0,0,0|3,0,0]=4 705 B11R1.36 FC(F)C(Cl)c1ccccc1 Amb24400669 [1,0,0,0,0,0|3,0,0]=4 706 B11R1.36 N=C(N)C(O)c1ccccc1 Amb19890170 [1,0,0,0,0,0|1,0,1]=3 707 B11R1.36 N=C(N)C(O)c1ccccc1 Amb6316124 [1,0,0,0,0,0|1,0,1]=3 708 B11R1.36 N=C(N)[C@@H](O)c1ccccc1 Amb22587581 [1,0,0,0,0,0|1,0,1]=3 709 B11R1.36 N=C(N)[C@H](O)c1ccccc1 Amb22587530 [1,0,0,0,0,0|1,0,1]=3 710 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [1,0,0,0,0,0|2,0,1]=4 711 B11R1.36 NC(=O)C(Cl)c1ccccc1 Amb1678054 [1,0,0,0,0,0|2,0,1]=4 712 B11R1.36 NC(=O)C(N)c1ccccc1 Amb13951330 [1,0,0,0,0,0|2,0,1]=4 713 B11R1.36 NC(=O)C(N)c1ccccc1 Amb9720012 [1,0,0,0,0,0|2,0,1]=4 714 B11R1.36 NC(=O)C(O)c1ccccc1 Amb2611605 [1,0,0,0,0,0|1,0,1]=3 715 B11R1.36 NC(=O)C(O)c1ccccn1 Amb24396108 [1,0,0,0,0,0|2,0,1]=4 716 B11R1.36 NC(=O)C(O)c1cccnc1 Amb18182774 [1,0,0,0,0,0|2,0,1]=4 717 B11R1.36 NC(=O)C(O)c1ccncc1 Amb25783931 [1,0,0,0,0,0|2,0,1]=4 718 B11R1.36 NC(=O)C(S)c1ccccc1 Amb27823310 [1,0,0,0,0,0|1,1,1]=4 719 B11R1.36 NC(=O)[C@@H](Cl)c1ccccc1 Amb28244737 [1,0,0,0,0,0|2,0,1]=4 720 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb10603128 [1,0,0,0,0,0|2,0,1]=4 721 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [1,0,0,0,0,0|2,0,1]=4 722 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [1,0,0,0,0,0|1,0,1]=3 723 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [1,0,0,0,0,0|2,0,1]=4 724 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb8392882 [1,0,0,0,0,0|2,0,1]=4 725 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [1,0,0,0,0,0|1,0,1]=3 726 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [1,0,0,0,0,0|2,0,1]=4 727 B11R1.36 NC(=S)[C@@H](O)c1ccccc1 Amb27650180 [1,0,0,0,0,0|1,0,1]=3 728 B11R1.36 NC(Cl)C(O)c1ccccc1 Amb28134966 [1,0,0,0,0,0|1,0,0]=2 729 B11R1.36 NC(c1ccccc1)C(F)Cl Amb27776949 [1,0,0,0,0,0|3,0,0]=4 730 B11R1.36 NC(c1ccccc1)C(F)F Amb28872274 [1,0,0,0,0,0|3,0,0]=4 731 B11R1.36 NC(c1ccccc1)C(F)F Amb7783757 [1,0,0,0,0,0|3,0,0]=4 732 B11R1.36 N[C@@H](c1ccccc1)C(F)F Amb24485821 [1,0,0,0,0,0|3,0,0]=4 733 B11R1.36 N[C@@H](c1ccccc1)C(F)F Amb33483668 [1,0,0,0,0,0|3,0,0]=4 734 B11R1.36 N[C@H](Cl)[C@H](O)c1ccccc1 Amb27194438 [1,0,0,0,0,0|1,0,0]=2 735 B11R1.36 N[C@H](c1ccccc1)C(F)F Amb27607103 [1,0,0,0,0,0|3,0,0]=4 736 B11R1.36 N[C@H](c1ccccc1)C(F)F Amb33483577 [1,0,0,0,0,0|3,0,0]=4 737 B11R1.36 O=C(O)C(O)c1ccccc1 Amb4018578 [1,0,0,0,0,0|2,0,1]=4 738 B11R1.36 O=C(O)C(O)c1ccccc1 Amb9703097 [1,0,0,0,0,0|2,0,1]=4 739 B11R1.36 O=C(O)[C@@H](O)c1ccccc1 Amb6354582 [1,0,0,0,0,0|2,0,1]=4 740 B11R1.36 O=C(O)[C@H](O)c1ccccc1 Amb3428495 [1,0,0,0,0,0|2,0,1]=4 741 B11R1.36 O=[PH](O)C(O)c1ccccc1 Amb21618921 [1,0,0,0,0,0|3,0,0]=4 742 B11R1.36 OC(c1ccccc1)C(Cl)Cl Amb28244940 [1,0,0,0,0,0|2,0,0]=3 743 B11R1.36 OC(c1ccccc1)C(F)F Amb19895457 [1,0,0,0,0,0|2,0,0]=3 744 B11R1.36 OC(c1ccccn1)C(F)F Amb24441352 [1,0,0,0,0,0|3,0,0]=4 745 B11R1.36 OC(c1cccnc1)C(F)F Amb25861872 [1,0,0,0,0,0|3,0,0]=4 746 B11R1.36 OC(c1ccncc1)C(F)F Amb25840862 [1,0,0,0,0,0|3,0,0]=4 747 B11R1.36 O[C@@H](c1ccccc1)C(F)F Amb24623094 [1,0,0,0,0,0|2,0,0]=3 748 B11R1.36 O[C@@H](c1ccccc1)[C@@H](F)Cl Amb27878816 [1,0,0,0,0,0|2,0,0]=3 749 B11R1.36 O[C@H](c1ccccc1)C(Cl)Cl Amb28365479 [1,0,0,0,0,0|2,0,0]=3 750 B11R1.36 O[C@H](c1ccccc1)C(F)F Amb25977650 [1,0,0,0,0,0|2,0,0]=3 751 B11R1.40 C#CC(C)Cc1ccccc1 Amb32953156 [1,0,0,0,0,0|1,0,1]=3 752 B11R1.40 C#CC(O)Cc1ccccc1 Amb8392589 [1,0,0,0,0,0|2,0,1]=4 753 B11R1.40 C#CN(C)Cc1ccccc1 Amb27654928 [1,0,0,0,0,0|2,0,1]=4 754 B11R1.40 C#C[C@H](N)Cc1ccccc1 Amb27468328 [1,0,0,0,0,0|2,0,1]=4 755 B11R1.40 C=CC(Br)Cc1ccccc1 Amb27176324 [1,0,0,0,0,0|2,0,1]=4 756 B11R1.40 C=CC(C)Cc1ccccc1 Amb25850978 [1,0,0,0,0,0|1,0,1]=3 757 B11R1.40 C=CC(C)Nc1ccccc1 Amb24122661 [1,0,0,0,0,0|2,0,1]=4 758 B11R1.40 C=CC(Cl)Cc1ccccc1 Amb28056812 [1,0,0,0,0,0|2,0,1]=4 759 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,0,0,0,0,0|2,0,1]=4 760 B11R1.40 C=CN(C)Cc1ccccc1 Amb27777024 [1,0,0,0,0,0|2,0,1]=4 761 B11R1.40 C=C[C@@H](C)Nc1ccccc1 Amb28241123 [1,0,0,0,0,0|2,0,1]=4 762 B11R1.40 C=C[C@@H](N)Cc1ccccc1 Amb10982592 [1,0,0,0,0,0|2,0,1]=4 763 B11R1.40 C=C[C@H](C)Nc1ccccc1 Amb27596585 [1,0,0,0,0,0|2,0,1]=4 764 B11R1.40 CC(C#N)Cc1ccccc1 Amb24402121 [1,0,0,0,0,0|2,0,0]=3 765 B11R1.40 CC(C#N)Nc1ccccc1 Amb17399903 [1,0,0,0,0,0|3,0,0]=4 766 B11R1.40 CC(C#N)Oc1ccccc1 Amb5780982 [1,0,0,0,0,0|3,0,0]=4 767 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [1,0,0,0,0,0|3,0,0]=4 768 B11R1.40 CC(C=O)Cc1ccccc1 Amb4035446 [1,0,0,0,0,0|2,0,0]=3 769 B11R1.40 CC(C=O)Cc1ccccn1 Amb28196427 [1,0,0,0,0,0|3,0,0]=4 770 B11R1.40 CC(C=O)Cc1cccnc1 Amb27629255 [1,0,0,0,0,0|3,0,0]=4 771 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [1,0,0,0,0,0|3,0,0]=4 772 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [1,0,0,0,0,0|3,0,0]=4 773 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [1,0,0,0,0,0|2,0,0]=3 774 B11R1.40 CC(CBr)Oc1ccccc1 Amb17241866 [1,0,0,0,0,0|3,0,0]=4 775 B11R1.40 CC(CCl)Cc1ccccc1 Amb17477588 [1,0,0,0,0,0|2,0,0]=3 776 B11R1.40 CC(CCl)Oc1ccccc1 Amb17232796 [1,0,0,0,0,0|3,0,0]=4 777 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [1,0,0,0,0,0|2,0,0]=3 778 B11R1.40 CC(CN)Cc1ccccc1 Amb5743836 [1,0,0,0,0,0|2,0,0]=3 779 B11R1.40 CC(CN)Cc1ccccn1 Amb5743833 [1,0,0,0,0,0|3,0,0]=4 780 B11R1.40 CC(CN)Cc1cccnc1 Amb5743834 [1,0,0,0,0,0|3,0,0]=4 781 B11R1.40 CC(CN)Cc1ccncc1 Amb5743835 [1,0,0,0,0,0|3,0,0]=4 782 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [1,0,0,0,0,0|3,0,0]=4 783 B11R1.40 CC(CN)Oc1ccccc1 Amb3938897 [1,0,0,0,0,0|3,0,0]=4 784 B11R1.40 CC(CN)Oc1ccccc1 Amb6365930 [1,0,0,0,0,0|3,0,0]=4 785 B11R1.40 CC(CN)Sc1ccccc1 Amb17485971 [1,0,0,0,0,0|3,0,0]=4 786 B11R1.40 CC(CO)Cc1ccccc1 Amb17477578 [1,0,0,0,0,0|2,0,0]=3 787 B11R1.40 CC(CO)Cc1ccccn1 Amb33745069 [1,0,0,0,0,0|3,0,0]=4 788 B11R1.40 CC(CO)Cc1cccnc1 Amb28350489 [1,0,0,0,0,0|3,0,0]=4 789 B11R1.40 CC(CO)Cc1ccncc1 Amb25374015 [1,0,0,0,0,0|3,0,0]=4 790 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [1,0,0,0,0,0|3,0,0]=4 791 B11R1.40 CC(CO)Oc1ccccc1 Amb17232100 [1,0,0,0,0,0|3,0,0]=4 792 B11R1.40 CC(Cc1ccccc1)NN Amb31156530 [1,0,0,0,0,0|1,0,0]=2 793 B11R1.40 CC(Cc1ccccc1)NN Amb4136392 [1,0,0,0,0,0|1,0,0]=2 794 B11R1.40 CC(Cc1ccccc1)ON Amb32952996 [1,0,0,0,0,0|2,0,0]=3 795 B11R1.40 CC(Cc1ccccn1)NN Amb27976484 [1,0,0,0,0,0|2,0,0]=3 796 B11R1.40 CC(Cc1ccncc1)NN Amb27493950 [1,0,0,0,0,0|2,0,0]=3 797 B11R1.40 CCC(=O)Cc1ccccc1 Amb4605994 [1,0,0,0,0,0|2,0,1]=4 798 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,0,0,0,0,0|2,0,0]=3 799 B11R1.40 CCC(Br)Cc1ccccn1 Amb28285520 [1,0,0,0,0,0|3,0,0]=4 800 B11R1.40 CCC(Br)Cc1ccncc1 Amb24353281 [1,0,0,0,0,0|3,0,0]=4 801 B11R1.40 CCC(Br)Cc1ccncc1 Amb32758727 [1,0,0,0,0,0|3,0,0]=4 802 B11R1.40 CCC(C)Nc1ccccc1 Amb4017601 [1,0,0,0,0,0|2,0,0]=3 803 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [1,0,0,0,0,0|2,0,0]=3 804 B11R1.40 CCC(C)Oc1cccnc1 Amb27432375 [1,0,0,0,0,0|3,0,0]=4 805 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [1,0,0,0,0,0|2,0,0]=3 806 B11R1.40 CCC(C)Sc1ccncc1 Amb27840194 [1,0,0,0,0,0|3,0,0]=4 807 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,0,0,0,0,0|2,0,0]=3 808 B11R1.40 CCC(Cl)Cc1ccncc1 Amb17477712 [1,0,0,0,0,0|3,0,0]=4 809 B11R1.40 CCC(N)Cc1ccccc1 Amb9428866 [1,0,0,0,0,0|2,0,0]=3 810 B11R1.40 CCC(N)Cc1ccccn1 Amb7772139 [1,0,0,0,0,0|3,0,0]=4 811 B11R1.40 CCC(N)Cc1cccnc1 Amb9428899 [1,0,0,0,0,0|3,0,0]=4 812 B11R1.40 CCC(N)Cc1ccncc1 Amb9428894 [1,0,0,0,0,0|3,0,0]=4 813 B11R1.40 CCC(O)Cc1ccccc1 Amb4035173 [1,0,0,0,0,0|2,0,0]=3 814 B11R1.40 CCC(O)Cc1ccccn1 Amb17477703 [1,0,0,0,0,0|3,0,0]=4 815 B11R1.40 CCC(O)Cc1ccncc1 Amb17477704 [1,0,0,0,0,0|3,0,0]=4 816 B11R1.40 CCC(S)Cc1ccccc1 Amb26868958 [1,0,0,0,0,0|2,0,0]=3 817 B11R1.40 CCN(C)Cc1cccnc1 Amb26606819 [1,0,0,0,0,0|3,0,0]=4 818 B11R1.40 CCN(N)Cc1ccccc1 Amb17232076 [1,0,0,0,0,0|3,0,0]=4 819 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,0,0,0,0,0|2,0,0]=3 820 B11R1.40 CC[C@@H](N)Cc1ccccn1 Amb27471046 [1,0,0,0,0,0|3,0,0]=4 821 B11R1.40 CC[C@@H](N)Cc1ccncc1 Amb27945734 [1,0,0,0,0,0|3,0,0]=4 822 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,0,0,0,0,0|2,0,0]=3 823 B11R1.40 CC[C@H](C)Cc1ccccc1 Amb25892475 [1,0,0,0,0,0|1,0,0]=2 824 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,0,0,0,0,0|2,0,0]=3 825 B11R1.40 CC[C@H](O)Cc1ccccc1 Amb27803759 [1,0,0,0,0,0|2,0,0]=3 826 B11R1.40 CC\C(C)=C/c1ccccc1 Amb22546773 [1,0,0,0,0,0|1,0,2]=4 827 B11R1.40 CC\C(C)=C\c1ccccc1 Amb4034910 [1,0,0,0,0,0|1,0,2]=4 828 B11R1.40 CN(C#N)Cc1ccccc1 Amb25072835 [1,0,0,0,0,0|3,0,0]=4 829 B11R1.40 CN(C=O)Cc1ccccc1 Amb27795680 [1,0,0,0,0,0|3,0,0]=4 830 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [1,0,0,0,0,0|2,0,1]=4 831 B11R1.40 CNC(=N)Nc1ccccc1 Amb27656297 [1,0,0,0,0,0|2,0,1]=4 832 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [1,0,0,0,0,0|2,0,1]=4 833 B11R1.40 CNC(=O)Cc1ccccc1 Amb3099550 [1,0,0,0,0,0|1,0,1]=3 834 B11R1.40 CNC(=O)Cc1ccccn1 Amb28365941 [1,0,0,0,0,0|2,0,1]=4 835 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [1,0,0,0,0,0|2,0,1]=4 836 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [1,0,0,0,0,0|2,0,1]=4 837 B11R1.40 CNC(=O)Oc1ccccc1 Amb27212784 [1,0,0,0,0,0|2,0,1]=4 838 B11R1.40 CNC(=O)Sc1ccccc1 Amb4407856 [1,0,0,0,0,0|2,0,1]=4 839 B11R1.40 CNC(=S)Cc1ccncc1 Amb28119234 [1,0,0,0,0,0|2,0,1]=4 840 B11R1.40 CNC(=S)Nc1ccccc1 Amb6335232 [1,0,0,0,0,0|2,0,1]=4 841 B11R1.40 CNC(=S)Oc1ccccc1 Amb28208369 [1,0,0,0,0,0|2,0,1]=4 842 B11R1.40 CNC(C)Cc1ccccc1 Amb5735450 [1,0,0,0,0,0|0,0,0]=1 843 B11R1.40 CNC(C)Cc1ccccn1 Amb1995150 [1,0,0,0,0,0|1,0,0]=2 844 B11R1.40 CNC(C)Cc1cccnc1 Amb5735448 [1,0,0,0,0,0|1,0,0]=2 845 B11R1.40 CNC(C)Cc1ccncc1 Amb5735449 [1,0,0,0,0,0|1,0,0]=2 846 B11R1.40 CNC(C)Cc1cnccn1 Amb1995173 [1,0,0,0,0,0|2,0,0]=3 847 B11R1.40 CNC(O)Cc1ccccc1 Amb34915471 [1,0,0,0,0,0|1,0,0]=2 848 B11R1.40 CN[C@@H](C)Cc1ccccc1 Amb3939875 [1,0,0,0,0,0|0,0,0]=1 849 B11R1.40 CN[C@H](C)Cc1ccccc1 Amb8389889 [1,0,0,0,0,0|0,0,0]=1 850 B11R1.40 CN\C(C)=C\c1ccccc1 Amb32758729 [1,0,0,0,0,0|0,0,2]=3 851 B11R1.40 CN\C(C)=C\c1ccccn1 Amb28423447 [1,0,0,0,0,0|1,0,2]=4 852 B11R1.40 CN\C(C)=C\c1cccnc1 Amb27170157 [1,0,0,0,0,0|1,0,2]=4 853 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [1,0,0,0,0,0|2,0,1]=4 854 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [1,0,0,0,0,0|2,0,1]=4 855 B11R1.40 COC(=O)Cc1ccccc1 Amb6608802 [1,0,0,0,0,0|2,0,1]=4 856 B11R1.40 CON(C)Cc1ccncc1 Amb28064659 [1,0,0,0,0,0|3,0,0]=4 857 B11R1.40 CO\C(C)=C\c1ccccc1 Amb4020305 [1,0,0,0,0,0|1,0,2]=4 858 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [1,0,0,0,0,0|3,0,0]=4 859 B11R1.40 C[C@@H](CBr)Cc1ccccc1 Amb27839684 [1,0,0,0,0,0|2,0,0]=3 860 B11R1.40 C[C@@H](CCl)Cc1ccccc1 Amb28060129 [1,0,0,0,0,0|2,0,0]=3 861 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [1,0,0,0,0,0|2,0,0]=3 862 B11R1.40 C[C@@H](CN)Cc1ccccn1 Amb33727431 [1,0,0,0,0,0|3,0,0]=4 863 B11R1.40 C[C@@H](CN)Cc1cccnc1 Amb33731721 [1,0,0,0,0,0|3,0,0]=4 864 B11R1.40 C[C@@H](CN)Cc1ccncc1 Amb28313701 [1,0,0,0,0,0|3,0,0]=4 865 B11R1.40 C[C@@H](CO)Cc1ccccc1 Amb26017714 [1,0,0,0,0,0|2,0,0]=3 866 B11R1.40 C[C@@H](CO)Cc1ccccn1 Amb33735563 [1,0,0,0,0,0|3,0,0]=4 867 B11R1.40 C[C@@H](CO)Cc1cccnc1 Amb33741020 [1,0,0,0,0,0|3,0,0]=4 868 B11R1.40 C[C@@H](CO)Cc1ccncc1 Amb33735386 [1,0,0,0,0,0|3,0,0]=4 869 B11R1.40 C[C@H](CN)Cc1ccccc1 Amb27595651 [1,0,0,0,0,0|2,0,0]=3 870 B11R1.40 C[C@H](CN)Cc1ccccn1 Amb33747428 [1,0,0,0,0,0|3,0,0]=4 871 B11R1.40 C[C@H](CN)Cc1cccnc1 Amb33737491 [1,0,0,0,0,0|3,0,0]=4 872 B11R1.40 C[C@H](CN)Cc1ccncc1 Amb24745496 [1,0,0,0,0,0|3,0,0]=4 873 B11R1.40 C[C@H](CN)Oc1ccccc1 Amb27803833 [1,0,0,0,0,0|3,0,0]=4 874 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,0,0,0,0,0|2,0,0]=3 875 B11R1.40 C[C@H](CO)Cc1ccccn1 Amb33730468 [1,0,0,0,0,0|3,0,0]=4 876 B11R1.40 C[C@H](CO)Cc1cccnc1 Amb33737852 [1,0,0,0,0,0|3,0,0]=4 877 B11R1.40 C[C@H](CO)Cc1ccncc1 Amb33730461 [1,0,0,0,0,0|3,0,0]=4 878 B11R1.40 C[C@H](CO)Oc1ccccc1 Amb28182636 [1,0,0,0,0,0|3,0,0]=4 879 B11R1.40 C[SiH](CO)Cc1ccccc1 Amb27981860 [1,0,0,0,0,0|2,1,0]=4 880 B11R1.40 C\C=C(\C)Nc1ccccc1 Amb27597055 [1,0,0,0,0,0|2,0,1]=4 881 B11R1.40 C\N=C(\C)Oc1ccccc1 Amb27260339 [1,0,0,0,0,0|1,0,2]=4 882 B11R1.40 C\N=C(\N)Cc1ccccc1 Amb23569051 [1,0,0,0,0,0|1,0,2]=4 883 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [1,0,0,0,0,0|3,0,0]=4 884 B11R1.40 N#CC(Br)Cc1ccccc1 Amb1154191 [1,0,0,0,0,0|3,0,0]=4 885 B11R1.40 N#CC(Cl)Cc1ccccc1 Amb1103676 [1,0,0,0,0,0|3,0,0]=4 886 B11R1.40 N#CC(N)Cc1ccccc1 Amb6892763 [1,0,0,0,0,0|3,0,0]=4 887 B11R1.40 N#CC(N)Cc1ccccc1 Amb9707863 [1,0,0,0,0,0|3,0,0]=4 888 B11R1.40 N#C[C@@H](N)Cc1ccccc1 Amb17399902 [1,0,0,0,0,0|3,0,0]=4 889 B11R1.40 N#C[C@H](N)Cc1ccccc1 Amb26366283 [1,0,0,0,0,0|3,0,0]=4 890 B11R1.40 N=C(Cc1ccccc1)NN Amb2616207 [1,0,0,0,0,0|2,0,1]=4 891 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,0,0,0,0,0|2,0,1]=4 892 B11R1.40 NC(CBr)Cc1ccccc1 Amb26619555 [1,0,0,0,0,0|3,0,0]=4 893 B11R1.40 NC(CCl)Cc1ccccc1 Amb28076898 [1,0,0,0,0,0|3,0,0]=4 894 B11R1.40 NC(CO)Cc1ccccc1 Amb6739795 [1,0,0,0,0,0|3,0,0]=4 895 B11R1.40 NC(CS)Cc1ccccc1 Amb27401982 [1,0,0,0,0,0|3,0,0]=4 896 B11R1.40 NCC(N)Cc1ccccc1 Amb9380670 [1,0,0,0,0,0|3,0,0]=4 897 B11R1.40 NCC(O)Cc1ccccc1 Amb2697590 [1,0,0,0,0,0|3,0,0]=4 898 B11R1.40 NCC(O)Cc1ccccc1 Amb8630271 [1,0,0,0,0,0|3,0,0]=4 899 B11R1.40 NC[C@@H](N)Cc1ccccc1 Amb17619360 [1,0,0,0,0,0|3,0,0]=4 900 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [1,0,0,0,0,0|3,0,0]=4 901 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb33456886 [1,0,0,0,0,0|3,0,0]=4 902 B11R1.40 NC[C@H](N)Cc1ccccc1 Amb17619359 [1,0,0,0,0,0|3,0,0]=4 903 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [1,0,0,0,0,0|3,0,0]=4 904 B11R1.40 NNC(=O)Cc1ccccc1 Amb6355837 [1,0,0,0,0,0|2,0,1]=4 905 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb27413229 [1,0,0,0,0,0|3,0,0]=4 906 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb33624252 [1,0,0,0,0,0|3,0,0]=4 907 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb534734 [1,0,0,0,0,0|3,0,0]=4 908 B11R1.40 N[C@H](C=O)Cc1ccccc1 Amb27810784 [1,0,0,0,0,0|3,0,0]=4 909 B11R1.40 N[C@H](CBr)Cc1ccccc1 Amb25923127 [1,0,0,0,0,0|3,0,0]=4 910 B11R1.40 N[C@H](CO)Cc1ccccc1 Amb3939343 [1,0,0,0,0,0|3,0,0]=4 911 B11R1.40 O=CC(Cl)Cc1ccccc1 Amb17204312 [1,0,0,0,0,0|3,0,0]=4 912 B11R1.40 O=CC(I)Cc1ccccc1 Amb27839657 [1,0,0,0,0,0|3,0,0]=4 913 B11R1.40 O=C[C@@H](Cl)Cc1ccccc1 Amb27632499 [1,0,0,0,0,0|3,0,0]=4 914 B11R1.40 O=C[C@H](Cl)Cc1ccccc1 Amb27955251 [1,0,0,0,0,0|3,0,0]=4 915 B11R1.40 O=C[C@H](I)Cc1ccccc1 Amb28365493 [1,0,0,0,0,0|3,0,0]=4 916 B11R1.40 OC(CBr)Cc1ccccc1 Amb17595843 [1,0,0,0,0,0|3,0,0]=4 917 B11R1.40 OC(CCl)Cc1ccccc1 Amb4035193 [1,0,0,0,0,0|3,0,0]=4 918 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [1,0,0,0,0,0|3,0,0]=4 919 B11R1.40 OCC(Br)Cc1ccccc1 Amb27225418 [1,0,0,0,0,0|3,0,0]=4 920 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,0,0,0,0,0|3,0,0]=4 921 B11R1.40 OCC(O)Cc1ccccc1 Amb17593786 [1,0,0,0,0,0|3,0,0]=4 922 B11R1.40 OCC(S)Cc1ccccc1 Amb28292008 [1,0,0,0,0,0|3,0,0]=4 923 B11R1.40 OC[C@@H](Br)Cc1ccccc1 Amb26974518 [1,0,0,0,0,0|3,0,0]=4 924 B11R1.40 OC[C@@H](Cl)Cc1ccccc1 Amb25984616 [1,0,0,0,0,0|3,0,0]=4 925 B11R1.40 OC[C@H](F)Cc1ccccc1 Amb27756441 [1,0,0,0,0,0|3,0,0]=4 926 B11R1.40 O[C@@H](CBr)Cc1ccccc1 Amb28135916 [1,0,0,0,0,0|3,0,0]=4 927 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [1,0,0,0,0,0|3,0,0]=4 928 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [1,0,0,0,0,0|3,0,0]=4 929 B11R1.40 [C-]#[N+]C(C)Cc1ccccc1 Amb32953158 [1,0,0,0,0,0|0,0,2]=3 930 B11R1.40 [NH3+]C(CO)Cc1ccccc1 Amb33512954 [1,0,0,0,0,0|3,0,0]=4 931 B13R1.21 C#CC(C)C(C)c1ccc(F)cc1 Amb33273702 [0,1,0,0,0,0|2,0,1]=4 932 B13R1.21 C#C[C@H](C)[C@@H](O)c1ccc(C)cc1 Amb27662114 [0,1,0,0,0,0|1,0,1]=3 933 B13R1.21 C=C=C(C)C(O)c1ccc(Cl)cc1 Amb27451070 [0,1,0,0,0,0|1,0,2]=4 934 B13R1.21 C=C=C(C)[C@H](O)c1ccc(Cl)cc1 Amb28321252 [0,1,0,0,0,0|1,0,2]=4 935 B13R1.21 C=CC(Cl)C(O)c1ccc(C)cc1 Amb27403074 [0,1,0,0,0,0|2,0,1]=4 936 B13R1.21 C=CC(Cl)C(O)c1ccc(F)cc1 Amb27771743 [0,1,0,0,0,0|2,0,1]=4 937 B13R1.21 C=C[C@@H](C)[C@@H](O)c1ccc(C)cc1 Amb27397036 [0,1,0,0,0,0|1,0,1]=3 938 B13R1.21 C=C[C@@H](C)[C@H](O)c1ccc(C)cc1 Amb27605453 [0,1,0,0,0,0|1,0,1]=3 939 B13R1.21 C=C[C@@H](Cl)[C@@H](O)c1ccc(Cl)cc1 Amb27961356 [0,1,0,0,0,0|2,0,1]=4 940 B13R1.21 C=C[C@@H](O)[C@@H](O)c1ccc(C)cc1 Amb27617625 [0,1,0,0,0,0|2,0,1]=4 941 B13R1.21 C=C[C@H](C)[C@H](O)c1ccc(Cl)cc1 Amb28435761 [0,1,0,0,0,0|1,0,1]=3 942 B13R1.21 C=C[C@H](Cl)[C@@H](O)c1ccc(Cl)cc1 Amb27797387 [0,1,0,0,0,0|2,0,1]=4 943 B13R1.21 CC(C#N)C(C)c1ccc(F)cc1 Amb33445892 [0,1,0,0,0,0|3,0,0]=4 944 B13R1.21 CC(C#N)C(O)c1ccc(Br)cc1 Amb27466037 [0,1,0,0,0,0|2,0,0]=3 945 B13R1.21 CC(C#N)C(O)c1ccc(Cl)cc1 Amb25786005 [0,1,0,0,0,0|2,0,0]=3 946 B13R1.21 CC(C=O)C(C)c1ccc(F)cc1 Amb33273696 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.21 CC(CBr)C(C)c1ccc(F)cc1 Amb33431602 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.21 CC(CN)C(C)c1ccc(Br)cc1 Amb18728142 [0,1,0,0,0,0|3,0,0]=4 949 B13R1.21 CC(CN)C(C)c1ccc(F)cc1 Amb18192870 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.21 CC(CN)C(F)c1ccc(Br)cc1 Amb35591789 [0,1,0,0,0,0|3,0,0]=4 951 B13R1.21 CC(CN)C(O)c1ccc(Br)cc1 Amb18155764 [0,1,0,0,0,0|2,0,0]=3 952 B13R1.21 CC(CN)C(O)c1ccc(Br)cn1 Amb26080289 [0,1,0,0,0,0|3,0,0]=4 953 B13R1.21 CC(CN)C(O)c1ccc(Cl)cc1 Amb18187531 [0,1,0,0,0,0|2,0,0]=3 954 B13R1.21 CC(CN)C(O)c1ccc(Cl)cn1 Amb32694275 [0,1,0,0,0,0|3,0,0]=4 955 B13R1.21 CC(CN)C(O)c1ccc(F)cc1 Amb18823322 [0,1,0,0,0,0|2,0,0]=3 956 B13R1.21 CC(CN)C(O)c1ccc(F)cn1 Amb32694208 [0,1,0,0,0,0|3,0,0]=4 957 B13R1.21 CC(CN)C(O)c1ccc(I)cc1 Amb27592776 [0,1,0,0,0,0|2,0,0]=3 958 B13R1.21 CC(CO)C(C)c1ccc(F)cc1 Amb33748316 [0,1,0,0,0,0|3,0,0]=4 959 B13R1.21 CC(CO)C(N)c1ccc(Br)cc1 Amb27476719 [0,1,0,0,0,0|3,0,0]=4 960 B13R1.21 CC(CO)C(N)c1ccc(Br)cc1 Amb33531480 [0,1,0,0,0,0|3,0,0]=4 961 B13R1.21 CC(CO)C(N)c1ccc(F)cc1 Amb27410193 [0,1,0,0,0,0|3,0,0]=4 962 B13R1.21 CC(ON)C(C)c1ccc(F)cc1 Amb33274195 [0,1,0,0,0,0|3,0,0]=4 963 B13R1.21 CC(c1ccc(F)cc1)[C@@H](C)CN Amb33727426 [0,1,0,0,0,0|3,0,0]=4 964 B13R1.21 CC(c1ccc(F)cc1)[C@@H](C)CO Amb33735559 [0,1,0,0,0,0|3,0,0]=4 965 B13R1.21 CC(c1ccc(F)cc1)[C@H](C)CN Amb33743100 [0,1,0,0,0,0|3,0,0]=4 966 B13R1.21 CC(c1ccc(F)cc1)[C@H](C)CO Amb33730464 [0,1,0,0,0,0|3,0,0]=4 967 B13R1.21 CCC(Br)C(C)c1ccc(Br)cc1 Amb27225528 [0,1,0,0,0,0|3,0,0]=4 968 B13R1.21 CCC(C)C(=O)c1ccc(Br)cc1 Amb8850512 [0,1,0,0,0,0|1,0,2]=4 969 B13R1.21 CCC(C)C(=O)c1ccc(C)cc1 Amb9214341 [0,1,0,0,0,0|1,0,2]=4 970 B13R1.21 CCC(C)C(=O)c1ccc(N)cc1 Amb28316490 [0,1,0,0,0,0|1,0,2]=4 971 B13R1.21 CCC(C)C(Br)c1ccc(F)cc1 Amb27178990 [0,1,0,0,0,0|2,0,0]=3 972 B13R1.21 CCC(C)C(N)c1ccc(Br)cc1 Amb6279034 [0,1,0,0,0,0|2,0,0]=3 973 B13R1.21 CCC(C)C(N)c1ccc(Br)nc1 Amb28196680 [0,1,0,0,0,0|3,0,0]=4 974 B13R1.21 CCC(C)C(N)c1ccc(C)cn1 Amb27959853 [0,1,0,0,0,0|3,0,0]=4 975 B13R1.21 CCC(C)C(N)c1ccc(Cl)cc1 Amb6663522 [0,1,0,0,0,0|2,0,0]=3 976 B13R1.21 CCC(C)C(O)c1ccc(C)cc1 Amb18796057 [0,1,0,0,0,0|1,0,0]=2 977 B13R1.21 CCC(C)C(O)c1ccc(C)nn1 Amb27783485 [0,1,0,0,0,0|3,0,0]=4 978 B13R1.21 CCC(C)C(O)c1ccc(I)cc1 Amb27594192 [0,1,0,0,0,0|1,0,0]=2 979 B13R1.21 CCC(C)C(O)c1ccc(N)cc1 Amb27179241 [0,1,0,0,0,0|1,0,0]=2 980 B13R1.21 CCC(C)C(O)c1ccc(N)cn1 Amb35625123 [0,1,0,0,0,0|2,0,0]=3 981 B13R1.21 CCC(C)[C@@H](N)c1ccc(Br)cc1 Amb27637865 [0,1,0,0,0,0|2,0,0]=3 982 B13R1.21 CCC(C)[C@@H](N)c1ccc(C)cc1 Amb27195847 [0,1,0,0,0,0|2,0,0]=3 983 B13R1.21 CCC(C)[C@@H](N)c1ccc(Cl)cc1 Amb28132432 [0,1,0,0,0,0|2,0,0]=3 984 B13R1.21 CCC(C)[C@@H](N)c1ccc(I)cc1 Amb27635065 [0,1,0,0,0,0|2,0,0]=3 985 B13R1.21 CCC(C)[C@H](N)c1ccc(Br)cc1 Amb27489116 [0,1,0,0,0,0|2,0,0]=3 986 B13R1.21 CCC(C)[C@H](N)c1ccc(Br)nc1 Amb27789940 [0,1,0,0,0,0|3,0,0]=4 987 B13R1.21 CCC(C)[C@H](N)c1ccc(F)cc1 Amb28384627 [0,1,0,0,0,0|2,0,0]=3 988 B13R1.21 CCC(C)[C@H](N)c1ccc(I)cc1 Amb28055870 [0,1,0,0,0,0|2,0,0]=3 989 B13R1.21 CCC(Cl)C(C)c1ccc(Br)cc1 Amb27748783 [0,1,0,0,0,0|3,0,0]=4 990 B13R1.21 CCC(Cl)C(Cl)c1ccc(C)cc1 Amb27799859 [0,1,0,0,0,0|3,0,0]=4 991 B13R1.21 CCC(N)C(C)c1ccc(Br)cc1 Amb27951208 [0,1,0,0,0,0|3,0,0]=4 992 B13R1.21 CCC(N)C(C)c1ccc(C)cc1 Amb18195746 [0,1,0,0,0,0|3,0,0]=4 993 B13R1.21 CCC(N)C(N)c1ccc(Br)cc1 Amb28429941 [0,1,0,0,0,0|3,0,0]=4 994 B13R1.21 CCC(N)C(N)c1ccc(C)cc1 Amb27430482 [0,1,0,0,0,0|3,0,0]=4 995 B13R1.21 CCC(N)C(N)c1ccc(Cl)cc1 Amb27597097 [0,1,0,0,0,0|3,0,0]=4 996 B13R1.21 CCC(N)C(N)c1ccc(F)cc1 Amb27460212 [0,1,0,0,0,0|3,0,0]=4 997 B13R1.21 CCC(N)C(O)c1ccc(C)cn1 Amb27223240 [0,1,0,0,0,0|3,0,0]=4 998 B13R1.21 CCC(N)C(O)c1ccc(C)nc1 Amb18824369 [0,1,0,0,0,0|3,0,0]=4 999 B13R1.21 CCC(N)C(O)c1ccc(Cl)cc1 Amb32667543 [0,1,0,0,0,0|2,0,0]=3 1000 B13R1.21 CCC(N)C(O)c1ccc(Cl)cc1 Amb9429055 [0,1,0,0,0,0|2,0,0]=3 1001 B13R1.21 CCC(N)C(O)c1ccc(Cl)cn1 Amb27960717 [0,1,0,0,0,0|3,0,0]=4 1002 B13R1.21 CCC(N)C(O)c1ccc(Cl)nc1 Amb28140747 [0,1,0,0,0,0|3,0,0]=4 1003 B13R1.21 CCC(N)C(O)c1ccc(F)cn1 Amb27252245 [0,1,0,0,0,0|3,0,0]=4 1004 B13R1.21 CCC(N)C(O)c1ccc(N)nc1 Amb28326070 [0,1,0,0,0,0|3,0,0]=4 1005 B13R1.21 CCC(O)C(C)c1ccc(Br)cc1 Amb27951876 [0,1,0,0,0,0|3,0,0]=4 1006 B13R1.21 CCC(O)C(C)c1ccc(F)cc1 Amb27947781 [0,1,0,0,0,0|3,0,0]=4 1007 B13R1.21 CCC(O)C(C)c1ccc(N)cc1 Amb35622405 [0,1,0,0,0,0|3,0,0]=4 1008 B13R1.21 CCC(O)C(N)c1ccc(Br)cc1 Amb18723288 [0,1,0,0,0,0|3,0,0]=4 1009 B13R1.21 CCC(O)C(N)c1ccc(C)cc1 Amb27448833 [0,1,0,0,0,0|3,0,0]=4 1010 B13R1.21 CCC(O)C(O)c1ccc(Br)cc1 Amb35605442 [0,1,0,0,0,0|2,0,0]=3 1011 B13R1.21 CCC(O)C(O)c1ccc(F)cc1 Amb28248470 [0,1,0,0,0,0|2,0,0]=3 1012 B13R1.21 CCN(C)C(C)c1ccc(I)cc1 Amb27757050 [0,1,0,0,0,0|3,0,0]=4 1013 B13R1.21 CCN(C)C(C)c1ccc(O)cc1 Amb27449769 [0,1,0,0,0,0|3,0,0]=4 1014 B13R1.21 CC[C@@H](C)C(=O)c1ccc(N)cc1 Amb27251532 [0,1,0,0,0,0|1,0,2]=4 1015 B13R1.21 CC[C@@H](N)C(O)c1ccc(Br)cc1 Amb35659332 [0,1,0,0,0,0|2,0,0]=3 1016 B13R1.21 CC[C@@H](N)C(O)c1ccc(C)cc1 Amb35602698 [0,1,0,0,0,0|2,0,0]=3 1017 B13R1.21 CC[C@@H](N)C(O)c1ccc(C)nc1 Amb35659416 [0,1,0,0,0,0|3,0,0]=4 1018 B13R1.21 CC[C@@H](N)C(O)c1ccc(Cl)cc1 Amb35602702 [0,1,0,0,0,0|2,0,0]=3 1019 B13R1.21 CC[C@@H](N)C(O)c1ccc(F)cc1 Amb35659378 [0,1,0,0,0,0|2,0,0]=3 1020 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(C)cn1 Amb27204863 [0,1,0,0,0,0|3,0,0]=4 1021 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(O)cc1 Amb28076041 [0,1,0,0,0,0|2,0,0]=3 1022 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(O)cn1 Amb27430253 [0,1,0,0,0,0|3,0,0]=4 1023 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(C)cc1 Amb28131444 [0,1,0,0,0,0|2,0,0]=3 1024 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(F)nc1 Amb27620462 [0,1,0,0,0,0|3,0,0]=4 1025 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(Br)cc1 Amb28139568 [0,1,0,0,0,0|3,0,0]=4 1026 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(C)cc1 Amb28061303 [0,1,0,0,0,0|3,0,0]=4 1027 B13R1.21 CC[C@@H](O)[C@@H](O)c1ccc(C)cc1 Amb27486584 [0,1,0,0,0,0|2,0,0]=3 1028 B13R1.21 CC[C@H](N)C(O)c1ccc(Br)cc1 Amb35601442 [0,1,0,0,0,0|2,0,0]=3 1029 B13R1.21 CC[C@H](N)C(O)c1ccc(C)cc1 Amb35601300 [0,1,0,0,0,0|2,0,0]=3 1030 B13R1.21 CC[C@H](N)C(O)c1ccc(C)nc1 Amb35601516 [0,1,0,0,0,0|3,0,0]=4 1031 B13R1.21 CC[C@H](N)C(O)c1ccc(Cl)cc1 Amb35601167 [0,1,0,0,0,0|2,0,0]=3 1032 B13R1.21 CC[C@H](N)C(O)c1ccc(F)cc1 Amb35601264 [0,1,0,0,0,0|2,0,0]=3 1033 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(Br)cc1 Amb27430297 [0,1,0,0,0,0|3,0,0]=4 1034 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(C)cc1 Amb28055948 [0,1,0,0,0,0|3,0,0]=4 1035 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(Br)cc1 Amb27440461 [0,1,0,0,0,0|2,0,0]=3 1036 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(F)cc1 Amb28208510 [0,1,0,0,0,0|2,0,0]=3 1037 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(Br)cc1 Amb28384670 [0,1,0,0,0,0|2,0,0]=3 1038 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(Cl)cn1 Amb27964141 [0,1,0,0,0,0|3,0,0]=4 1039 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(Cl)nc1 Amb27964123 [0,1,0,0,0,0|3,0,0]=4 1040 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(F)nc1 Amb27430342 [0,1,0,0,0,0|3,0,0]=4 1041 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(N)cc1 Amb28075256 [0,1,0,0,0,0|2,0,0]=3 1042 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(C)cc1 Amb27840975 [0,1,0,0,0,0|3,0,0]=4 1043 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(I)cc1 Amb28315059 [0,1,0,0,0,0|3,0,0]=4 1044 B13R1.21 CNC(=O)C(C)c1ccc(C)cc1 Amb24440896 [0,1,0,0,0,0|2,0,1]=4 1045 B13R1.21 CNC(=O)C(C)c1ccc(Cl)cc1 Amb28255686 [0,1,0,0,0,0|2,0,1]=4 1046 B13R1.21 CNC(=O)C(Cl)c1ccc(F)cc1 Amb27172058 [0,1,0,0,0,0|2,0,1]=4 1047 B13R1.21 CNC(=O)C(N)c1ccc(Br)cc1 Amb25102382 [0,1,0,0,0,0|2,0,1]=4 1048 B13R1.21 CNC(=O)C(N)c1ccc(C)cc1 Amb26991597 [0,1,0,0,0,0|2,0,1]=4 1049 B13R1.21 CNC(=O)C(N)c1ccc(Cl)cc1 Amb27603587 [0,1,0,0,0,0|2,0,1]=4 1050 B13R1.21 CNC(=O)C(N)c1ccc(F)cc1 Amb26856863 [0,1,0,0,0,0|2,0,1]=4 1051 B13R1.21 CNC(=O)C(N)c1ccc(O)cc1 Amb27179326 [0,1,0,0,0,0|2,0,1]=4 1052 B13R1.21 CNC(=O)C(O)c1ccc(Br)cc1 Amb28317472 [0,1,0,0,0,0|1,0,1]=3 1053 B13R1.21 CNC(=O)C(O)c1ccc(C)cc1 Amb17400709 [0,1,0,0,0,0|1,0,1]=3 1054 B13R1.21 CNC(=O)C(O)c1ccc(Cl)cc1 Amb17402319 [0,1,0,0,0,0|1,0,1]=3 1055 B13R1.21 CNC(=O)C(O)c1ccc(F)cc1 Amb17400966 [0,1,0,0,0,0|1,0,1]=3 1056 B13R1.21 CNC(C)C(=O)c1ccc(Br)cc1 Amb17312906 [0,1,0,0,0,0|0,0,2]=3 1057 B13R1.21 CNC(C)C(=O)c1ccc(C)cc1 Amb18540236 [0,1,0,0,0,0|0,0,2]=3 1058 B13R1.21 CNC(C)C(=O)c1ccc(C)nc1 Amb28423091 [0,1,0,0,0,0|1,0,2]=4 1059 B13R1.21 CNC(C)C(=O)c1ccc(Cl)cc1 Amb17312952 [0,1,0,0,0,0|0,0,2]=3 1060 B13R1.21 CNC(C)C(=O)c1ccc(F)cc1 Amb17313013 [0,1,0,0,0,0|0,0,2]=3 1061 B13R1.21 CNC(C)C(=O)c1ccc(N)cc1 Amb18051421 [0,1,0,0,0,0|0,0,2]=3 1062 B13R1.21 CNC(C)C(=O)c1ccc(O)cc1 Amb27239640 [0,1,0,0,0,0|0,0,2]=3 1063 B13R1.21 CNC(C)C(C)c1ccc(Br)cc1 Amb28368126 [0,1,0,0,0,0|1,0,0]=2 1064 B13R1.21 CNC(C)C(C)c1ccc(Cl)cc1 Amb20623680 [0,1,0,0,0,0|1,0,0]=2 1065 B13R1.21 CNC(C)C(O)c1ccc(Br)cc1 Amb18071614 [0,1,0,0,0,0|0,0,0]=1 1066 B13R1.21 CNC(C)C(O)c1ccc(C)nc1 Amb35741560 [0,1,0,0,0,0|1,0,0]=2 1067 B13R1.21 CNC(C)C(O)c1ccc(Cl)cc1 Amb18066518 [0,1,0,0,0,0|0,0,0]=1 1068 B13R1.21 CNC(C)C(O)c1ccc(O)cc1 Amb28316376 [0,1,0,0,0,0|0,0,0]=1 1069 B13R1.21 CNC(C)C(O)c1ccc(O)cc1 Amb4021861 [0,1,0,0,0,0|0,0,0]=1 1070 B13R1.21 CN[C@@H](C)C(=O)c1ccc(Br)cc1 Amb35662339 [0,1,0,0,0,0|0,0,2]=3 1071 B13R1.21 CN[C@@H](C)C(=O)c1ccc(C)cc1 Amb35659958 [0,1,0,0,0,0|0,0,2]=3 1072 B13R1.21 CN[C@@H](C)C(=O)c1ccc(C)nc1 Amb35659962 [0,1,0,0,0,0|1,0,2]=4 1073 B13R1.21 CN[C@@H](C)C(=O)c1ccc(Cl)cc1 Amb29891463 [0,1,0,0,0,0|0,0,2]=3 1074 B13R1.21 CN[C@@H](C)C(=O)c1ccc(F)cc1 Amb35659967 [0,1,0,0,0,0|0,0,2]=3 1075 B13R1.21 CN[C@@H](C)C(O)c1ccc(Br)cc1 Amb35662601 [0,1,0,0,0,0|0,0,0]=1 1076 B13R1.21 CN[C@@H](C)C(O)c1ccc(C)cc1 Amb35662449 [0,1,0,0,0,0|0,0,0]=1 1077 B13R1.21 CN[C@@H](C)C(O)c1ccc(C)nc1 Amb30038956 [0,1,0,0,0,0|1,0,0]=2 1078 B13R1.21 CN[C@@H](C)C(O)c1ccc(Cl)cc1 Amb35662198 [0,1,0,0,0,0|0,0,0]=1 1079 B13R1.21 CN[C@@H](C)C(O)c1ccc(F)cc1 Amb35662349 [0,1,0,0,0,0|0,0,0]=1 1080 B13R1.21 CN[C@@H](C)[C@H](O)c1ccc(C)cc1 Amb27204880 [0,1,0,0,0,0|0,0,0]=1 1081 B13R1.21 CN[C@@H](C)[C@H](O)c1ccc(Cl)cc1 Amb27608595 [0,1,0,0,0,0|0,0,0]=1 1082 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(C)cc1 Amb27771839 [0,1,0,0,0,0|0,0,0]=1 1083 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(F)cc1 Amb26424302 [0,1,0,0,0,0|0,0,0]=1 1084 B13R1.21 CN[C@H](C)[C@@H](O)c1ccc(O)cc1 Amb27459431 [0,1,0,0,0,0|0,0,0]=1 1085 B13R1.21 CN[C@H](C)[C@H](O)c1ccc(F)cc1 Amb28429623 [0,1,0,0,0,0|0,0,0]=1 1086 B13R1.21 COC(=N)C(O)c1ccc(F)cc1 Amb28138731 [0,1,0,0,0,0|2,0,1]=4 1087 B13R1.21 COC(=O)C(O)c1ccc(Br)cc1 Amb23596562 [0,1,0,0,0,0|2,0,1]=4 1088 B13R1.21 COC(=O)C(O)c1ccc(C)cc1 Amb18809303 [0,1,0,0,0,0|2,0,1]=4 1089 B13R1.21 COC(=O)C(O)c1ccc(Cl)cc1 Amb18333892 [0,1,0,0,0,0|2,0,1]=4 1090 B13R1.21 COC(=O)C(O)c1ccc(F)cc1 Amb19068667 [0,1,0,0,0,0|2,0,1]=4 1091 B13R1.21 COC(=O)C(O)c1ccc(N)cc1 Amb28138063 [0,1,0,0,0,0|2,0,1]=4 1092 B13R1.21 COC(C)C(=O)c1ccc(Cl)cc1 Amb9665988 [0,1,0,0,0,0|1,0,2]=4 1093 B13R1.21 COC(C)C(N)c1ccc(Br)cc1 Amb18155746 [0,1,0,0,0,0|2,0,0]=3 1094 B13R1.21 COC(C)C(N)c1ccc(C)nc1 Amb28123070 [0,1,0,0,0,0|3,0,0]=4 1095 B13R1.21 COC(C)C(N)c1ccc(Cl)cc1 Amb18187532 [0,1,0,0,0,0|2,0,0]=3 1096 B13R1.21 COC(C)C(O)c1ccc(Br)cc1 Amb30021896 [0,1,0,0,0,0|1,0,0]=2 1097 B13R1.21 CSC(C)C(=O)c1ccc(Br)cc1 Amb24356936 [0,1,0,0,0,0|1,0,2]=4 1098 B13R1.21 CSC(C)C(=O)c1ccc(C)cc1 Amb18321261 [0,1,0,0,0,0|1,0,2]=4 1099 B13R1.21 CSC(C)C(=O)c1ccc(Cl)cc1 Amb26994193 [0,1,0,0,0,0|1,0,2]=4 1100 B13R1.21 CSC(C)C(=O)c1ccc(F)cc1 Amb19055166 [0,1,0,0,0,0|1,0,2]=4 1101 B13R1.21 C[C@@H](CO)[C@H](O)c1ccc(F)cc1 Amb27414008 [0,1,0,0,0,0|2,0,0]=3 1102 B13R1.21 Cc1ccc(C(C)C(C)CN)cc1 Amb18195748 [0,1,0,0,0,0|3,0,0]=4 1103 B13R1.21 Cc1ccc(C(C)C(C)CO)cc1 Amb25846204 [0,1,0,0,0,0|3,0,0]=4 1104 B13R1.21 Cc1ccc(C(C)[C@@H](C)CN)cc1 Amb33729600 [0,1,0,0,0,0|3,0,0]=4 1105 B13R1.21 Cc1ccc(C(C)[C@@H](C)CO)cc1 Amb33739355 [0,1,0,0,0,0|3,0,0]=4 1106 B13R1.21 Cc1ccc(C(C)[C@H](C)CN)cc1 Amb33727709 [0,1,0,0,0,0|3,0,0]=4 1107 B13R1.21 Cc1ccc(C(C)[C@H](C)CO)cc1 Amb33748179 [0,1,0,0,0,0|3,0,0]=4 1108 B13R1.21 Cc1ccc(C(N)C(C)CO)cc1 Amb27624306 [0,1,0,0,0,0|3,0,0]=4 1109 B13R1.21 Cc1ccc(C(O)C(C)CN)cc1 Amb18194406 [0,1,0,0,0,0|2,0,0]=3 1110 B13R1.21 Cc1ccc(C(O)C(C)CN)cn1 Amb26622747 [0,1,0,0,0,0|3,0,0]=4 1111 B13R1.21 Cc1ccc(C(O)C(C)CN)nc1 Amb27653756 [0,1,0,0,0,0|3,0,0]=4 1112 B13R1.21 N=C(NO)C(O)c1ccc(F)cc1 Amb27640193 [0,1,0,0,0,0|2,0,1]=4 1113 B13R1.21 NC(CF)C(O)c1ccc(I)cc1 Amb26346793 [0,1,0,0,0,0|3,0,0]=4 1114 B13R1.21 NC(CO)C(O)c1ccc(Br)cc1 Amb18717857 [0,1,0,0,0,0|3,0,0]=4 1115 B13R1.21 NC(CO)C(O)c1ccc(Cl)cc1 Amb26970777 [0,1,0,0,0,0|3,0,0]=4 1116 B13R1.21 NC(CO)C(O)c1ccc(Cl)cc1 Amb28556037 [0,1,0,0,0,0|3,0,0]=4 1117 B13R1.21 NC(CO)C(O)c1ccc(I)cc1 Amb27172794 [0,1,0,0,0,0|3,0,0]=4 1118 B13R1.21 NNC(=O)C(O)c1ccc(Cl)cc1 Amb2699554 [0,1,0,0,0,0|2,0,1]=4 1119 B13R1.21 N[C@@H](CO)[C@H](O)c1ccc(Cl)cc1 Amb27964202 [0,1,0,0,0,0|3,0,0]=4 1120 B13R1.21 N[C@H](CF)[C@H](O)c1ccc(I)cc1 Amb26924186 [0,1,0,0,0,0|3,0,0]=4 1121 B13R1.21 N[C@H](CO)[C@H](O)c1ccc(Br)cc1 Amb27468566 [0,1,0,0,0,0|3,0,0]=4 1122 B13R1.21 N[C@H](CO)[C@H](O)c1ccc(I)cc1 Amb22504553 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.21 Nc1ccc(C(O)C(N)CO)cc1 Amb4433959 [0,1,0,0,0,0|3,0,0]=4 1124 B13R1.21 Nc1ccc(C(O)C(O)CO)cc1 Amb1058853 [0,1,0,0,0,0|3,0,0]=4 1125 B13R1.21 Nc1ccc([C@@H](O)[C@H](N)CO)cc1 Amb22757757 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.21 Nc1ccc([C@H](O)[C@@H](N)CO)cc1 Amb533755 [0,1,0,0,0,0|3,0,0]=4 1127 B13R1.21 OCC(O)C(O)c1ccc(O)cc1 Amb27599351 [0,1,0,0,0,0|3,0,0]=4 1128 B13R1.21 OC[C@@H](O)[C@H](O)c1ccc(O)cc1 Amb27486104 [0,1,0,0,0,0|3,0,0]=4 1129 B13R1.21 [C-]#[N+]C(C)C(C)c1ccc(F)cc1 Amb33274137 [0,1,0,0,0,0|1,0,2]=4 1130 B13R1.22 C=C[C@H](C)[C@H](N)c1cccc(F)c1 Amb27404124 [0,1,0,0,0,0|2,0,1]=4 1131 B13R1.22 CC(C#N)C(O)c1cccc(Br)c1 Amb27212621 [0,1,0,0,0,0|2,0,0]=3 1132 B13R1.22 CC(C#N)C(O)c1cccc(F)c1 Amb27787606 [0,1,0,0,0,0|2,0,0]=3 1133 B13R1.22 CC(C=O)C(O)c1cccc(Cl)c1 Amb27972525 [0,1,0,0,0,0|2,0,0]=3 1134 B13R1.22 CC(CN)C(C)c1cccc(Br)c1 Amb30021559 [0,1,0,0,0,0|3,0,0]=4 1135 B13R1.22 CC(CN)C(C)c1cccc(F)c1 Amb25117804 [0,1,0,0,0,0|3,0,0]=4 1136 B13R1.22 CC(CN)C(F)c1cccc(Br)c1 Amb35641872 [0,1,0,0,0,0|3,0,0]=4 1137 B13R1.22 CC(CN)C(F)c1cccc(F)c1 Amb27602950 [0,1,0,0,0,0|3,0,0]=4 1138 B13R1.22 CC(CN)C(O)c1cccc(Br)c1 Amb24685665 [0,1,0,0,0,0|2,0,0]=3 1139 B13R1.22 CC(CN)C(O)c1cccc(Cl)c1 Amb27853969 [0,1,0,0,0,0|2,0,0]=3 1140 B13R1.22 CC(CN)C(O)c1cccc(F)c1 Amb25333845 [0,1,0,0,0,0|2,0,0]=3 1141 B13R1.22 CC(CN)C(O)c1cccc(I)c1 Amb24452359 [0,1,0,0,0,0|2,0,0]=3 1142 B13R1.22 CC(CN)C(O)c1cncc(Br)c1 Amb27587032 [0,1,0,0,0,0|3,0,0]=4 1143 B13R1.22 CC(CN)C(O)c1cncc(Cl)c1 Amb32694212 [0,1,0,0,0,0|3,0,0]=4 1144 B13R1.22 CC(CN)C(O)c1cncc(F)c1 Amb27977222 [0,1,0,0,0,0|3,0,0]=4 1145 B13R1.22 CC(CO)C(C)c1cccc(F)c1 Amb33745865 [0,1,0,0,0,0|3,0,0]=4 1146 B13R1.22 CC(CO)C(O)c1cccc(F)c1 Amb27826570 [0,1,0,0,0,0|2,0,0]=3 1147 B13R1.22 CC(c1cccc(F)c1)[C@@H](C)CN Amb33730577 [0,1,0,0,0,0|3,0,0]=4 1148 B13R1.22 CC(c1cccc(F)c1)[C@@H](C)CO Amb33747157 [0,1,0,0,0,0|3,0,0]=4 1149 B13R1.22 CC(c1cccc(F)c1)[C@H](C)CN Amb33748023 [0,1,0,0,0,0|3,0,0]=4 1150 B13R1.22 CC(c1cccc(F)c1)[C@H](C)CO Amb33744405 [0,1,0,0,0,0|3,0,0]=4 1151 B13R1.22 CCC(Br)C(C)c1cccc(Br)c1 Amb27254018 [0,1,0,0,0,0|3,0,0]=4 1152 B13R1.22 CCC(C)C(=O)c1cccc(Br)c1 Amb27668477 [0,1,0,0,0,0|1,0,2]=4 1153 B13R1.22 CCC(C)C(=O)c1cccc(Cl)c1 Amb28041298 [0,1,0,0,0,0|1,0,2]=4 1154 B13R1.22 CCC(C)C(Cl)c1cccc(Br)c1 Amb29880793 [0,1,0,0,0,0|2,0,0]=3 1155 B13R1.22 CCC(C)C(Cl)c1cccc(Cl)c1 Amb27260606 [0,1,0,0,0,0|2,0,0]=3 1156 B13R1.22 CCC(C)C(N)c1cccc(F)c1 Amb27877654 [0,1,0,0,0,0|2,0,0]=3 1157 B13R1.22 CCC(C)C(N)c1cccc(N)c1 Amb32697381 [0,1,0,0,0,0|2,0,0]=3 1158 B13R1.22 CCC(C)C(N)c1cncc(C)c1 Amb27477348 [0,1,0,0,0,0|3,0,0]=4 1159 B13R1.22 CCC(C)C(N)c1cncc(F)c1 Amb27667506 [0,1,0,0,0,0|3,0,0]=4 1160 B13R1.22 CCC(C)C(O)c1cc(C)ccn1 Amb27263574 [0,1,0,0,0,0|2,0,0]=3 1161 B13R1.22 CCC(C)C(O)c1cccc(Br)c1 Amb27947820 [0,1,0,0,0,0|1,0,0]=2 1162 B13R1.22 CCC(C)C(O)c1cccc(Cl)c1 Amb27623788 [0,1,0,0,0,0|1,0,0]=2 1163 B13R1.22 CCC(C)C(O)c1cccc(F)c1 Amb27795478 [0,1,0,0,0,0|1,0,0]=2 1164 B13R1.22 CCC(C)C(O)c1cccc(N)n1 Amb35743398 [0,1,0,0,0,0|2,0,0]=3 1165 B13R1.22 CCC(C)C(O)c1ccnc(C)c1 Amb27484244 [0,1,0,0,0,0|2,0,0]=3 1166 B13R1.22 CCC(C)C(O)c1cncc(Cl)c1 Amb28457311 [0,1,0,0,0,0|2,0,0]=3 1167 B13R1.22 CCC(C)N(C)c1cccc(C)c1 Amb27456312 [0,1,0,0,0,0|3,0,0]=4 1168 B13R1.22 CCC(C)N(C)c1cccc(F)c1 Amb27858150 [0,1,0,0,0,0|3,0,0]=4 1169 B13R1.22 CCC(C)S(=O)c1cccc(F)c1 Amb28434577 [0,1,0,0,0,0|2,0,1]=4 1170 B13R1.22 CCC(C)S(=O)c1cccc(N)c1 Amb27609099 [0,1,0,0,0,0|2,0,1]=4 1171 B13R1.22 CCC(C)[C@@H](N)c1cccc(Br)c1 Amb28055866 [0,1,0,0,0,0|2,0,0]=3 1172 B13R1.22 CCC(C)[C@@H](N)c1cccc(Br)n1 Amb27776926 [0,1,0,0,0,0|3,0,0]=4 1173 B13R1.22 CCC(C)[C@@H](N)c1cccc(I)c1 Amb28434724 [0,1,0,0,0,0|2,0,0]=3 1174 B13R1.22 CCC(C)[C@@H](N)c1cncc(Br)c1 Amb27626926 [0,1,0,0,0,0|3,0,0]=4 1175 B13R1.22 CCC(C)[C@H](N)c1cccc(Br)n1 Amb27985364 [0,1,0,0,0,0|3,0,0]=4 1176 B13R1.22 CCC(C)[C@H](N)c1cccc(C)n1 Amb27878982 [0,1,0,0,0,0|3,0,0]=4 1177 B13R1.22 CCC(C)[C@H](N)c1cccc(F)c1 Amb27789955 [0,1,0,0,0,0|2,0,0]=3 1178 B13R1.22 CCC(N)C(C)c1cccc(Br)c1 Amb18156155 [0,1,0,0,0,0|3,0,0]=4 1179 B13R1.22 CCC(N)C(C)c1cccc(C)c1 Amb18195745 [0,1,0,0,0,0|3,0,0]=4 1180 B13R1.22 CCC(N)C(C)c1cccc(F)c1 Amb28047094 [0,1,0,0,0,0|3,0,0]=4 1181 B13R1.22 CCC(N)C(N)c1cccc(I)c1 Amb28075244 [0,1,0,0,0,0|3,0,0]=4 1182 B13R1.22 CCC(N)C(O)c1cc(N)ccn1 Amb27855286 [0,1,0,0,0,0|3,0,0]=4 1183 B13R1.22 CCC(N)C(O)c1cccc(O)c1 Amb9429033 [0,1,0,0,0,0|2,0,0]=3 1184 B13R1.22 CCC(N)C(O)c1cncc(Br)c1 Amb27801920 [0,1,0,0,0,0|3,0,0]=4 1185 B13R1.22 CCC(N)C(O)c1cncc(C)c1 Amb27233937 [0,1,0,0,0,0|3,0,0]=4 1186 B13R1.22 CCC(N)C(O)c1cncc(F)c1 Amb28056130 [0,1,0,0,0,0|3,0,0]=4 1187 B13R1.22 CCC(N)C(O)c1cncc(N)c1 Amb27430384 [0,1,0,0,0,0|3,0,0]=4 1188 B13R1.22 CCC(O)C(C)c1cccc(Br)c1 Amb27618121 [0,1,0,0,0,0|3,0,0]=4 1189 B13R1.22 CCC(O)C(C)c1cccc(Cl)c1 Amb27947782 [0,1,0,0,0,0|3,0,0]=4 1190 B13R1.22 CCC(O)C(N)c1cccc(C)c1 Amb27415220 [0,1,0,0,0,0|3,0,0]=4 1191 B13R1.22 CCC(O)C(N)c1cccc(F)c1 Amb27857873 [0,1,0,0,0,0|3,0,0]=4 1192 B13R1.22 CCC(O)C(O)c1cccc(Br)c1 Amb30021902 [0,1,0,0,0,0|2,0,0]=3 1193 B13R1.22 CCC(O)C(O)c1cccc(C)c1 Amb28388241 [0,1,0,0,0,0|2,0,0]=3 1194 B13R1.22 CCC(O)C(O)c1cncc(F)c1 Amb28239262 [0,1,0,0,0,0|3,0,0]=4 1195 B13R1.22 CCN(C)C(C)c1cccc(Br)c1 Amb27665161 [0,1,0,0,0,0|3,0,0]=4 1196 B13R1.22 CCN(C)C(C)c1cccc(C)c1 Amb28282359 [0,1,0,0,0,0|3,0,0]=4 1197 B13R1.22 CCN(C)C(C)c1cccc(Cl)c1 Amb28064779 [0,1,0,0,0,0|3,0,0]=4 1198 B13R1.22 CCN(C)C(C)c1cccc(O)c1 Amb28314839 [0,1,0,0,0,0|3,0,0]=4 1199 B13R1.22 CC[C@@H](N)C(O)c1cccc(Br)c1 Amb35659336 [0,1,0,0,0,0|2,0,0]=3 1200 B13R1.22 CC[C@@H](N)C(O)c1cccc(C)c1 Amb35659374 [0,1,0,0,0,0|2,0,0]=3 1201 B13R1.22 CC[C@@H](N)C(O)c1cccc(Cl)c1 Amb35659327 [0,1,0,0,0,0|2,0,0]=3 1202 B13R1.22 CC[C@@H](N)C(O)c1cccc(F)c1 Amb35659451 [0,1,0,0,0,0|2,0,0]=3 1203 B13R1.22 CC[C@@H](N)C(O)c1cncc(C)c1 Amb35601246 [0,1,0,0,0,0|3,0,0]=4 1204 B13R1.22 CC[C@@H](N)C(O)c1cncc(F)c1 Amb35659420 [0,1,0,0,0,0|3,0,0]=4 1205 B13R1.22 CC[C@@H](N)[C@@H](O)c1cc(N)ccn1 Amb27204852 [0,1,0,0,0,0|3,0,0]=4 1206 B13R1.22 CC[C@@H](N)[C@@H](O)c1cccc(Br)c1 Amb27201425 [0,1,0,0,0,0|2,0,0]=3 1207 B13R1.22 CC[C@@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27818125 [0,1,0,0,0,0|2,0,0]=3 1208 B13R1.22 CC[C@@H](N)[C@@H](O)c1cccc(O)c1 Amb27875530 [0,1,0,0,0,0|2,0,0]=3 1209 B13R1.22 CC[C@@H](N)[C@@H](O)c1ccnc(C)c1 Amb28143207 [0,1,0,0,0,0|3,0,0]=4 1210 B13R1.22 CC[C@@H](N)[C@@H](O)c1cncc(F)c1 Amb28421921 [0,1,0,0,0,0|3,0,0]=4 1211 B13R1.22 CC[C@@H](N)[C@@H](O)c1cncc(N)c1 Amb27804075 [0,1,0,0,0,0|3,0,0]=4 1212 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(C)ccn1 Amb27848261 [0,1,0,0,0,0|3,0,0]=4 1213 B13R1.22 CC[C@@H](N)[C@H](O)c1cccc(F)c1 Amb28077235 [0,1,0,0,0,0|2,0,0]=3 1214 B13R1.22 CC[C@@H](N)[C@H](O)c1cccc(N)c1 Amb28411242 [0,1,0,0,0,0|2,0,0]=3 1215 B13R1.22 CC[C@@H](N)[C@H](O)c1cncc(C)c1 Amb27493503 [0,1,0,0,0,0|3,0,0]=4 1216 B13R1.22 CC[C@@H](O)[C@@H](N)c1cccc(C)c1 Amb27480928 [0,1,0,0,0,0|3,0,0]=4 1217 B13R1.22 CC[C@@H](O)[C@@H](N)c1cccc(I)c1 Amb27436803 [0,1,0,0,0,0|3,0,0]=4 1218 B13R1.22 CC[C@H](N)C(O)c1cccc(Br)c1 Amb35601447 [0,1,0,0,0,0|2,0,0]=3 1219 B13R1.22 CC[C@H](N)C(O)c1cccc(C)c1 Amb35601242 [0,1,0,0,0,0|2,0,0]=3 1220 B13R1.22 CC[C@H](N)C(O)c1cccc(Cl)c1 Amb35601439 [0,1,0,0,0,0|2,0,0]=3 1221 B13R1.22 CC[C@H](N)C(O)c1cccc(F)c1 Amb35601351 [0,1,0,0,0,0|2,0,0]=3 1222 B13R1.22 CC[C@H](N)C(O)c1cncc(C)c1 Amb35601478 [0,1,0,0,0,0|3,0,0]=4 1223 B13R1.22 CC[C@H](N)C(O)c1cncc(F)c1 Amb35601521 [0,1,0,0,0,0|3,0,0]=4 1224 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(F)c1 Amb27816583 [0,1,0,0,0,0|3,0,0]=4 1225 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(Br)c1 Amb27818116 [0,1,0,0,0,0|2,0,0]=3 1226 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(C)n1 Amb28208518 [0,1,0,0,0,0|3,0,0]=4 1227 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27195878 [0,1,0,0,0,0|2,0,0]=3 1228 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(Cl)n1 Amb28055947 [0,1,0,0,0,0|3,0,0]=4 1229 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(N)n1 Amb27777343 [0,1,0,0,0,0|3,0,0]=4 1230 B13R1.22 CC[C@H](N)[C@@H](O)c1cncc(C)c1 Amb27204921 [0,1,0,0,0,0|3,0,0]=4 1231 B13R1.22 CC[C@H](N)[C@@H](O)c1cncc(Cl)c1 Amb28384673 [0,1,0,0,0,0|3,0,0]=4 1232 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(C)c1 Amb28434748 [0,1,0,0,0,0|2,0,0]=3 1233 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(Cl)c1 Amb27620370 [0,1,0,0,0,0|2,0,0]=3 1234 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(N)c1 Amb27234020 [0,1,0,0,0,0|2,0,0]=3 1235 B13R1.22 CC[C@H](N)[C@H](O)c1ccnc(C)c1 Amb27493460 [0,1,0,0,0,0|3,0,0]=4 1236 B13R1.22 CC[C@H](N)[C@H](O)c1cncc(Cl)c1 Amb28245458 [0,1,0,0,0,0|3,0,0]=4 1237 B13R1.22 CC[C@H](N)[C@H](O)c1cncc(F)c1 Amb27214860 [0,1,0,0,0,0|3,0,0]=4 1238 B13R1.22 CC[C@H](N)[C@H](O)c1cncc(N)c1 Amb27875534 [0,1,0,0,0,0|3,0,0]=4 1239 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(Cl)c1 Amb28316607 [0,1,0,0,0,0|3,0,0]=4 1240 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(F)c1 Amb27858322 [0,1,0,0,0,0|3,0,0]=4 1241 B13R1.22 CNC(=O)C(C)c1cccc(F)c1 Amb28285619 [0,1,0,0,0,0|2,0,1]=4 1242 B13R1.22 CNC(=O)C(Cl)c1cccc(Br)c1 Amb28249748 [0,1,0,0,0,0|2,0,1]=4 1243 B13R1.22 CNC(=O)C(Cl)c1cccc(C)c1 Amb19083266 [0,1,0,0,0,0|2,0,1]=4 1244 B13R1.22 CNC(=O)C(N)c1cccc(Br)c1 Amb27840878 [0,1,0,0,0,0|2,0,1]=4 1245 B13R1.22 CNC(=O)C(N)c1cccc(C)c1 Amb25873323 [0,1,0,0,0,0|2,0,1]=4 1246 B13R1.22 CNC(=O)C(N)c1cccc(Cl)c1 Amb27841021 [0,1,0,0,0,0|2,0,1]=4 1247 B13R1.22 CNC(=O)C(N)c1cccc(F)c1 Amb24459874 [0,1,0,0,0,0|2,0,1]=4 1248 B13R1.22 CNC(=O)C(O)c1cccc(Br)c1 Amb24704267 [0,1,0,0,0,0|1,0,1]=3 1249 B13R1.22 CNC(=O)C(O)c1cccc(C)c1 Amb25695140 [0,1,0,0,0,0|1,0,1]=3 1250 B13R1.22 CNC(=O)C(O)c1cccc(F)c1 Amb24439436 [0,1,0,0,0,0|1,0,1]=3 1251 B13R1.22 CNC(C)C(=O)c1cccc(Br)c1 Amb26877485 [0,1,0,0,0,0|0,0,2]=3 1252 B13R1.22 CNC(C)C(=O)c1cccc(C)c1 Amb27873898 [0,1,0,0,0,0|0,0,2]=3 1253 B13R1.22 CNC(C)C(=O)c1cccc(Cl)c1 Amb19889606 [0,1,0,0,0,0|0,0,2]=3 1254 B13R1.22 CNC(C)C(=O)c1cccc(F)c1 Amb28282705 [0,1,0,0,0,0|0,0,2]=3 1255 B13R1.22 CNC(C)C(=O)c1cccc(N)c1 Amb28140764 [0,1,0,0,0,0|0,0,2]=3 1256 B13R1.22 CNC(C)C(=O)c1cncc(F)c1 Amb27173376 [0,1,0,0,0,0|1,0,2]=4 1257 B13R1.22 CNC(C)C(C)c1cccc(Br)c1 Amb27947314 [0,1,0,0,0,0|1,0,0]=2 1258 B13R1.22 CNC(C)C(O)c1cccc(Br)c1 Amb35621405 [0,1,0,0,0,0|0,0,0]=1 1259 B13R1.22 CNC(C)C(O)c1cccc(C)c1 Amb35741408 [0,1,0,0,0,0|0,0,0]=1 1260 B13R1.22 CNC(C)C(O)c1cccc(Cl)c1 Amb35741309 [0,1,0,0,0,0|0,0,0]=1 1261 B13R1.22 CNC(C)C(O)c1cncc(C)c1 Amb35621104 [0,1,0,0,0,0|1,0,0]=2 1262 B13R1.22 CNC(C)C(O)c1cncc(F)c1 Amb35741562 [0,1,0,0,0,0|1,0,0]=2 1263 B13R1.22 CN[C@@H](C)C(=O)c1cccc(Br)c1 Amb35662340 [0,1,0,0,0,0|0,0,2]=3 1264 B13R1.22 CN[C@@H](C)C(=O)c1cccc(C)c1 Amb35659957 [0,1,0,0,0,0|0,0,2]=3 1265 B13R1.22 CN[C@@H](C)C(=O)c1cccc(Cl)c1 Amb29891462 [0,1,0,0,0,0|0,0,2]=3 1266 B13R1.22 CN[C@@H](C)C(=O)c1cccc(F)c1 Amb35659966 [0,1,0,0,0,0|0,0,2]=3 1267 B13R1.22 CN[C@@H](C)C(=O)c1cncc(C)c1 Amb35659949 [0,1,0,0,0,0|1,0,2]=4 1268 B13R1.22 CN[C@@H](C)C(=O)c1cncc(F)c1 Amb29891457 [0,1,0,0,0,0|1,0,2]=4 1269 B13R1.22 CN[C@@H](C)C(O)c1cccc(Br)c1 Amb35662604 [0,1,0,0,0,0|0,0,0]=1 1270 B13R1.22 CN[C@@H](C)C(O)c1cccc(C)c1 Amb35662344 [0,1,0,0,0,0|0,0,0]=1 1271 B13R1.22 CN[C@@H](C)C(O)c1cccc(Cl)c1 Amb35662598 [0,1,0,0,0,0|0,0,0]=1 1272 B13R1.22 CN[C@@H](C)C(O)c1cccc(F)c1 Amb35662613 [0,1,0,0,0,0|0,0,0]=1 1273 B13R1.22 CN[C@@H](C)C(O)c1cncc(C)c1 Amb35664060 [0,1,0,0,0,0|1,0,0]=2 1274 B13R1.22 CN[C@@H](C)C(O)c1cncc(F)c1 Amb35664054 [0,1,0,0,0,0|1,0,0]=2 1275 B13R1.22 CN[C@@H](C)[C@@H](O)c1cccc(O)c1 Amb27597057 [0,1,0,0,0,0|0,0,0]=1 1276 B13R1.22 CN[C@H](C)[C@@H](O)c1cccc(O)c1 Amb27647578 [0,1,0,0,0,0|0,0,0]=1 1277 B13R1.22 CN[C@H](C)[C@H](O)c1cccc(O)c1 Amb28240477 [0,1,0,0,0,0|0,0,0]=1 1278 B13R1.22 COC(=O)C(O)c1cccc(Br)c1 Amb23596560 [0,1,0,0,0,0|2,0,1]=4 1279 B13R1.22 COC(=O)C(O)c1cccc(C)c1 Amb18186544 [0,1,0,0,0,0|2,0,1]=4 1280 B13R1.22 COC(=O)C(O)c1cccc(Cl)c1 Amb18333893 [0,1,0,0,0,0|2,0,1]=4 1281 B13R1.22 COC(=O)C(O)c1cccc(F)c1 Amb19074669 [0,1,0,0,0,0|2,0,1]=4 1282 B13R1.22 COC(=O)C(O)c1cccc(O)c1 Amb18187057 [0,1,0,0,0,0|2,0,1]=4 1283 B13R1.22 COC(=O)[C@@H](O)c1cccc(O)c1 Amb27762630 [0,1,0,0,0,0|2,0,1]=4 1284 B13R1.22 COC(=O)[C@H](O)c1cccc(Cl)c1 Amb26080884 [0,1,0,0,0,0|2,0,1]=4 1285 B13R1.22 COC(=O)[C@H](O)c1cccc(O)c1 Amb28074213 [0,1,0,0,0,0|2,0,1]=4 1286 B13R1.22 COC(C)C(=O)c1cccc(Br)c1 Amb35614573 [0,1,0,0,0,0|1,0,2]=4 1287 B13R1.22 COC(C)C(=O)c1cccc(F)c1 Amb27663099 [0,1,0,0,0,0|1,0,2]=4 1288 B13R1.22 COC(C)C(N)c1cccc(Br)c1 Amb35626162 [0,1,0,0,0,0|2,0,0]=3 1289 B13R1.22 COC(C)C(N)c1cccc(C)c1 Amb27416131 [0,1,0,0,0,0|2,0,0]=3 1290 B13R1.22 COC(C)C(N)c1cccc(Cl)c1 Amb27416130 [0,1,0,0,0,0|2,0,0]=3 1291 B13R1.22 COC(C)C(N)c1cncc(F)c1 Amb27595492 [0,1,0,0,0,0|3,0,0]=4 1292 B13R1.22 COC(C)C(O)c1cccc(Br)c1 Amb30028049 [0,1,0,0,0,0|1,0,0]=2 1293 B13R1.22 COC(C)C(O)c1cccc(Cl)c1 Amb27272688 [0,1,0,0,0,0|1,0,0]=2 1294 B13R1.22 CSC(C)C(=O)c1cccc(Cl)c1 Amb25110469 [0,1,0,0,0,0|1,0,2]=4 1295 B13R1.22 C\C(=N/O)C(O)c1cccc(O)c1 Amb28202121 [0,1,0,0,0,0|1,0,2]=4 1296 B13R1.22 Cc1cc(C(O)C(C)CN)ccn1 Amb32694210 [0,1,0,0,0,0|3,0,0]=4 1297 B13R1.22 Cc1cccc(C(C)C(C)CN)c1 Amb27609096 [0,1,0,0,0,0|3,0,0]=4 1298 B13R1.22 Cc1cccc(C(N)C(C)CO)c1 Amb28317955 [0,1,0,0,0,0|3,0,0]=4 1299 B13R1.22 Cc1cccc(C(O)C(C)CN)c1 Amb25189856 [0,1,0,0,0,0|2,0,0]=3 1300 B13R1.22 Cc1cccc(C(O)C(N)CO)c1 Amb27750570 [0,1,0,0,0,0|3,0,0]=4 1301 B13R1.22 N=C(NO)C(O)c1cccc(O)c1 Amb27409606 [0,1,0,0,0,0|2,0,1]=4 1302 B13R1.47 C#CCC(C)C(O)c1ccccc1 Amb27656739 [0,1,0,0,0,0|1,0,1]=3 1303 B13R1.47 C=C(\C=C\C)C(O)c1ccccc1 Amb27458007 [0,1,0,0,0,0|1,0,2]=4 1304 B13R1.47 C=C=CC(C)C(O)c1ccccc1 Amb27415474 [0,1,0,0,0,0|1,0,1]=3 1305 B13R1.47 C=C=C[C@@H](C)[C@@H](O)c1ccccc1 Amb27761631 [0,1,0,0,0,0|1,0,1]=3 1306 B13R1.47 CC#CC(O)C(O)c1ccccc1 Amb28321416 [0,1,0,0,0,0|2,0,0]=3 1307 B13R1.47 CC(CC#N)C(O)c1ccccc1 Amb17335051 [0,1,0,0,0,0|1,0,1]=3 1308 B13R1.47 CC(CC#N)C(O)c1ccccn1 Amb17335129 [0,1,0,0,0,0|2,0,1]=4 1309 B13R1.47 CC(CCN)C(C)c1ccccc1 Amb33081589 [0,1,0,0,0,0|2,0,0]=3 1310 B13R1.47 CC(CCN)C(O)c1ccccc1 Amb18194408 [0,1,0,0,0,0|1,0,0]=2 1311 B13R1.47 CC(CCN)N(C)c1ccccc1 Amb17138895 [0,1,0,0,0,0|3,0,0]=4 1312 B13R1.47 CC(CON)C(C)c1ccccc1 Amb33081866 [0,1,0,0,0,0|3,0,0]=4 1313 B13R1.47 CC(N=C=O)C(C)c1ccccc1 Amb33081602 [0,1,0,0,0,0|1,0,2]=4 1314 B13R1.47 CC(c1ccccc1)C(F)CCN Amb33081849 [0,1,0,0,0,0|3,0,0]=4 1315 B13R1.47 CC(c1ccccc1)C(N)CCO Amb32946598 [0,1,0,0,0,0|3,0,0]=4 1316 B13R1.47 CC(c1ccccc1)C(O)CCN Amb32693482 [0,1,0,0,0,0|3,0,0]=4 1317 B13R1.47 CC(c1ccccc1)N(C)CCCl Amb17337267 [0,1,0,0,0,0|3,0,0]=4 1318 B13R1.47 CC(c1ccccc1)N(C)CCN Amb17335265 [0,1,0,0,0,0|3,0,0]=4 1319 B13R1.47 CC(c1ccccc1)N(C)CCO Amb17335355 [0,1,0,0,0,0|3,0,0]=4 1320 B13R1.47 CC(c1ccccc1)[C@@H](O)CCN Amb33081848 [0,1,0,0,0,0|3,0,0]=4 1321 B13R1.47 CC(c1ccccc1)[C@H](O)CCN Amb33081844 [0,1,0,0,0,0|3,0,0]=4 1322 B13R1.47 CC=C=C(C)C(O)c1ccccc1 Amb17594415 [0,1,0,0,0,0|1,0,1]=3 1323 B13R1.47 CCCC(N)C(O)c1ccccc1 Amb18128510 [0,1,0,0,0,0|2,0,0]=3 1324 B13R1.47 CCC[C@@H](O)[C@H](N)c1ccccc1 Amb32412697 [0,1,0,0,0,0|3,0,0]=4 1325 B13R1.47 CCNC(=N)C(C)c1ccccc1 Amb27415625 [0,1,0,0,0,0|2,0,1]=4 1326 B13R1.47 CCNC(=N)C(N)c1ccccc1 Amb27230276 [0,1,0,0,0,0|2,0,1]=4 1327 B13R1.47 CCNC(=O)C(Cl)c1ccccc1 Amb8825186 [0,1,0,0,0,0|2,0,1]=4 1328 B13R1.47 CCNC(=O)C(N)c1ccccc1 Amb6275596 [0,1,0,0,0,0|2,0,1]=4 1329 B13R1.47 CCNC(=O)C(O)c1ccccc1 Amb17400707 [0,1,0,0,0,0|1,0,1]=3 1330 B13R1.47 CCNC(=O)[C@@H](C)c1ccccc1 Amb27790114 [0,1,0,0,0,0|2,0,1]=4 1331 B13R1.47 CCNC(=O)[C@@H](N)c1ccccc1 Amb17233443 [0,1,0,0,0,0|2,0,1]=4 1332 B13R1.47 CCNC(C)C(O)c1ccccc1 Amb17594595 [0,1,0,0,0,0|0,0,0]=1 1333 B13R1.47 CCNC(C)C(O)c1ccccc1 Amb32661029 [0,1,0,0,0,0|0,0,0]=1 1334 B13R1.47 CCOC(=O)C(O)c1ccccc1 Amb3939668 [0,1,0,0,0,0|2,0,1]=4 1335 B13R1.47 CCOC(=O)[C@@H](O)c1ccccc1 Amb3939685 [0,1,0,0,0,0|2,0,1]=4 1336 B13R1.47 CCOC(=O)[C@H](O)c1ccccc1 Amb3939686 [0,1,0,0,0,0|2,0,1]=4 1337 B13R1.47 CCSC(C)C(=O)c1ccccc1 Amb9668556 [0,1,0,0,0,0|1,0,2]=4 1338 B13R1.47 CC\C=C(/C)C(O)c1ccccc1 Amb22546638 [0,1,0,0,0,0|1,0,1]=3 1339 B13R1.47 CC\C=C(\C)C(O)c1ccccc1 Amb28294233 [0,1,0,0,0,0|1,0,1]=3 1340 B13R1.47 CNCC(=O)C(C)c1ccccc1 Amb33223804 [0,1,0,0,0,0|2,0,1]=4 1341 B13R1.47 CNCC(O)C(C)c1ccccc1 Amb19031257 [0,1,0,0,0,0|2,0,0]=3 1342 B13R1.47 CN\N=C(\N)C(O)c1ccccc1 Amb27392222 [0,1,0,0,0,0|1,0,1]=3 1343 B13R1.47 CONC(=O)C(C)c1ccccc1 Amb28072728 [0,1,0,0,0,0|2,0,1]=4 1344 B13R1.47 CONC(=O)C(N)c1ccccc1 Amb28243508 [0,1,0,0,0,0|2,0,1]=4 1345 B13R1.47 CONC(=O)[C@@H](N)c1ccccc1 Amb27402365 [0,1,0,0,0,0|2,0,1]=4 1346 B13R1.47 CONC(=O)[C@@H](O)c1ccccc1 Amb27206352 [0,1,0,0,0,0|1,0,1]=3 1347 B13R1.47 CONC(=O)[C@H](N)c1ccccc1 Amb27455721 [0,1,0,0,0,0|2,0,1]=4 1348 B13R1.47 C[C@@H](NC=O)[C@H](O)c1ccccc1 Amb27401045 [0,1,0,0,0,0|0,0,1]=2 1349 B13R1.47 C[C@H](N=[N+]=[N-])[C@@H](O)c1ccccc1 Amb27657856 [0,1,0,0,0,0|1,0,1]=3 1350 B13R1.47 C[C@H](NC=O)C(=O)c1ccccc1 Amb27859073 [0,1,0,0,0,0|0,0,3]=4 1351 B13R1.47 C[C@H](\C=C/Cl)[C@@H](O)c1ccccc1 Amb28458376 [0,1,0,0,0,0|1,0,1]=3 1352 B13R1.47 C\C(=C/CO)C(O)c1ccccc1 Amb22547006 [0,1,0,0,0,0|1,0,1]=3 1353 B13R1.47 C\C(=C\CN)C(O)c1ccccc1 Amb27803981 [0,1,0,0,0,0|1,0,1]=3 1354 B13R1.47 C\C(=C\CO)C(O)c1ccccc1 Amb22547016 [0,1,0,0,0,0|1,0,1]=3 1355 B13R1.47 C\C(=C\CO)[C@H](O)c1ccccc1 Amb27605421 [0,1,0,0,0,0|1,0,1]=3 1356 B13R1.47 C\C=C\C(C)C(=O)c1ccccc1 Amb24492785 [0,1,0,0,0,0|1,0,2]=4 1357 B13R1.47 C\C=C\C(C)C(O)c1ccccc1 Amb28207338 [0,1,0,0,0,0|1,0,0]=2 1358 B13R1.47 C\C=C\C(O)C(N)c1ccccc1 Amb27618354 [0,1,0,0,0,0|3,0,0]=4 1359 B13R1.47 C\C=C\C(O)C(O)c1ccccn1 Amb27763836 [0,1,0,0,0,0|3,0,0]=4 1360 B13R1.47 C\C=C\C(O)C(O)c1ccncc1 Amb27853523 [0,1,0,0,0,0|3,0,0]=4 1361 B13R1.47 C\C=C\[C@@H](C)C(O)c1ccccc1 Amb27255266 [0,1,0,0,0,0|1,0,0]=2 1362 B13R1.47 C\C=C\[C@@H](C)[C@@H](O)c1ccccc1 Amb27660881 [0,1,0,0,0,0|1,0,0]=2 1363 B13R1.47 C\C=C\[C@@H](O)[C@@H](C)c1ccccc1 Amb27598532 [0,1,0,0,0,0|3,0,0]=4 1364 B13R1.86 C#CC(C=C)C(O)c1ccccc1 Amb27833672 [0,1,0,0,0,0|1,0,2]=4 1365 B13R1.86 C#CC(NN)C(C)c1ccccc1 Amb35711148 [0,1,0,0,0,0|2,0,1]=4 1366 B13R1.86 CC(c1ccccc1)C(CN)CO Amb33362234 [0,1,0,0,0,0|3,0,0]=4 1367 B13R1.86 CCC(C#N)C(O)c1ccncc1 Amb28318301 [0,1,0,0,0,0|2,0,1]=4 1368 B13R1.86 CCC(CC)C(N)c1ccccc1 Amb6255035 [0,1,0,0,0,0|2,0,0]=3 1369 B13R1.86 CCC(CN)C(O)c1ccccc1 Amb32693635 [0,1,0,0,0,0|1,0,0]=2 1370 B13R1.86 CCC(CN)C(O)c1ccccn1 Amb32693637 [0,1,0,0,0,0|2,0,0]=3 1371 B13R1.86 CCC(CN)C(O)c1cccnc1 Amb32693638 [0,1,0,0,0,0|2,0,0]=3 1372 B13R1.86 CCC(CN)C(O)c1ccncc1 Amb32693636 [0,1,0,0,0,0|2,0,0]=3 1373 B13R1.86 CCC(CN)C(O)c1ccncn1 Amb32693639 [0,1,0,0,0,0|3,0,0]=4 1374 B13R1.86 CCC(CN)C(O)c1cnccn1 Amb32694163 [0,1,0,0,0,0|3,0,0]=4 1375 B13R1.86 CCC(CN)C(O)c1cncnc1 Amb32693770 [0,1,0,0,0,0|3,0,0]=4 1376 B13R1.86 CCC(NC)C(=O)c1ccccc1 Amb17621424 [0,1,0,0,0,0|0,0,2]=3 1377 B13R1.86 CCC(NC)C(O)c1ccccc1 Amb18604539 [0,1,0,0,0,0|0,0,0]=1 1378 B13R1.86 CCC(SC)C(=O)c1ccccc1 Amb19051956 [0,1,0,0,0,0|1,0,2]=4 1379 B13R1.86 CC[C@@H](C#N)[C@@H](O)c1ccccc1 Amb27484816 [0,1,0,0,0,0|1,0,1]=3 1380 B13R1.86 CNC(C#N)C(C)c1ccccc1 Amb18975499 [0,1,0,0,0,0|1,0,1]=3 1381 B13R1.86 COC(OC)C(=O)c1ccccc1 Amb10559989 [0,1,0,0,0,0|1,0,2]=4 1382 B13R1.86 COC(OC)C(N)c1ccccc1 Amb33548321 [0,1,0,0,0,0|2,0,0]=3 1383 B13R1.86 COC(OC)C(N)c1cccnc1 Amb33307076 [0,1,0,0,0,0|3,0,0]=4 1384 B13R1.86 COC(OC)C(O)c1ccccc1 Amb29845522 [0,1,0,0,0,0|1,0,0]=2 1385 B13R1.86 C\C=C(\C#N)C(O)c1ccccc1 Amb27617636 [0,1,0,0,0,0|1,0,2]=4 1386 B13R1.86 C\C=C(\CO)C(O)c1ccccc1 Amb27484745 [0,1,0,0,0,0|1,0,1]=3 1387 B13R1.86 C\N=C(\NC)N(C)c1ccccc1 Amb28130495 [0,1,0,0,0,0|2,0,1]=4 1388 B13R1.86 N#CC(CN)C(O)c1ccccc1 Amb27597649 [0,1,0,0,0,0|2,0,0]=3 1389 B13R1.86 N#C[C@@H](CCl)[C@@H](O)c1ccccc1 Amb27863452 [0,1,0,0,0,0|2,0,0]=3 1390 B13R1.152 BN(C)C(C)C(Cl)c1ccccc1 Amb27169118 [0,1,0,0,0,0|1,0,0]=2 1391 B13R1.152 BN(C)[C@H](C)[C@@H](Cl)c1ccccc1 Amb27876394 [0,1,0,0,0,0|1,0,0]=2 1392 B13R1.152 C=C(C(C)=O)C(O)c1ccccc1 Amb6537578 [0,1,0,0,0,0|1,0,2]=4 1393 B13R1.152 C=C(C)C(=O)[C@@H](O)c1ccccc1 Amb28381192 [0,1,0,0,0,0|2,0,1]=4 1394 B13R1.152 C=C(C)C(C)N(O)c1ccccn1 Amb27219596 [0,1,0,0,0,0|3,0,0]=4 1395 B13R1.152 C=C(C)C(O)C(N)c1ccccc1 Amb29875677 [0,1,0,0,0,0|3,0,0]=4 1396 B13R1.152 C=C(C)[C@@H](C)[C@H](O)c1ccccc1 Amb27486556 [0,1,0,0,0,0|1,0,0]=2 1397 B13R1.152 C=C(C)[C@H](C)[C@@H](O)c1ccccc1 Amb28061921 [0,1,0,0,0,0|1,0,0]=2 1398 B13R1.152 C=C(C)[C@H](C)[C@H](O)c1ccccc1 Amb27394813 [0,1,0,0,0,0|1,0,0]=2 1399 B13R1.152 C=C(C)[C@H](O)[C@@H](C)c1ccccc1 Amb27761634 [0,1,0,0,0,0|3,0,0]=4 1400 B13R1.152 CC(=O)C(Br)C(Br)c1ccccc1 Amb2610167 [0,1,0,0,0,0|3,0,0]=4 1401 B13R1.152 CC(=O)C(C)C(=O)c1ccccc1 Amb8394273 [0,1,0,0,0,0|1,0,2]=4 1402 B13R1.152 CC(=O)C(C)C(O)c1ccncc1 Amb27164650 [0,1,0,0,0,0|2,0,0]=3 1403 B13R1.152 CC(=O)C(Cl)C(Cl)c1ccccc1 Amb27623863 [0,1,0,0,0,0|3,0,0]=4 1404 B13R1.152 CC(=O)C(F)C(O)c1ccccc1 Amb28294136 [0,1,0,0,0,0|2,0,0]=3 1405 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](O)c1ccccc1 Amb28076748 [0,1,0,0,0,0|2,0,0]=3 1406 B13R1.152 CC(=O)[C@@H](Cl)[C@H](O)c1ccccc1 Amb28252413 [0,1,0,0,0,0|2,0,0]=3 1407 B13R1.152 CC(=O)[C@H](Cl)[C@H](Cl)c1ccccc1 Amb27390157 [0,1,0,0,0,0|3,0,0]=4 1408 B13R1.152 CC(=O)[C@H](Cl)[C@H](O)c1ccccc1 Amb28121183 [0,1,0,0,0,0|2,0,0]=3 1409 B13R1.152 CC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb27660884 [0,1,0,0,0,0|2,0,0]=3 1410 B13R1.152 CC(=O)\C(C)=C(/O)c1ccccc1 Amb17594481 [0,1,0,0,0,0|1,0,2]=4 1411 B13R1.152 CC(C(=N)N(C)C)c1ccccc1 Amb35715675 [0,1,0,0,0,0|2,0,1]=4 1412 B13R1.152 CC(C(=O)O)C(C)c1ccccc1 Amb6360544 [0,1,0,0,0,0|3,0,0]=4 1413 B13R1.152 CC(C(=O)O)C(N)c1ccccc1 Amb17470593 [0,1,0,0,0,0|3,0,0]=4 1414 B13R1.152 CC(C(=O)O)C(N)c1ccccc1 Amb19375481 [0,1,0,0,0,0|3,0,0]=4 1415 B13R1.152 CC(C(=O)O)C(O)c1ccccc1 Amb3430442 [0,1,0,0,0,0|2,0,0]=3 1416 B13R1.152 CC(C(=O)c1ccccc1)N(C)C Amb8384821 [0,1,0,0,0,0|0,0,2]=3 1417 B13R1.152 CC(C(Cl)c1ccccc1)N(C)C Amb27392377 [0,1,0,0,0,0|1,0,0]=2 1418 B13R1.152 CC(C(N)=O)C(N)c1ccccc1 Amb27585479 [0,1,0,0,0,0|3,0,0]=4 1419 B13R1.152 CC(C(O)c1ccccc1)N(C)O Amb28189465 [0,1,0,0,0,0|0,0,0]=1 1420 B13R1.152 CC(C(O)c1ccccc1)[N+](=O)[O-] Amb6360730 [0,1,0,0,0,0|1,0,1]=3 1421 B13R1.152 CC(C(O)c1ccccc1)[NH+](C)C Amb2388354 [0,1,0,0,0,0|0,0,1]=2 1422 B13R1.152 CC(C)C(Br)C(C)c1ccccc1 Amb27951183 [0,1,0,0,0,0|3,0,0]=4 1423 B13R1.152 CC(C)C(C)C(N)c1ccncc1 Amb28342576 [0,1,0,0,0,0|3,0,0]=4 1424 B13R1.152 CC(C)C(C)C(O)c1cccnc1 Amb28397540 [0,1,0,0,0,0|2,0,0]=3 1425 B13R1.152 CC(C)C(C)C(O)c1ccncc1 Amb27955489 [0,1,0,0,0,0|2,0,0]=3 1426 B13R1.152 CC(C)C(C)C(O)c1ccncn1 Amb27645903 [0,1,0,0,0,0|3,0,0]=4 1427 B13R1.152 CC(C)C(C)C(O)c1ccnnc1 Amb28382185 [0,1,0,0,0,0|3,0,0]=4 1428 B13R1.152 CC(C)C(N)C(O)c1ccccc1 Amb17138913 [0,1,0,0,0,0|2,0,0]=3 1429 B13R1.152 CC(C)C(N)C(O)c1ccccn1 Amb18564134 [0,1,0,0,0,0|3,0,0]=4 1430 B13R1.152 CC(C)C(O)C(N)c1ccccc1 Amb33531271 [0,1,0,0,0,0|3,0,0]=4 1431 B13R1.152 CC(C)C(O)C(O)c1cccnc1 Amb27399860 [0,1,0,0,0,0|3,0,0]=4 1432 B13R1.152 CC(C)[C@@H](N)C(O)c1ccccc1 Amb35623667 [0,1,0,0,0,0|2,0,0]=3 1433 B13R1.152 CC(C)[C@@H](N)C(O)c1cccnc1 Amb35623660 [0,1,0,0,0,0|3,0,0]=4 1434 B13R1.152 CC(C)[C@@H](N)[C@@H](O)c1cccnc1 Amb27879034 [0,1,0,0,0,0|3,0,0]=4 1435 B13R1.152 CC(C)[C@@H](N)[C@H](O)c1cccnc1 Amb27976006 [0,1,0,0,0,0|3,0,0]=4 1436 B13R1.152 CC(C)[C@@H](O)[C@@H](O)c1ccccc1 Amb27617821 [0,1,0,0,0,0|2,0,0]=3 1437 B13R1.152 CC(C)[C@H](C)[C@@H](O)c1ccccc1 Amb27484757 [0,1,0,0,0,0|1,0,0]=2 1438 B13R1.152 CC(C)[C@H](C)[C@H](O)c1ccccc1 Amb28207390 [0,1,0,0,0,0|1,0,0]=2 1439 B13R1.152 CC(C)[C@H](N)C(O)c1ccccc1 Amb27201305 [0,1,0,0,0,0|2,0,0]=3 1440 B13R1.152 CC(C)[C@H](N)C(O)c1cccnc1 Amb35623845 [0,1,0,0,0,0|3,0,0]=4 1441 B13R1.152 CC(C)[C@H](N)[C@H](O)c1ccccc1 Amb27180072 [0,1,0,0,0,0|2,0,0]=3 1442 B13R1.152 CC(C)[C@H](O)[C@@H](O)c1ccccc1 Amb27486212 [0,1,0,0,0,0|2,0,0]=3 1443 B13R1.152 CC(N)C(C)C(O)c1ccccc1 Amb35624683 [0,1,0,0,0,0|1,0,0]=2 1444 B13R1.152 CC(N)C(C)C(O)c1cccnc1 Amb35621666 [0,1,0,0,0,0|2,0,0]=3 1445 B13R1.152 CC(N)C(C)C(O)c1cnccn1 Amb35624929 [0,1,0,0,0,0|3,0,0]=4 1446 B13R1.152 CC(N)C(C)C(O)c1cncnc1 Amb35624522 [0,1,0,0,0,0|3,0,0]=4 1447 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb25189862 [0,1,0,0,0,0|2,0,0]=3 1448 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb32662531 [0,1,0,0,0,0|2,0,0]=3 1449 B13R1.152 CC(c1ccccc1)[C@@H](C)C(=O)O Amb33744674 [0,1,0,0,0,0|3,0,0]=4 1450 B13R1.152 CC(c1ccccc1)[C@H](C)C(=O)O Amb33744350 [0,1,0,0,0,0|3,0,0]=4 1451 B13R1.152 CN(C)C(=O)C(Cl)c1ccccc1 Amb1106097 [0,1,0,0,0,0|2,0,1]=4 1452 B13R1.152 CN(C)C(=O)C(F)c1ccccc1 Amb2614493 [0,1,0,0,0,0|2,0,1]=4 1453 B13R1.152 CN(C)C(=O)C(N)c1ccccc1 Amb10609379 [0,1,0,0,0,0|2,0,1]=4 1454 B13R1.152 CN(C)C(=O)C(N)c1ccccc1 Amb9718610 [0,1,0,0,0,0|2,0,1]=4 1455 B13R1.152 CN(C)C(=O)C(O)c1ccccc1 Amb17400708 [0,1,0,0,0,0|1,0,1]=3 1456 B13R1.152 CN(C)C(=O)C(O)c1ccccn1 Amb27205661 [0,1,0,0,0,0|2,0,1]=4 1457 B13R1.152 CN(C)C(=O)C(O)c1cccnc1 Amb26059551 [0,1,0,0,0,0|2,0,1]=4 1458 B13R1.152 CN(C)C(=O)C(O)c1ccncc1 Amb27610352 [0,1,0,0,0,0|2,0,1]=4 1459 B13R1.152 CN(C)C(=O)[C@@H](N)c1ccccc1 Amb17233442 [0,1,0,0,0,0|2,0,1]=4 1460 B13R1.152 CN(C)C(=O)[C@@H](O)c1ccccc1 Amb25795435 [0,1,0,0,0,0|1,0,1]=3 1461 B13R1.152 CN(C)C(=O)[C@H](Cl)c1ccccc1 Amb28193702 [0,1,0,0,0,0|2,0,1]=4 1462 B13R1.152 CN(C)C(=O)[C@H](O)c1ccccc1 Amb27980458 [0,1,0,0,0,0|1,0,1]=3 1463 B13R1.152 CN(C)C(O)C(=O)c1ccccc1 Amb27599342 [0,1,0,0,0,0|1,0,2]=4 1464 B13R1.152 CN(O)C(=O)C(O)c1ccccc1 Amb28077821 [0,1,0,0,0,0|1,0,1]=3 1465 B13R1.152 CN(O)C(=O)[C@@H](N)c1ccccc1 Amb27216398 [0,1,0,0,0,0|2,0,1]=4 1466 B13R1.152 CN(O)C(=O)[C@H](N)c1ccccc1 Amb27216399 [0,1,0,0,0,0|2,0,1]=4 1467 B13R1.152 C[C@@H](C(=O)O)[C@@H](C)c1ccccc1 Amb27407054 [0,1,0,0,0,0|3,0,0]=4 1468 B13R1.152 C[C@@H](C(=O)O)[C@H](O)c1ccccc1 Amb28239779 [0,1,0,0,0,0|2,0,0]=3 1469 B13R1.152 C[C@@H](C(=O)c1ccccc1)N(C)C Amb27861373 [0,1,0,0,0,0|0,0,2]=3 1470 B13R1.152 C[C@@H](C(=O)c1ccccc1)[C@@H](C)Cl Amb28325714 [0,1,0,0,0,0|1,0,2]=4 1471 B13R1.152 C[C@@H](O)[C@@H](C)C(=O)c1ccccc1 Amb28321937 [0,1,0,0,0,0|1,0,2]=4 1472 B13R1.152 C[C@@H](O)[C@@H](C)[C@@H](O)c1ccccc1 Amb27665209 [0,1,0,0,0,0|1,0,0]=2 1473 B13R1.152 C[C@@H]([C@@H](C)O)S(=O)c1ccccc1 Amb28401032 [0,1,0,0,0,0|2,0,1]=4 1474 B13R1.152 C[C@@H]([C@@H](C)O)[C@@H](O)c1ccccc1 Amb27406983 [0,1,0,0,0,0|1,0,0]=2 1475 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)N(C)C Amb27180205 [0,1,0,0,0,0|1,0,0]=2 1476 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)N(C)C Amb10844736 [0,1,0,0,0,0|0,0,0]=1 1477 B13R1.152 C[C@@H]([C@H](Cl)c1ccccc1)N(C)C Amb27955200 [0,1,0,0,0,0|1,0,0]=2 1478 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)C Amb3940113 [0,1,0,0,0,0|0,0,0]=1 1479 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)N Amb27753054 [0,1,0,0,0,0|0,0,0]=1 1480 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)O Amb27972558 [0,1,0,0,0,0|0,0,0]=1 1481 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)[NH+](C)C Amb28463793 [0,1,0,0,0,0|0,0,1]=2 1482 B13R1.152 C[C@H](C(=O)O)C(O)c1ccccc1 Amb27408977 [0,1,0,0,0,0|2,0,0]=3 1483 B13R1.152 C[C@H](C(=O)O)[C@@H](N)c1ccccc1 Amb27392248 [0,1,0,0,0,0|3,0,0]=4 1484 B13R1.152 C[C@H](C(=O)O)[C@H](C)c1ccccc1 Amb28244756 [0,1,0,0,0,0|3,0,0]=4 1485 B13R1.152 C[C@H](Cl)[C@@H](C)C(=O)c1ccccc1 Amb27179287 [0,1,0,0,0,0|1,0,2]=4 1486 B13R1.152 C[C@H](O)[C@@H](C)[C@H](O)c1ccccc1 Amb27197964 [0,1,0,0,0,0|1,0,0]=2 1487 B13R1.152 C[C@H](O)[C@H](C)S(=O)c1ccccc1 Amb27660942 [0,1,0,0,0,0|2,0,1]=4 1488 B13R1.152 C[C@H](O)[C@H](C)[C@@H](N)c1ccccc1 Amb27179082 [0,1,0,0,0,0|2,0,0]=3 1489 B13R1.152 C[C@H]([C@@H](C)O)[C@@H](N)c1ccccc1 Amb27777185 [0,1,0,0,0,0|2,0,0]=3 1490 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)N(C)C Amb6357237 [0,1,0,0,0,0|0,0,0]=1 1491 B13R1.152 C[C@H]([C@H](O)c1ccccc1)N(C)C Amb8387313 [0,1,0,0,0,0|0,0,0]=1 1492 B13R1.152 NC(=O)C(F)C(O)c1ccccc1 Amb27876419 [0,1,0,0,0,0|3,0,0]=4 1493 B13R1.152 NC(=O)[C@H](N)[C@H](O)c1ccccc1 Amb27477518 [0,1,0,0,0,0|3,0,0]=4 1494 B13R1.152 NC(C(=O)O)C(O)c1ccccc1 Amb2228459 [0,1,0,0,0,0|3,0,0]=4 1495 B13R1.152 NC(C(=O)O)C(O)c1ccccc1 Amb533731 [0,1,0,0,0,0|3,0,0]=4 1496 B13R1.152 NC(C(F)F)C(O)c1ccccc1 Amb27415651 [0,1,0,0,0,0|3,0,0]=4 1497 B13R1.152 N[C@@H](C(=O)O)[C@@H](O)c1ccccc1 Amb26968525 [0,1,0,0,0,0|3,0,0]=4 1498 B13R1.152 N[C@H](C(=O)O)C(O)c1ccccc1 Amb27180158 [0,1,0,0,0,0|3,0,0]=4 1499 B13R1.152 N[C@H](C(=O)O)[C@H](O)c1ccccc1 Amb8516907 [0,1,0,0,0,0|3,0,0]=4 1500 B13R1.152 O=C(O)C(O)C(O)c1ccccc1 Amb2799349 [0,1,0,0,0,0|3,0,0]=4 1501 B13R1.152 O=C(O)[C@@H](O)[C@@H](O)c1ccccc1 Amb559389 [0,1,0,0,0,0|3,0,0]=4 1502 B13R1.263 C#CC(C)(C)C(C)c1ccccc1 Amb33081867 [0,1,0,0,0,0|2,0,1]=4 1503 B13R1.263 C#CC(C)(O)C(O)c1ccccc1 Amb27618159 [0,1,0,0,0,0|1,0,1]=3 1504 B13R1.263 C=CC(C)(C)C(N)c1ccccc1 Amb27179237 [0,1,0,0,0,0|2,0,1]=4 1505 B13R1.263 C=CC(C)(C)C(O)c1ccccc1 Amb27857995 [0,1,0,0,0,0|1,0,1]=3 1506 B13R1.263 C=CC(C)(O)C(N)c1ccccc1 Amb27645409 [0,1,0,0,0,0|2,0,1]=4 1507 B13R1.263 C=CC(F)(F)C(O)c1ccccc1 Amb27197521 [0,1,0,0,0,0|2,0,1]=4 1508 B13R1.263 CC(C)(C#N)C(N)c1ccccc1 Amb18127313 [0,1,0,0,0,0|3,0,0]=4 1509 B13R1.263 CC(C)(C#N)C(O)c1ccccc1 Amb578625 [0,1,0,0,0,0|2,0,0]=3 1510 B13R1.263 CC(C)(C#N)C(O)c1ccncc1 Amb28280545 [0,1,0,0,0,0|3,0,0]=4 1511 B13R1.263 CC(C)(C=O)[C@@H](O)c1ccccc1 Amb28388613 [0,1,0,0,0,0|2,0,0]=3 1512 B13R1.263 CC(C)(C=O)[C@H](O)c1ccccc1 Amb28239495 [0,1,0,0,0,0|2,0,0]=3 1513 B13R1.263 CC(C)(CN)C(N)c1ccccc1 Amb25752199 [0,1,0,0,0,0|3,0,0]=4 1514 B13R1.263 CC(C)(CN)C(O)c1ccccc1 Amb18252491 [0,1,0,0,0,0|2,0,0]=3 1515 B13R1.263 CC(C)(CN)C(O)c1ccccn1 Amb26878762 [0,1,0,0,0,0|3,0,0]=4 1516 B13R1.263 CC(C)(CN)C(O)c1cccnc1 Amb18909171 [0,1,0,0,0,0|3,0,0]=4 1517 B13R1.263 CC(C)(CN)C(O)c1ccncc1 Amb24715184 [0,1,0,0,0,0|3,0,0]=4 1518 B13R1.263 CC(C)(CO)C(F)c1ccccc1 Amb32862889 [0,1,0,0,0,0|3,0,0]=4 1519 B13R1.263 CC(C)(CO)C(N)c1ccccc1 Amb17605527 [0,1,0,0,0,0|3,0,0]=4 1520 B13R1.263 CC(C)(CO)C(O)c1ccccc1 Amb9825980 [0,1,0,0,0,0|2,0,0]=3 1521 B13R1.263 CC(C)(CO)C(O)c1ccncc1 Amb3993655 [0,1,0,0,0,0|3,0,0]=4 1522 B13R1.263 CC(C)(CO)[C@@H](Cl)c1ccccc1 Amb28118840 [0,1,0,0,0,0|3,0,0]=4 1523 B13R1.263 CC(C)(CO)[C@@H](N)c1ccccc1 Amb22736693 [0,1,0,0,0,0|3,0,0]=4 1524 B13R1.263 CC(C)(CO)[C@@H](O)c1ccccc1 Amb22737277 [0,1,0,0,0,0|2,0,0]=3 1525 B13R1.263 CC(C)(CO)[C@H](N)c1ccccc1 Amb22736692 [0,1,0,0,0,0|3,0,0]=4 1526 B13R1.263 CC(C)(CO)[C@H](O)c1ccccc1 Amb27147490 [0,1,0,0,0,0|2,0,0]=3 1527 B13R1.263 CC(C)(NO)C(=O)c1ccccc1 Amb2226850 [0,1,0,0,0,0|1,0,2]=4 1528 B13R1.263 CC(C)(NO)C(=O)c1ccccc1 Amb592275 [0,1,0,0,0,0|1,0,2]=4 1529 B13R1.263 CC(C)(NO)C(O)c1ccccc1 Amb24376632 [0,1,0,0,0,0|1,0,0]=2 1530 B13R1.263 CC(N)(C#N)C(O)c1ccccc1 Amb28203182 [0,1,0,0,0,0|2,0,0]=3 1531 B13R1.263 CC(c1ccccc1)C(C)(C)C#N Amb17333812 [0,1,0,0,0,0|3,0,0]=4 1532 B13R1.263 CC(c1ccccc1)C(C)(C)C=O Amb25125280 [0,1,0,0,0,0|3,0,0]=4 1533 B13R1.263 CC(c1ccccc1)C(C)(C)CBr Amb33081861 [0,1,0,0,0,0|3,0,0]=4 1534 B13R1.263 CC(c1ccccc1)C(C)(C)CN Amb17333855 [0,1,0,0,0,0|3,0,0]=4 1535 B13R1.263 CC(c1ccccc1)C(C)(C)CO Amb28341231 [0,1,0,0,0,0|3,0,0]=4 1536 B13R1.263 CC(c1ccccc1)C(C)(C)ON Amb33081870 [0,1,0,0,0,0|3,0,0]=4 1537 B13R1.263 CC(c1ccccc1)C(C)(N)CO Amb33081891 [0,1,0,0,0,0|3,0,0]=4 1538 B13R1.263 CC(c1ccccc1)C(C)(O)CN Amb33081889 [0,1,0,0,0,0|3,0,0]=4 1539 B13R1.263 CCC(C)(C)C(=O)c1ccccc1 Amb2780702 [0,1,0,0,0,0|1,0,2]=4 1540 B13R1.263 CCC(C)(C)C(Cl)c1ccccc1 Amb27208277 [0,1,0,0,0,0|2,0,0]=3 1541 B13R1.263 CCC(C)(C)C(N)c1cccnc1 Amb28401319 [0,1,0,0,0,0|3,0,0]=4 1542 B13R1.263 CCC(C)(F)C(N)c1ccccc1 Amb27587277 [0,1,0,0,0,0|2,0,0]=3 1543 B13R1.263 CCC(C)(F)[C@H](N)c1ccccc1 Amb27752028 [0,1,0,0,0,0|2,0,0]=3 1544 B13R1.263 CCC(C)(N)C(O)c1ccccc1 Amb35587088 [0,1,0,0,0,0|1,0,0]=2 1545 B13R1.263 CCC(C)(N)C(O)c1cccnc1 Amb35587017 [0,1,0,0,0,0|2,0,0]=3 1546 B13R1.263 CCC(C)(N)C(O)c1cnccn1 Amb35742206 [0,1,0,0,0,0|3,0,0]=4 1547 B13R1.263 CCC(C)(N)C(O)c1cncnc1 Amb35742159 [0,1,0,0,0,0|3,0,0]=4 1548 B13R1.263 CCC(C)(O)C(O)c1ccccc1 Amb28041348 [0,1,0,0,0,0|1,0,0]=2 1549 B13R1.263 CCC(F)(F)C(Br)c1ccccc1 Amb35609812 [0,1,0,0,0,0|3,0,0]=4 1550 B13R1.263 CCC(F)(F)C(Cl)c1ccccc1 Amb35609823 [0,1,0,0,0,0|3,0,0]=4 1551 B13R1.263 CCC(F)(F)C(N)c1ccccc1 Amb27404603 [0,1,0,0,0,0|3,0,0]=4 1552 B13R1.263 CCC(F)(F)C(O)c1ccccc1 Amb35645005 [0,1,0,0,0,0|2,0,0]=3 1553 B13R1.263 CCC(F)(F)C(O)c1cccnc1 Amb35645175 [0,1,0,0,0,0|3,0,0]=4 1554 B13R1.263 CC[C@@](C)(F)[C@H](N)c1ccccc1 Amb28243532 [0,1,0,0,0,0|2,0,0]=3 1555 B13R1.263 CC[C@@](C)(N)C(=O)c1ccccc1 Amb27471762 [0,1,0,0,0,0|1,0,2]=4 1556 B13R1.263 CNC(C)(C)C(C)c1ccccc1 Amb33081912 [0,1,0,0,0,0|1,0,0]=2 1557 B13R1.263 CNS(=O)(=O)C(C)c1ccccc1 Amb26571049 [0,1,0,0,0,0|3,0,0]=4 1558 B13R1.263 COC(C)(C)C(O)c1cccnc1 Amb27170045 [0,1,0,0,0,0|2,0,0]=3 1559 B13R1.263 COC(C)(C)C(O)c1cnccn1 Amb27836896 [0,1,0,0,0,0|3,0,0]=4 1560 B13R1.263 COC(C)(C)C(O)c1cncnc1 Amb27464071 [0,1,0,0,0,0|3,0,0]=4 1561 B13R1.532 C#CC(N)C(OC)c1ccccc1 Amb27952395 [0,1,0,0,0,0|2,0,1]=4 1562 B13R1.532 CC(C#N)C(C#N)c1ccccc1 Amb18647403 [0,1,0,0,0,0|3,0,0]=4 1563 B13R1.532 CCC(C)C(C#N)c1ccccc1 Amb4020042 [0,1,0,0,0,0|2,0,0]=3 1564 B13R1.532 CCC(O)C(C#N)c1ccccc1 Amb27763844 [0,1,0,0,0,0|3,0,0]=4 1565 B13R1.532 CCC(c1ccccc1)C(C)CN Amb18195747 [0,1,0,0,0,0|3,0,0]=4 1566 B13R1.532 CCC(c1ccccc1)C(C)CO Amb33745579 [0,1,0,0,0,0|3,0,0]=4 1567 B13R1.532 CCC(c1ccccc1)[C@@H](C)CN Amb33744683 [0,1,0,0,0,0|3,0,0]=4 1568 B13R1.532 CCC(c1ccccc1)[C@@H](C)CO Amb33735562 [0,1,0,0,0,0|3,0,0]=4 1569 B13R1.532 CCC(c1ccccc1)[C@H](C)CN Amb33747433 [0,1,0,0,0,0|3,0,0]=4 1570 B13R1.532 CCC(c1ccccc1)[C@H](C)CO Amb33738172 [0,1,0,0,0,0|3,0,0]=4 1571 B13R1.532 CCN(C)C(CN)c1ccccc1 Amb8890621 [0,1,0,0,0,0|3,0,0]=4 1572 B13R1.532 CC[C@@H](O)[C@@H](C#N)c1ccccc1 Amb27853904 [0,1,0,0,0,0|3,0,0]=4 1573 B13R1.532 CNC(=O)C(C#N)c1ccccc1 Amb18790298 [0,1,0,0,0,0|2,0,1]=4 1574 B13R1.532 CNC(=O)C(NC)c1ccccc1 Amb18128254 [0,1,0,0,0,0|2,0,1]=4 1575 B13R1.532 CNC(=O)C(NO)c1ccccc1 Amb28292806 [0,1,0,0,0,0|1,0,1]=3 1576 B13R1.532 CNC(=O)C(SC)c1ccccc1 Amb27236891 [0,1,0,0,0,0|1,1,1]=4 1577 B13R1.532 CNC(=O)[C@H](OC)c1ccccc1 Amb27810966 [0,1,0,0,0,0|1,0,1]=3 1578 B13R1.532 CNC(=O)\C(=N/O)c1ccccc1 Amb1951205 [0,1,0,0,0,0|1,0,2]=4 1579 B13R1.532 COC(=O)C(OC)c1ccccc1 Amb4379025 [0,1,0,0,0,0|2,0,1]=4 1580 B13R1.532 COC(=O)[C@H](OC)c1ccccc1 Amb22274921 [0,1,0,0,0,0|2,0,1]=4 1581 B13R1.532 COC(C(=O)NN)c1ccccc1 Amb9814616 [0,1,0,0,0,0|2,0,1]=4 1582 B13R1.532 COC(c1ccccc1)C(O)C#N Amb27179599 [0,1,0,0,0,0|3,0,0]=4 1583 B13R1.696 C#C[C@H](C)[C@@H](O)c1ccccc1C Amb27598619 [0,1,0,0,0,0|1,0,1]=3 1584 B13R1.696 C=C[C@@H](C)[C@@H](O)c1ccccc1Cl Amb28065358 [0,1,0,0,0,0|1,0,1]=3 1585 B13R1.696 C=C[C@@H](C)[C@@H](O)c1ccccc1O Amb27587142 [0,1,0,0,0,0|1,0,1]=3 1586 B13R1.696 C=C[C@@H](C)[C@H](O)c1ccccc1C Amb28206150 [0,1,0,0,0,0|1,0,1]=3 1587 B13R1.696 C=C[C@H](C)[C@@H](O)c1ccccc1C Amb28207311 [0,1,0,0,0,0|1,0,1]=3 1588 B13R1.696 C=C[C@H](C)[C@@H](O)c1ccccc1Cl Amb27642151 [0,1,0,0,0,0|1,0,1]=3 1589 B13R1.696 C=C[C@H](Cl)[C@@H](O)c1ccccc1F Amb28133391 [0,1,0,0,0,0|2,0,1]=4 1590 B13R1.696 CC(CN)C(C)c1ccccc1F Amb27873695 [0,1,0,0,0,0|3,0,0]=4 1591 B13R1.696 CC(CN)C(O)c1ccccc1Br Amb27235565 [0,1,0,0,0,0|2,0,0]=3 1592 B13R1.696 CC(CN)C(O)c1ccccc1Cl Amb25674619 [0,1,0,0,0,0|2,0,0]=3 1593 B13R1.696 CC(CN)C(O)c1ccccc1F Amb26036177 [0,1,0,0,0,0|2,0,0]=3 1594 B13R1.696 CC(CN)C(O)c1cccnc1Br Amb35702790 [0,1,0,0,0,0|3,0,0]=4 1595 B13R1.696 CC(CN)C(O)c1ccncc1Br Amb32693730 [0,1,0,0,0,0|3,0,0]=4 1596 B13R1.696 CC(CN)C(O)c1ccncc1Cl Amb32694214 [0,1,0,0,0,0|3,0,0]=4 1597 B13R1.696 CC(CO)C(C)c1ccccc1F Amb33743276 [0,1,0,0,0,0|3,0,0]=4 1598 B13R1.696 CC(CO)C(N)c1ccccc1Cl Amb25084551 [0,1,0,0,0,0|3,0,0]=4 1599 B13R1.696 CC(c1ccccc1F)[C@@H](C)CN Amb33727855 [0,1,0,0,0,0|3,0,0]=4 1600 B13R1.696 CC(c1ccccc1F)[C@@H](C)CO Amb33746685 [0,1,0,0,0,0|3,0,0]=4 1601 B13R1.696 CC(c1ccccc1F)[C@H](C)CN Amb33739861 [0,1,0,0,0,0|3,0,0]=4 1602 B13R1.696 CC(c1ccccc1F)[C@H](C)CO Amb33730471 [0,1,0,0,0,0|3,0,0]=4 1603 B13R1.696 CCC(=O)C(O)c1ccccc1F Amb27805104 [0,1,0,0,0,0|2,0,1]=4 1604 B13R1.696 CCC(=O)[C@H](O)c1ccccc1F Amb27486587 [0,1,0,0,0,0|2,0,1]=4 1605 B13R1.696 CCC(C)C(=O)c1ccccc1F Amb27171035 [0,1,0,0,0,0|1,0,2]=4 1606 B13R1.696 CCC(C)C(Cl)c1ccccc1C Amb27658972 [0,1,0,0,0,0|2,0,0]=3 1607 B13R1.696 CCC(C)C(Cl)c1ccncc1F Amb27982252 [0,1,0,0,0,0|3,0,0]=4 1608 B13R1.696 CCC(C)C(N)c1cccnc1Br Amb28384626 [0,1,0,0,0,0|3,0,0]=4 1609 B13R1.696 CCC(C)C(N)c1cccnc1Cl Amb27204877 [0,1,0,0,0,0|3,0,0]=4 1610 B13R1.696 CCC(C)C(N)c1ccncc1F Amb27763477 [0,1,0,0,0,0|3,0,0]=4 1611 B13R1.696 CCC(C)C(N)c1ncccc1Br Amb28366765 [0,1,0,0,0,0|3,0,0]=4 1612 B13R1.696 CCC(C)C(O)c1cccnc1Br Amb35702787 [0,1,0,0,0,0|2,0,0]=3 1613 B13R1.696 CCC(C)C(O)c1cccnc1C Amb27174843 [0,1,0,0,0,0|2,0,0]=3 1614 B13R1.696 CCC(C)C(O)c1cccnc1N Amb28256224 [0,1,0,0,0,0|2,0,0]=3 1615 B13R1.696 CCC(C)C(O)c1cnccc1N Amb28045338 [0,1,0,0,0,0|2,0,0]=3 1616 B13R1.696 CCC(C)C(O)c1cncnc1C Amb27795809 [0,1,0,0,0,0|3,0,0]=4 1617 B13R1.696 CCC(C)C(O)c1ncccc1F Amb28041312 [0,1,0,0,0,0|2,0,0]=3 1618 B13R1.696 CCC(C)C(O)c1ncccc1N Amb35622602 [0,1,0,0,0,0|2,0,0]=3 1619 B13R1.696 CCC(C)C(O)c1nccnc1C Amb35602947 [0,1,0,0,0,0|3,0,0]=4 1620 B13R1.696 CCC(C)N(C)c1ccccc1F Amb27826203 [0,1,0,0,0,0|3,0,0]=4 1621 B13R1.696 CCC(C)N(C)c1ccccc1O Amb27749774 [0,1,0,0,0,0|3,0,0]=4 1622 B13R1.696 CCC(C)S(=O)c1ccccc1F Amb27412800 [0,1,0,0,0,0|2,0,1]=4 1623 B13R1.696 CCC(C)S(=O)c1ccccc1N Amb18977317 [0,1,0,0,0,0|2,0,1]=4 1624 B13R1.696 CCC(C)[C@@H](N)c1ccccc1Br Amb27985363 [0,1,0,0,0,0|2,0,0]=3 1625 B13R1.696 CCC(C)[C@@H](N)c1ccccc1Cl Amb28055869 [0,1,0,0,0,0|2,0,0]=3 1626 B13R1.696 CCC(C)[C@@H](N)c1cccnc1Cl Amb27233948 [0,1,0,0,0,0|3,0,0]=4 1627 B13R1.696 CCC(C)[C@@H](N)c1ccncc1Cl Amb27985362 [0,1,0,0,0,0|3,0,0]=4 1628 B13R1.696 CCC(C)[C@H](N)c1ccccc1O Amb28384636 [0,1,0,0,0,0|2,0,0]=3 1629 B13R1.696 CCC(C)[C@H](N)c1cccnc1F Amb28384618 [0,1,0,0,0,0|3,0,0]=4 1630 B13R1.696 CCC(C)[C@H](N)c1ccncc1Cl Amb27878979 [0,1,0,0,0,0|3,0,0]=4 1631 B13R1.696 CCC(N)C(C)c1ccccc1Cl Amb27807135 [0,1,0,0,0,0|3,0,0]=4 1632 B13R1.696 CCC(N)C(N)c1ccccc1Br Amb27776919 [0,1,0,0,0,0|3,0,0]=4 1633 B13R1.696 CCC(N)C(N)c1ccccc1C Amb27874518 [0,1,0,0,0,0|3,0,0]=4 1634 B13R1.696 CCC(N)C(N)c1ccccc1F Amb27792163 [0,1,0,0,0,0|3,0,0]=4 1635 B13R1.696 CCC(N)C(N)c1ccccc1I Amb27430385 [0,1,0,0,0,0|3,0,0]=4 1636 B13R1.696 CCC(N)C(N)c1ccccc1O Amb27430308 [0,1,0,0,0,0|3,0,0]=4 1637 B13R1.696 CCC(N)C(O)c1ccccc1F Amb19149127 [0,1,0,0,0,0|2,0,0]=3 1638 B13R1.696 CCC(N)C(O)c1ccccc1F Amb9429017 [0,1,0,0,0,0|2,0,0]=3 1639 B13R1.696 CCC(N)C(O)c1cccnc1Cl Amb27880635 [0,1,0,0,0,0|3,0,0]=4 1640 B13R1.696 CCC(N)C(O)c1ccncc1F Amb35740733 [0,1,0,0,0,0|3,0,0]=4 1641 B13R1.696 CCC(N)C(O)c1cnccc1N Amb29875501 [0,1,0,0,0,0|3,0,0]=4 1642 B13R1.696 CCC(N)C(O)c1ncccc1C Amb27233918 [0,1,0,0,0,0|3,0,0]=4 1643 B13R1.696 CCC(O)C(N)c1ccccc1Br Amb28281808 [0,1,0,0,0,0|3,0,0]=4 1644 B13R1.696 CCC(O)C(N)c1ccccc1Cl Amb27617875 [0,1,0,0,0,0|3,0,0]=4 1645 B13R1.696 CCC(O)C(O)c1cccnc1N Amb27776402 [0,1,0,0,0,0|3,0,0]=4 1646 B13R1.696 CC[C@@H](N)C(O)c1ccccc1C Amb35659373 [0,1,0,0,0,0|2,0,0]=3 1647 B13R1.696 CC[C@@H](N)C(O)c1ccccc1Cl Amb35659338 [0,1,0,0,0,0|2,0,0]=3 1648 B13R1.696 CC[C@@H](N)C(O)c1ccccc1F Amb35659339 [0,1,0,0,0,0|2,0,0]=3 1649 B13R1.696 CC[C@@H](N)C(O)c1cccnc1N Amb30038887 [0,1,0,0,0,0|3,0,0]=4 1650 B13R1.696 CC[C@@H](N)C(O)c1ccncc1F Amb35601471 [0,1,0,0,0,0|3,0,0]=4 1651 B13R1.696 CC[C@@H](N)C(O)c1cnccc1C Amb35659414 [0,1,0,0,0,0|3,0,0]=4 1652 B13R1.696 CC[C@@H](N)C(O)c1cnccc1N Amb30038886 [0,1,0,0,0,0|3,0,0]=4 1653 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1Br Amb27445501 [0,1,0,0,0,0|2,0,0]=3 1654 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1C Amb27445509 [0,1,0,0,0,0|2,0,0]=3 1655 B13R1.696 CC[C@@H](N)[C@@H](O)c1cccnc1C Amb27777342 [0,1,0,0,0,0|3,0,0]=4 1656 B13R1.696 CC[C@@H](N)[C@@H](O)c1ncccc1C Amb27848282 [0,1,0,0,0,0|3,0,0]=4 1657 B13R1.696 CC[C@@H](N)[C@@H](O)c1ncccc1O Amb28326109 [0,1,0,0,0,0|3,0,0]=4 1658 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1Br Amb27205110 [0,1,0,0,0,0|2,0,0]=3 1659 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1C Amb27430242 [0,1,0,0,0,0|2,0,0]=3 1660 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1N Amb27964149 [0,1,0,0,0,0|2,0,0]=3 1661 B13R1.696 CC[C@@H](N)[C@H](O)c1cccnc1C Amb27964132 [0,1,0,0,0,0|3,0,0]=4 1662 B13R1.696 CC[C@@H](N)[C@H](O)c1cnccc1C Amb27430243 [0,1,0,0,0,0|3,0,0]=4 1663 B13R1.696 CC[C@@H](N)[C@H](O)c1cnccc1Cl Amb28129293 [0,1,0,0,0,0|3,0,0]=4 1664 B13R1.696 CC[C@@H](N)[C@H](O)c1ncccc1C Amb27964147 [0,1,0,0,0,0|3,0,0]=4 1665 B13R1.696 CC[C@@H](N)[C@H](O)c1ncccc1F Amb27629695 [0,1,0,0,0,0|3,0,0]=4 1666 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1Br Amb28289649 [0,1,0,0,0,0|3,0,0]=4 1667 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1F Amb28256732 [0,1,0,0,0,0|3,0,0]=4 1668 B13R1.696 CC[C@H](N)C(O)c1ccccc1C Amb35601234 [0,1,0,0,0,0|2,0,0]=3 1669 B13R1.696 CC[C@H](N)C(O)c1ccccc1Cl Amb35601342 [0,1,0,0,0,0|2,0,0]=3 1670 B13R1.696 CC[C@H](N)C(O)c1ccccc1F Amb35601343 [0,1,0,0,0,0|2,0,0]=3 1671 B13R1.696 CC[C@H](N)C(O)c1cccnc1N Amb35596800 [0,1,0,0,0,0|3,0,0]=4 1672 B13R1.696 CC[C@H](N)C(O)c1ccncc1F Amb35597756 [0,1,0,0,0,0|3,0,0]=4 1673 B13R1.696 CC[C@H](N)C(O)c1cnccc1C Amb35601514 [0,1,0,0,0,0|3,0,0]=4 1674 B13R1.696 CC[C@H](N)C(O)c1cnccc1N Amb35596799 [0,1,0,0,0,0|3,0,0]=4 1675 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1C Amb28384672 [0,1,0,0,0,0|3,0,0]=4 1676 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1Cl Amb27430304 [0,1,0,0,0,0|3,0,0]=4 1677 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1I Amb27785046 [0,1,0,0,0,0|3,0,0]=4 1678 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1O Amb27620451 [0,1,0,0,0,0|3,0,0]=4 1679 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1Cl Amb27430474 [0,1,0,0,0,0|2,0,0]=3 1680 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1F Amb27630528 [0,1,0,0,0,0|2,0,0]=3 1681 B13R1.696 CC[C@H](N)[C@@H](O)c1cccnc1Cl Amb27234021 [0,1,0,0,0,0|3,0,0]=4 1682 B13R1.696 CC[C@H](N)[C@@H](O)c1cnccc1C Amb27205213 [0,1,0,0,0,0|3,0,0]=4 1683 B13R1.696 CC[C@H](N)[C@@H](O)c1ncccc1O Amb28326108 [0,1,0,0,0,0|3,0,0]=4 1684 B13R1.696 CC[C@H](N)[C@H](O)c1ccccc1Br Amb27792205 [0,1,0,0,0,0|2,0,0]=3 1685 B13R1.696 CC[C@H](N)[C@H](O)c1cccnc1N Amb27430305 [0,1,0,0,0,0|3,0,0]=4 1686 B13R1.696 CC[C@H](N)[C@H](O)c1cnccc1C Amb27881791 [0,1,0,0,0,0|3,0,0]=4 1687 B13R1.696 CC[C@H](N)[C@H](O)c1ncccc1Cl Amb28140773 [0,1,0,0,0,0|3,0,0]=4 1688 B13R1.696 CC[C@H](N)[C@H](O)c1ncccc1F Amb28057572 [0,1,0,0,0,0|3,0,0]=4 1689 B13R1.696 CC[C@H](N)[C@H](O)c1ncccc1N Amb27444855 [0,1,0,0,0,0|3,0,0]=4 1690 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1C Amb28348708 [0,1,0,0,0,0|3,0,0]=4 1691 B13R1.696 CNC(=O)C(C)c1ccccc1C Amb27179428 [0,1,0,0,0,0|2,0,1]=4 1692 B13R1.696 CNC(=O)C(C)c1ccccc1Cl Amb2444727 [0,1,0,0,0,0|2,0,1]=4 1693 B13R1.696 CNC(=O)C(Cl)c1ccccc1F Amb27812873 [0,1,0,0,0,0|2,0,1]=4 1694 B13R1.696 CNC(=O)C(N)c1ccccc1Br Amb27143467 [0,1,0,0,0,0|2,0,1]=4 1695 B13R1.696 CNC(=O)C(N)c1ccccc1C Amb25127837 [0,1,0,0,0,0|2,0,1]=4 1696 B13R1.696 CNC(=O)C(N)c1ccccc1Cl Amb24733869 [0,1,0,0,0,0|2,0,1]=4 1697 B13R1.696 CNC(=O)C(N)c1ccccc1F Amb28188743 [0,1,0,0,0,0|2,0,1]=4 1698 B13R1.696 CNC(=O)C(O)c1ccccc1Br Amb27196729 [0,1,0,0,0,0|1,0,1]=3 1699 B13R1.696 CNC(=O)C(O)c1ccccc1C Amb25949513 [0,1,0,0,0,0|1,0,1]=3 1700 B13R1.696 CNC(=O)C(O)c1ccccc1F Amb25936901 [0,1,0,0,0,0|1,0,1]=3 1701 B13R1.696 CNC(=O)C(O)c1ncccc1C Amb27766264 [0,1,0,0,0,0|2,0,1]=4 1702 B13R1.696 CNC(=O)N(O)c1ccccc1C Amb27622172 [0,1,0,0,0,0|2,0,1]=4 1703 B13R1.696 CNC(=O)N(O)c1ccccc1Cl Amb22433830 [0,1,0,0,0,0|2,0,1]=4 1704 B13R1.696 CNC(=O)[C@H](O)c1ccccc1Cl Amb27457359 [0,1,0,0,0,0|1,0,1]=3 1705 B13R1.696 CNC(C)C(=O)c1ccccc1Br Amb26514902 [0,1,0,0,0,0|0,0,2]=3 1706 B13R1.696 CNC(C)C(=O)c1ccccc1C Amb25836669 [0,1,0,0,0,0|0,0,2]=3 1707 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb25228402 [0,1,0,0,0,0|0,0,2]=3 1708 B13R1.696 CNC(C)C(C)c1ccccc1Br Amb27949357 [0,1,0,0,0,0|1,0,0]=2 1709 B13R1.696 CNC(C)C(O)c1ccccc1C Amb35741407 [0,1,0,0,0,0|0,0,0]=1 1710 B13R1.696 CNC(C)C(O)c1ccccc1F Amb35621407 [0,1,0,0,0,0|0,0,0]=1 1711 B13R1.696 CNC(C)C(O)c1cccnc1N Amb35621615 [0,1,0,0,0,0|1,0,0]=2 1712 B13R1.696 CNC(C)C(O)c1ccncc1F Amb35624559 [0,1,0,0,0,0|1,0,0]=2 1713 B13R1.696 CNC(C)C(O)c1cnccc1C Amb35741400 [0,1,0,0,0,0|1,0,0]=2 1714 B13R1.696 CNC(C)C(O)c1cnccc1N Amb35621603 [0,1,0,0,0,0|1,0,0]=2 1715 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1C Amb35659960 [0,1,0,0,0,0|0,0,2]=3 1716 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1Cl Amb29891464 [0,1,0,0,0,0|0,0,2]=3 1717 B13R1.696 CN[C@@H](C)C(=O)c1ccccc1F Amb35659965 [0,1,0,0,0,0|0,0,2]=3 1718 B13R1.696 CN[C@@H](C)C(=O)c1cccnc1N Amb35659964 [0,1,0,0,0,0|1,0,2]=4 1719 B13R1.696 CN[C@@H](C)C(=O)c1ccncc1F Amb29891458 [0,1,0,0,0,0|1,0,2]=4 1720 B13R1.696 CN[C@@H](C)C(=O)c1cnccc1C Amb35659961 [0,1,0,0,0,0|1,0,2]=4 1721 B13R1.696 CN[C@@H](C)C(=O)c1cnccc1N Amb35659963 [0,1,0,0,0,0|1,0,2]=4 1722 B13R1.696 CN[C@@H](C)C(O)c1ccccc1C Amb35662207 [0,1,0,0,0,0|0,0,0]=1 1723 B13R1.696 CN[C@@H](C)C(O)c1ccccc1Cl Amb35662568 [0,1,0,0,0,0|0,0,0]=1 1724 B13R1.696 CN[C@@H](C)C(O)c1ccccc1F Amb35662596 [0,1,0,0,0,0|0,0,0]=1 1725 B13R1.696 CN[C@@H](C)C(O)c1cccnc1N Amb29891490 [0,1,0,0,0,0|1,0,0]=2 1726 B13R1.696 CN[C@@H](C)C(O)c1ccncc1F Amb35659714 [0,1,0,0,0,0|1,0,0]=2 1727 B13R1.696 CN[C@@H](C)C(O)c1cnccc1C Amb30038954 [0,1,0,0,0,0|1,0,0]=2 1728 B13R1.696 CN[C@@H](C)C(O)c1cnccc1N Amb29891489 [0,1,0,0,0,0|1,0,0]=2 1729 B13R1.696 CN[C@@H](C)[C@H](O)c1ccccc1Cl Amb27793498 [0,1,0,0,0,0|0,0,0]=1 1730 B13R1.696 CN[C@H](C)[C@@H](O)c1ccccc1Cl Amb28123192 [0,1,0,0,0,0|0,0,0]=1 1731 B13R1.696 COC(=N)C(O)c1ccccc1F Amb27978331 [0,1,0,0,0,0|2,0,1]=4 1732 B13R1.696 COC(=O)C(O)c1ccccc1Br Amb23596557 [0,1,0,0,0,0|2,0,1]=4 1733 B13R1.696 COC(=O)C(O)c1ccccc1C Amb18809302 [0,1,0,0,0,0|2,0,1]=4 1734 B13R1.696 COC(=O)C(O)c1ccccc1Cl Amb8383971 [0,1,0,0,0,0|2,0,1]=4 1735 B13R1.696 COC(=O)C(O)c1ccccc1F Amb19074670 [0,1,0,0,0,0|2,0,1]=4 1736 B13R1.696 COC(=O)C(O)c1ccccc1O Amb24408426 [0,1,0,0,0,0|2,0,1]=4 1737 B13R1.696 COC(=O)[C@@H](O)c1ccccc1Cl Amb19131235 [0,1,0,0,0,0|2,0,1]=4 1738 B13R1.696 COC(=O)[C@H](O)c1ccccc1Cl Amb17610948 [0,1,0,0,0,0|2,0,1]=4 1739 B13R1.696 COC(C)C(C)c1ccccc1N Amb27864034 [0,1,0,0,0,0|2,0,0]=3 1740 B13R1.696 COC(C)C(N)c1cccnc1N Amb27416132 [0,1,0,0,0,0|3,0,0]=4 1741 B13R1.696 COC(C)C(O)c1ccccc1C Amb27458098 [0,1,0,0,0,0|1,0,0]=2 1742 B13R1.696 COC(C)C(O)c1cccnc1Br Amb35670264 [0,1,0,0,0,0|2,0,0]=3 1743 B13R1.696 COC(C)C(O)c1cnccc1C Amb27416073 [0,1,0,0,0,0|2,0,0]=3 1744 B13R1.696 C[C@H](C=O)[C@H](O)c1ccccc1Cl Amb27966675 [0,1,0,0,0,0|2,0,0]=3 1745 B13R1.696 Cc1ccccc1C(C)C(C)CN Amb25068214 [0,1,0,0,0,0|3,0,0]=4 1746 B13R1.696 Cc1ccccc1C(C)C(C)CO Amb26963342 [0,1,0,0,0,0|3,0,0]=4 1747 B13R1.696 Cc1ccccc1C(C)[C@@H](C)CN Amb33744943 [0,1,0,0,0,0|3,0,0]=4 1748 B13R1.696 Cc1ccccc1C(C)[C@@H](C)CO Amb33736431 [0,1,0,0,0,0|3,0,0]=4 1749 B13R1.696 Cc1ccccc1C(C)[C@H](C)CN Amb33730085 [0,1,0,0,0,0|3,0,0]=4 1750 B13R1.696 Cc1ccccc1C(C)[C@H](C)CO Amb33738439 [0,1,0,0,0,0|3,0,0]=4 1751 B13R1.696 Cc1ccccc1C(O)C(=O)NN Amb9768588 [0,1,0,0,0,0|2,0,1]=4 1752 B13R1.696 Cc1ccccc1C(O)C(C)C#N Amb27207214 [0,1,0,0,0,0|2,0,0]=3 1753 B13R1.696 Cc1ccccc1C(O)C(C)CN Amb27248239 [0,1,0,0,0,0|2,0,0]=3 1754 B13R1.696 Cc1ccncc1C(O)C(C)CN Amb26593739 [0,1,0,0,0,0|3,0,0]=4 1755 B13R1.696 Cc1cnccc1C(O)C(C)C#N Amb28324029 [0,1,0,0,0,0|3,0,0]=4 1756 B13R1.696 Cc1cnccc1C(O)C(C)CN Amb24646274 [0,1,0,0,0,0|3,0,0]=4 1757 B13R1.696 N=C(NO)C(O)c1ccccc1Cl Amb28456439 [0,1,0,0,0,0|2,0,1]=4 1758 B13R1.696 NC(CO)C(O)c1ccccc1Br Amb18717858 [0,1,0,0,0,0|3,0,0]=4 1759 B13R1.696 NNC(=O)C(O)c1ccccc1O Amb27802468 [0,1,0,0,0,0|2,0,1]=4 1760 B13R1.708 C#CC(C)C(C)(C)c1ccccc1 Amb33175840 [0,1,0,0,0,0|2,0,1]=4 1761 B13R1.708 C#CC(C)C(F)(F)c1ccccc1 Amb33082225 [0,1,0,0,0,0|2,0,1]=4 1762 B13R1.708 C=C[C@@H](C)[C@@](C)(N)c1ccccc1 Amb27415676 [0,1,0,0,0,0|2,0,1]=4 1763 B13R1.708 C=C[C@H](C)[C@@](C)(N)c1ccccc1 Amb27389997 [0,1,0,0,0,0|2,0,1]=4 1764 B13R1.708 CC(C#N)C(C)(C)c1ccccc1 Amb18127125 [0,1,0,0,0,0|3,0,0]=4 1765 B13R1.708 CC(C#N)C(C)(O)c1ccccc1 Amb598103 [0,1,0,0,0,0|2,0,0]=3 1766 B13R1.708 CC(C#N)C(F)(F)c1ccccc1 Amb33081964 [0,1,0,0,0,0|3,0,0]=4 1767 B13R1.708 CC(C=O)C(C)(C)c1ccccc1 Amb27949663 [0,1,0,0,0,0|3,0,0]=4 1768 B13R1.708 CC(C=O)C(F)(F)c1ccccc1 Amb33082207 [0,1,0,0,0,0|3,0,0]=4 1769 B13R1.708 CC(CBr)C(C)(C)c1ccccc1 Amb33175833 [0,1,0,0,0,0|3,0,0]=4 1770 B13R1.708 CC(CBr)C(F)(F)c1ccccc1 Amb33082220 [0,1,0,0,0,0|3,0,0]=4 1771 B13R1.708 CC(CN)C(C)(C)c1ccccc1 Amb33475497 [0,1,0,0,0,0|3,0,0]=4 1772 B13R1.708 CC(CN)C(C)(O)c1ccccc1 Amb27207211 [0,1,0,0,0,0|2,0,0]=3 1773 B13R1.708 CC(CN)C(C)(O)c1ccccn1 Amb27803175 [0,1,0,0,0,0|3,0,0]=4 1774 B13R1.708 CC(CN)C(F)(F)c1ccccc1 Amb33081972 [0,1,0,0,0,0|3,0,0]=4 1775 B13R1.708 CC(CO)C(C)(C)c1ccccc1 Amb26943202 [0,1,0,0,0,0|3,0,0]=4 1776 B13R1.708 CC(CO)C(C)(N)c1ccccc1 Amb35648872 [0,1,0,0,0,0|3,0,0]=4 1777 B13R1.708 CC(CO)C(C)(O)c1ccccc1 Amb27485895 [0,1,0,0,0,0|2,0,0]=3 1778 B13R1.708 CC(CO)C(F)(F)c1ccccc1 Amb33740097 [0,1,0,0,0,0|3,0,0]=4 1779 B13R1.708 CC(O)(C(=O)NN)c1ccccc1 Amb28410448 [0,1,0,0,0,0|2,0,1]=4 1780 B13R1.708 CC(ON)C(C)(C)c1ccccc1 Amb33175839 [0,1,0,0,0,0|3,0,0]=4 1781 B13R1.708 CC(ON)C(F)(F)c1ccccc1 Amb33082199 [0,1,0,0,0,0|3,0,0]=4 1782 B13R1.708 CCC(C)C(C)(O)c1ccccn1 Amb27781185 [0,1,0,0,0,0|2,0,0]=3 1783 B13R1.708 CCC(C)C(C)(O)c1cncnc1 Amb18186682 [0,1,0,0,0,0|3,0,0]=4 1784 B13R1.708 CCC(C)S(=O)(=O)c1ccccc1 Amb27804676 [0,1,0,0,0,0|2,0,1]=4 1785 B13R1.708 CCC(N)C(C)(C)c1ccccc1 Amb18303249 [0,1,0,0,0,0|3,0,0]=4 1786 B13R1.708 CCC(O)C(C)(C)c1ccccc1 Amb18178607 [0,1,0,0,0,0|3,0,0]=4 1787 B13R1.708 CCC(O)C(C)(N)c1ccccc1 Amb35584277 [0,1,0,0,0,0|3,0,0]=4 1788 B13R1.708 CCC(O)C(C)(O)c1cccnc1 Amb27617828 [0,1,0,0,0,0|3,0,0]=4 1789 B13R1.708 CNC(=N)C(C)(C)c1ccccc1 Amb27460930 [0,1,0,0,0,0|2,0,1]=4 1790 B13R1.708 CNC(=O)C(C)(C)c1ccccc1 Amb8333371 [0,1,0,0,0,0|2,0,1]=4 1791 B13R1.708 CNC(=O)C(C)(O)c1ccccc1 Amb28068753 [0,1,0,0,0,0|1,0,1]=3 1792 B13R1.708 CNC(C)C(C)(O)c1ccccc1 Amb27209525 [0,1,0,0,0,0|0,0,0]=1 1793 B13R1.708 CN[C@H](C)[C@@](C)(O)c1ccccc1 Amb27848220 [0,1,0,0,0,0|0,0,0]=1 1794 B13R1.708 COC(=O)C(C)(O)c1ccccc1 Amb18186543 [0,1,0,0,0,0|2,0,1]=4 1795 B13R1.708 COC(C)C(C)(O)c1cccnc1 Amb28077579 [0,1,0,0,0,0|2,0,0]=3 1796 B13R1.708 COC(O)C(F)(F)c1ccccc1 Amb27456654 [0,1,0,0,0,0|3,0,0]=4 1797 B13R1.708 C[C@@H](CN)C(C)(C)c1ccccc1 Amb33727428 [0,1,0,0,0,0|3,0,0]=4 1798 B13R1.708 C[C@@H](CN)C(F)(F)c1ccccc1 Amb33727237 [0,1,0,0,0,0|3,0,0]=4 1799 B13R1.708 C[C@@H](CO)C(C)(C)c1ccccc1 Amb33735561 [0,1,0,0,0,0|3,0,0]=4 1800 B13R1.708 C[C@@H](CO)C(F)(F)c1ccccc1 Amb33727006 [0,1,0,0,0,0|3,0,0]=4 1801 B13R1.708 C[C@@H](CO)[C@](C)(O)c1ccccc1 Amb28207310 [0,1,0,0,0,0|2,0,0]=3 1802 B13R1.708 C[C@H](CN)C(C)(C)c1ccccc1 Amb33747425 [0,1,0,0,0,0|3,0,0]=4 1803 B13R1.708 C[C@H](CN)C(F)(F)c1ccccc1 Amb33738141 [0,1,0,0,0,0|3,0,0]=4 1804 B13R1.708 C[C@H](CO)C(C)(C)c1ccccc1 Amb33730455 [0,1,0,0,0,0|3,0,0]=4 1805 B13R1.708 C[C@H](CO)C(F)(F)c1ccccc1 Amb33733099 [0,1,0,0,0,0|3,0,0]=4 1806 B13R1.708 [C-]#[N+]C(C)C(C)(C)c1ccccc1 Amb33481074 [0,1,0,0,0,0|1,0,2]=4 1807 B13R1.708 [C-]#[N+]C(C)C(F)(F)c1ccccc1 Amb33082017 [0,1,0,0,0,0|1,0,2]=4 1808 B13R2.15 BrC1CCCC1c2ccccc2 Amb27487943 [0,0,0,1,0,0|3,0,0]=4 1809 B13R2.15 CC1CCCC1c2ccccc2 Amb28060308 [0,0,0,1,0,0|2,0,0]=3 1810 B13R2.15 CC1CCN=C1c2ccccc2 Amb26867229 [0,0,0,1,0,0|2,0,1]=4 1811 B13R2.15 CC1CCNC1c2ccccc2 Amb33533836 [0,0,0,1,0,0|2,0,0]=3 1812 B13R2.15 CC1CCNC1c2cccnc2 Amb3788163 [0,0,0,1,0,0|3,0,0]=4 1813 B13R2.15 CC1CNCC1c2ccccc2 Amb24312553 [0,0,0,1,0,0|3,0,0]=4 1814 B13R2.15 CC1NCCC1c2ccccc2 Amb18279882 [0,0,0,1,0,0|1,0,0]=2 1815 B13R2.15 CC1NCCC1c2cnccn2 Amb35600826 [0,0,0,1,0,0|3,0,0]=4 1816 B13R2.15 CC1NCCC1c2cncnc2 Amb27215030 [0,0,0,1,0,0|3,0,0]=4 1817 B13R2.15 CC1OCNC1c2ccccc2 Amb27614663 [0,0,0,1,0,0|2,0,0]=3 1818 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [0,0,0,1,0,0|3,0,0]=4 1819 B13R2.15 CN1CCC[C@H]1c2ccccc2 Amb27603452 [0,0,0,1,0,0|3,0,0]=4 1820 B13R2.15 CN1CCOC1c2ccccc2 Amb3735625 [0,0,0,1,0,0|2,0,0]=3 1821 B13R2.15 CN1CCOC1c2ccccn2 Amb17334611 [0,0,0,1,0,0|3,0,0]=4 1822 B13R2.15 CN1CCOC1c2cccnc2 Amb17334613 [0,0,0,1,0,0|3,0,0]=4 1823 B13R2.15 CN1CCOC1c2ccncc2 Amb17334615 [0,0,0,1,0,0|3,0,0]=4 1824 B13R2.15 C[C@@H]1CCN[C@H]1c2ccccc2 Amb18829884 [0,0,0,1,0,0|2,0,0]=3 1825 B13R2.15 C[C@@H]1CCN[C@H]1c2ccccn2 Amb18829584 [0,0,0,1,0,0|3,0,0]=4 1826 B13R2.15 C[C@@H]1CCN[C@H]1c2cccnc2 Amb18829583 [0,0,0,1,0,0|3,0,0]=4 1827 B13R2.15 C[C@@H]1CCN[C@H]1c2ccncc2 Amb18829582 [0,0,0,1,0,0|3,0,0]=4 1828 B13R2.15 C[C@@H]1NCCC1c2ccccc2 Amb27616689 [0,0,0,1,0,0|1,0,0]=2 1829 B13R2.15 C[C@@H]1NCC[C@H]1c2ccccc2 Amb27420012 [0,0,0,1,0,0|1,0,0]=2 1830 B13R2.15 C[C@@H]1NCO[C@H]1c2ccccc2 Amb27441137 [0,0,0,1,0,0|0,0,0]=1 1831 B13R2.15 C[C@@H]1OCN[C@H]1c2ccccc2 Amb28385033 [0,0,0,1,0,0|2,0,0]=3 1832 B13R2.15 C[C@H]1CCN[C@@H]1c2ccccc2 Amb27252946 [0,0,0,1,0,0|2,0,0]=3 1833 B13R2.15 C[C@H]1CCN[C@@H]1c2ccccn2 Amb27420243 [0,0,0,1,0,0|3,0,0]=4 1834 B13R2.15 C[C@H]1OCN[C@H]1c2ccccc2 Amb27441110 [0,0,0,1,0,0|2,0,0]=3 1835 B13R2.15 ClC1C=NOC1c2ccccc2 Amb28078048 [0,0,0,1,0,0|3,0,0]=4 1836 B13R2.15 ClC1CCCC1c2ccccc2 Amb18184968 [0,0,0,1,0,0|3,0,0]=4 1837 B13R2.15 ClC1CCOC1c2ccccc2 Amb27634832 [0,0,0,1,0,0|2,0,0]=3 1838 B13R2.15 N=C1NCCC1c2ccccc2 Amb27791860 [0,0,0,1,0,0|2,0,1]=4 1839 B13R2.15 NC1CCCC1c2ccccc2 Amb17506307 [0,0,0,1,0,0|3,0,0]=4 1840 B13R2.15 NC1CCCC1c2ccccc2 Amb32652751 [0,0,0,1,0,0|3,0,0]=4 1841 B13R2.15 NC1CCNC1c2ccccc2 Amb18829599 [0,0,0,1,0,0|3,0,0]=4 1842 B13R2.15 NC1CCOC1c2ccccc2 Amb20623662 [0,0,0,1,0,0|2,0,0]=3 1843 B13R2.15 NC1CCOC1c2cccnc2 Amb32666104 [0,0,0,1,0,0|3,0,0]=4 1844 B13R2.15 NC1CCOC1c2ccncc2 Amb27658573 [0,0,0,1,0,0|3,0,0]=4 1845 B13R2.15 NC1CCOC1c2ccncc2 Amb32661506 [0,0,0,1,0,0|3,0,0]=4 1846 B13R2.15 N[C@@H]1CCC[C@@H]1c2ccccc2 Amb22745600 [0,0,0,1,0,0|3,0,0]=4 1847 B13R2.15 N[C@@H]1CCC[C@@H]1c2ccccc2 Amb32655988 [0,0,0,1,0,0|3,0,0]=4 1848 B13R2.15 N[C@@H]1CCC[C@H]1c2ccccc2 Amb25168925 [0,0,0,1,0,0|3,0,0]=4 1849 B13R2.15 N[C@@H]1CCC[C@H]1c2ccccc2 Amb28617037 [0,0,0,1,0,0|3,0,0]=4 1850 B13R2.15 N[C@@H]1CCO[C@@H]1c2ccccc2 Amb34915523 [0,0,0,1,0,0|2,0,0]=3 1851 B13R2.15 N[C@@H]1CCO[C@@H]1c2cccnc2 Amb34915533 [0,0,0,1,0,0|3,0,0]=4 1852 B13R2.15 N[C@@H]1CCO[C@@H]1c2ccncc2 Amb34915529 [0,0,0,1,0,0|3,0,0]=4 1853 B13R2.15 N[C@@H]1CCO[C@H]1c2ccccc2 Amb25289028 [0,0,0,1,0,0|2,0,0]=3 1854 B13R2.15 N[C@@H]1CCO[C@H]1c2cccnc2 Amb32668943 [0,0,0,1,0,0|3,0,0]=4 1855 B13R2.15 N[C@@H]1CCO[C@H]1c2ccncc2 Amb28455729 [0,0,0,1,0,0|3,0,0]=4 1856 B13R2.15 N[C@@H]1CCO[C@H]1c2ccncc2 Amb32668960 [0,0,0,1,0,0|3,0,0]=4 1857 B13R2.15 N[C@H]1CCC[C@H]1c2ccccc2 Amb27419894 [0,0,0,1,0,0|3,0,0]=4 1858 B13R2.15 N[C@H]1CCC[C@H]1c2ccccc2 Amb33804658 [0,0,0,1,0,0|3,0,0]=4 1859 B13R2.15 N[C@H]1CCO[C@@H]1c2cccnc2 Amb28679406 [0,0,0,1,0,0|3,0,0]=4 1860 B13R2.15 N[C@H]1CCO[C@@H]1c2ccncc2 Amb27803064 [0,0,0,1,0,0|3,0,0]=4 1861 B13R2.15 N[C@H]1CCO[C@@H]1c2ccncc2 Amb28717822 [0,0,0,1,0,0|3,0,0]=4 1862 B13R2.15 O=C1CCOC1c2ccccc2 Amb27177705 [0,0,0,1,0,0|2,0,1]=4 1863 B13R2.15 O=C1NCCC1c2ccccc2 Amb17400090 [0,0,0,1,0,0|2,0,1]=4 1864 B13R2.15 O=C1NCC[C@@H]1c2ccccc2 Amb28316759 [0,0,0,1,0,0|2,0,1]=4 1865 B13R2.15 O=C1NCC[C@H]1c2ccccc2 Amb27852446 [0,0,0,1,0,0|2,0,1]=4 1866 B13R2.15 O=C1NCOC1c2ccccc2 Amb28243816 [0,0,0,1,0,0|1,0,1]=3 1867 B13R2.15 OC1CCCC1c2ccccc2 Amb18798120 [0,0,0,1,0,0|3,0,0]=4 1868 B13R2.15 OC1CCNC1c2ccccc2 Amb18829239 [0,0,0,1,0,0|3,0,0]=4 1869 B13R2.15 OC1CCNC1c2ccccc2 Amb32411999 [0,0,0,1,0,0|3,0,0]=4 1870 B13R2.15 OC1CCO[C@@H]1c2ccccc2 Amb28454218 [0,0,0,1,0,0|2,0,0]=3 1871 B13R2.15 OC1OCCC1c2ccccc2 Amb22752503 [0,0,0,1,0,0|3,0,0]=4 1872 B13R2.15 O[C@@H]1CCC[C@@H]1c2ccccc2 Amb27255257 [0,0,0,1,0,0|3,0,0]=4 1873 B13R2.15 O[C@@H]1CCC[C@H]1c2ccccc2 Amb24678146 [0,0,0,1,0,0|3,0,0]=4 1874 B13R2.15 O[C@H]1CCC[C@@H]1c2ccccc2 Amb25236019 [0,0,0,1,0,0|3,0,0]=4 1875 B13R2.15 O[C@H]1CCC[C@H]1c2ccccc2 Amb28053441 [0,0,0,1,0,0|3,0,0]=4 1876 B13R2.15 O[C@H]1CCO[C@H]1c2ccccc2 Amb27443576 [0,0,0,1,0,0|2,0,0]=3 1877 B13R2.32 BrC1CCc2ccccc2C1Br Amb4020672 [0,0,0,1,0,0|3,0,0]=4 1878 B13R2.32 CC1=C(C)c2ccccc2CN1 Amb27392086 [0,0,0,1,0,0|1,0,2]=4 1879 B13R2.32 CC1C=Cc2ccccc2C1O Amb25098603 [0,0,0,1,0,0|1,0,1]=3 1880 B13R2.32 CC1CCc2ccccc2C1=O Amb6357464 [0,0,0,1,0,0|1,0,2]=4 1881 B13R2.32 CC1CCc2ccccc2C1Br Amb25106373 [0,0,0,1,0,0|2,0,0]=3 1882 B13R2.32 CC1CCc2ccccc2C1N Amb30584820 [0,0,0,1,0,0|2,0,0]=3 1883 B13R2.32 CC1CCc2ccccc2C1N Amb9782750 [0,0,0,1,0,0|2,0,0]=3 1884 B13R2.32 CC1CCc2ccccc2C1O Amb18800659 [0,0,0,1,0,0|1,0,0]=2 1885 B13R2.32 CC1CCc2ccccc2N1N Amb18829618 [0,0,0,1,0,0|3,0,0]=4 1886 B13R2.32 CC1CCc2ccccc2[C@H]1O Amb28194260 [0,0,0,1,0,0|1,0,0]=2 1887 B13R2.32 CC1CCc2ccncc2C1N Amb27965734 [0,0,0,1,0,0|3,0,0]=4 1888 B13R2.32 CC1CCc2ncccc2C1N Amb27445642 [0,0,0,1,0,0|3,0,0]=4 1889 B13R2.32 CC1COc2ccccc2C1N Amb32751223 [0,0,0,1,0,0|3,0,0]=4 1890 B13R2.32 CC1COc2ccccc2C1N Amb9783174 [0,0,0,1,0,0|3,0,0]=4 1891 B13R2.32 CC1COc2ccccc2C1O Amb25074476 [0,0,0,1,0,0|2,0,0]=3 1892 B13R2.32 CC1COc2ccccc2C1S Amb27255542 [0,0,0,1,0,0|2,1,0]=4 1893 B13R2.32 CC1SCc2ccccc2C1N Amb28046566 [0,0,0,1,0,0|2,0,0]=3 1894 B13R2.32 CC1c2ccccc2CCC1O Amb25861319 [0,0,0,1,0,0|3,0,0]=4 1895 B13R2.32 CC1c2ccccc2CCN1C Amb28434667 [0,0,0,1,0,0|3,0,0]=4 1896 B13R2.32 CN1CCc2ccccc2C1O Amb27193085 [0,0,0,1,0,0|2,0,0]=3 1897 B13R2.32 CN1NCc2ccccc2C1=O Amb24556524 [0,0,0,1,0,0|1,0,2]=4 1898 B13R2.32 CN1NCc2ccccc2C1=O Amb32652549 [0,0,0,1,0,0|1,0,2]=4 1899 B13R2.32 C[C@@H]1C=Cc2ccccc2[C@@H]1O Amb26058397 [0,0,0,1,0,0|1,0,1]=3 1900 B13R2.32 C[C@@H]1C=Cc2ccccc2[C@H]1O Amb26015042 [0,0,0,1,0,0|1,0,1]=3 1901 B13R2.32 C[C@@H]1CCc2ccccc2[C@@H]1N Amb27461977 [0,0,0,1,0,0|2,0,0]=3 1902 B13R2.32 C[C@@H]1CCc2ccccc2[C@H]1O Amb28061859 [0,0,0,1,0,0|1,0,0]=2 1903 B13R2.32 C[C@@H]1COc2ccccc2[C@@H]1N Amb27623300 [0,0,0,1,0,0|3,0,0]=4 1904 B13R2.32 C[C@@H]1COc2ccccc2[C@H]1N Amb28457498 [0,0,0,1,0,0|3,0,0]=4 1905 B13R2.32 C[C@H]1C=Cc2ccccc2[C@H]1O Amb27255258 [0,0,0,1,0,0|1,0,1]=3 1906 B13R2.32 ClC1CCc2ccccc2C1Cl Amb27799784 [0,0,0,1,0,0|3,0,0]=4 1907 B13R2.32 Cl[C@@H]1CCc2ccccc2[C@H]1Cl Amb28287713 [0,0,0,1,0,0|3,0,0]=4 1908 B13R2.32 F[C@H]1c2ccccc2CC[C@@H]1Cl Amb28436893 [0,0,0,1,0,0|3,0,0]=4 1909 B13R2.32 NC1C(=O)NCc2ccccc21 Amb21857372 [0,0,0,1,0,0|2,0,1]=4 1910 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22436817 [0,0,0,1,0,0|2,0,1]=4 1911 B13R2.32 NC1CCc2ccccc2C1N Amb18645719 [0,0,0,1,0,0|3,0,0]=4 1912 B13R2.32 NC1CCc2ccccc2C1O Amb21964517 [0,0,0,1,0,0|2,0,0]=3 1913 B13R2.32 NC1CCc2ccccc2C1O Amb2383071 [0,0,0,1,0,0|2,0,0]=3 1914 B13R2.32 NC1COc2ccccc2C1O Amb28555781 [0,0,0,1,0,0|3,0,0]=4 1915 B13R2.32 NC1COc2ccccc2C1O Amb8439667 [0,0,0,1,0,0|3,0,0]=4 1916 B13R2.32 NC1CSc2ccccc2C1O Amb28122857 [0,0,0,1,0,0|3,0,0]=4 1917 B13R2.32 NC1c2ccccc2CCC1Br Amb32752747 [0,0,0,1,0,0|3,0,0]=4 1918 B13R2.32 NC1c2ccccc2CCC1Cl Amb32698023 [0,0,0,1,0,0|3,0,0]=4 1919 B13R2.32 NC1c2ccccc2CCC1F Amb25117934 [0,0,0,1,0,0|3,0,0]=4 1920 B13R2.32 NC1c2ccccc2CCC1F Amb29990260 [0,0,0,1,0,0|3,0,0]=4 1921 B13R2.32 NC1c2ccccc2CCC1O Amb18645888 [0,0,0,1,0,0|3,0,0]=4 1922 B13R2.32 NC1c2ccccc2CCC1O Amb22275991 [0,0,0,1,0,0|3,0,0]=4 1923 B13R2.32 N[C@@H]1c2ccccc2CCC1Br Amb32654865 [0,0,0,1,0,0|3,0,0]=4 1924 B13R2.32 N[C@@H]1c2ccccc2CCC1Cl Amb32654866 [0,0,0,1,0,0|3,0,0]=4 1925 B13R2.32 N[C@@H]1c2ccccc2CC[C@@H]1O Amb27985829 [0,0,0,1,0,0|3,0,0]=4 1926 B13R2.32 N[C@@H]1c2ccccc2CC[C@H]1O Amb26397238 [0,0,0,1,0,0|3,0,0]=4 1927 B13R2.32 N[C@H]1CCc2ncccc2[C@H]1O Amb28132408 [0,0,0,1,0,0|3,0,0]=4 1928 B13R2.32 N[C@H]1COc2ccccc2C1O Amb27400359 [0,0,0,1,0,0|3,0,0]=4 1929 B13R2.32 N[C@H]1c2ccccc2CC[C@H]1N Amb26418947 [0,0,0,1,0,0|3,0,0]=4 1930 B13R2.32 N[C@H]1c2ccccc2CC[C@H]1O Amb22748703 [0,0,0,1,0,0|3,0,0]=4 1931 B13R2.32 N[C@H]1c2ccccc2CC[C@H]1O Amb32752546 [0,0,0,1,0,0|3,0,0]=4 1932 B13R2.32 OC1C=Cc2ccccc2C1O Amb22227709 [0,0,0,1,0,0|2,0,1]=4 1933 B13R2.32 OC1CNc2ccccc2C1O Amb28323585 [0,0,0,1,0,0|3,0,0]=4 1934 B13R2.32 OC1COc2ccccc2C1O Amb27164472 [0,0,0,1,0,0|3,0,0]=4 1935 B13R2.32 OC1c2ccccc2CCC1Br Amb4036293 [0,0,0,1,0,0|2,0,0]=3 1936 B13R2.32 OC1c2ccccc2CCC1Cl Amb26456275 [0,0,0,1,0,0|2,0,0]=3 1937 B13R2.32 OC1c2ccccc2CCC1F Amb26866847 [0,0,0,1,0,0|2,0,0]=3 1938 B13R2.32 OC1c2ccccc2OCC1Br Amb25816221 [0,0,0,1,0,0|3,0,0]=4 1939 B13R2.32 OC1c2ccccc2SCC1Cl Amb28073019 [0,0,0,1,0,0|3,0,0]=4 1940 B13R2.32 O[C@@H]1C=Cc2ccccc2[C@H]1O Amb24501437 [0,0,0,1,0,0|2,0,1]=4 1941 B13R2.32 O[C@@H]1CCc2ccccc2[C@H]1O Amb25250666 [0,0,0,1,0,0|2,0,0]=3 1942 B13R2.32 O[C@@H]1CCc2ncccc2[C@H]1O Amb27484608 [0,0,0,1,0,0|3,0,0]=4 1943 B13R2.32 O[C@@H]1c2ccccc2C=C[C@H]1F Amb27261466 [0,0,0,1,0,0|2,0,1]=4 1944 B13R2.32 O[C@@H]1c2ccccc2CCC1Br Amb32654860 [0,0,0,1,0,0|2,0,0]=3 1945 B13R2.32 O[C@@H]1c2ccccc2CCC1Cl Amb32654864 [0,0,0,1,0,0|2,0,0]=3 1946 B13R2.32 O[C@@H]1c2ccccc2CC[C@@H]1Cl Amb8394044 [0,0,0,1,0,0|2,0,0]=3 1947 B13R2.32 O[C@@H]1c2ccccc2CC[C@H]1F Amb28321308 [0,0,0,1,0,0|2,0,0]=3 1948 B13R2.32 O[C@@H]1c2ccccc2OC[C@@H]1Br Amb34916531 [0,0,0,1,0,0|3,0,0]=4 1949 B13R2.32 O[C@@H]1c2ccccc2OC[C@H]1Cl Amb27863559 [0,0,0,1,0,0|3,0,0]=4 1950 B13R2.32 O[C@@H]1c2ccccc2SC[C@@H]1Cl Amb28287299 [0,0,0,1,0,0|3,0,0]=4 1951 B13R2.32 O[C@H]1C=Cc2ccccc2[C@@H]1O Amb17613051 [0,0,0,1,0,0|2,0,1]=4 1952 B13R2.32 O[C@H]1C=Cc2ccccc2[C@H]1O Amb22353072 [0,0,0,1,0,0|2,0,1]=4 1953 B13R2.32 O[C@H]1CCc2ccccc2[C@@H]1Cl Amb28422703 [0,0,0,1,0,0|3,0,0]=4 1954 B13R2.32 O[C@H]1CCc2ccccc2[C@H]1O Amb22224796 [0,0,0,1,0,0|2,0,0]=3 1955 B13R2.32 O[C@H]1CCc2ncccc2[C@H]1O Amb27970481 [0,0,0,1,0,0|3,0,0]=4 1956 B13R2.32 O[C@H]1COc2ccccc2[C@H]1O Amb27625657 [0,0,0,1,0,0|3,0,0]=4 1957 B13R2.32 O[C@H]1c2ccccc2C=C[C@@H]1F Amb28455677 [0,0,0,1,0,0|2,0,1]=4 1958 B13R2.32 O[C@H]1c2ccccc2C=C[C@@H]1S Amb26556175 [0,0,0,1,0,0|2,0,1]=4 1959 B13R2.32 O[C@H]1c2ccccc2C=C[C@H]1O Amb25930973 [0,0,0,1,0,0|2,0,1]=4 1960 B13R2.32 O[C@H]1c2ccccc2CC[C@H]1Cl Amb28422794 [0,0,0,1,0,0|2,0,0]=3 1961 B13R2.32 O[C@H]1c2ccccc2CC[C@H]1O Amb2613184 [0,0,0,1,0,0|2,0,0]=3 1962 B13R2.32 O[C@H]1c2ccccc2OC[C@@H]1Br Amb25947812 [0,0,0,1,0,0|3,0,0]=4 1963 B13R2.32 O[C@H]1c2cccnc2CC[C@H]1O Amb28319992 [0,0,0,1,0,0|3,0,0]=4 1964 B13R2.45 C#CC1Cc2ccccc2C1O Amb27833663 [0,0,0,1,0,0|1,0,1]=3 1965 B13R2.45 C#C[C@@H]1Cc2ccccc2[C@@H]1O Amb27197594 [0,0,0,1,0,0|1,0,1]=3 1966 B13R2.45 C=CC1Cc2ccccc2C1O Amb27978259 [0,0,0,1,0,0|1,0,1]=3 1967 B13R2.45 C=C[C@@H]1Cc2ccccc2[C@@H]1O Amb27197958 [0,0,0,1,0,0|1,0,1]=3 1968 B13R2.45 CC1c2ccccc2CC1C#N Amb35722776 [0,0,0,1,0,0|3,0,0]=4 1969 B13R2.45 CC1c2ccccc2CC1CBr Amb29887219 [0,0,0,1,0,0|3,0,0]=4 1970 B13R2.45 CC1c2ccccc2CC1CN Amb35672163 [0,0,0,1,0,0|3,0,0]=4 1971 B13R2.45 CC1c2ccccc2CC1NN Amb29855809 [0,0,0,1,0,0|2,0,0]=3 1972 B13R2.45 CC1c2ccccc2CC1NO Amb29855874 [0,0,0,1,0,0|2,0,0]=3 1973 B13R2.45 CCC1Cc2ccccc2C1=O Amb4605959 [0,0,0,1,0,0|1,0,2]=4 1974 B13R2.45 CCC1Cc2ccccc2C1Br Amb27588452 [0,0,0,1,0,0|2,0,0]=3 1975 B13R2.45 CCC1Cc2ccccc2C1Cl Amb18186760 [0,0,0,1,0,0|2,0,0]=3 1976 B13R2.45 CCC1Oc2ccccc2C1N Amb26844209 [0,0,0,1,0,0|3,0,0]=4 1977 B13R2.45 CC[C@@H]1Cc2ccccc2C1=O Amb27262889 [0,0,0,1,0,0|1,0,2]=4 1978 B13R2.45 CC[C@@H]1Nc2ccccc2[C@@H]1C Amb27965504 [0,0,0,1,0,0|3,0,0]=4 1979 B13R2.45 CNC1Cc2ccccc2C1C Amb29855873 [0,0,0,1,0,0|1,0,0]=2 1980 B13R2.45 CNC1Cc2ccccc2C1O Amb18645898 [0,0,0,1,0,0|0,0,0]=1 1981 B13R2.45 CN[C@@H]1Cc2ccccc2[C@H]1O Amb24056611 [0,0,0,1,0,0|0,0,0]=1 1982 B13R2.45 CN[C@H]1Cc2ccccc2[C@@H]1O Amb9133996 [0,0,0,1,0,0|0,0,0]=1 1983 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,0,0,1,0,0|1,0,2]=4 1984 B13R2.45 COC1Cc2ccccc2C1Cl Amb27178097 [0,0,0,1,0,0|2,0,0]=3 1985 B13R2.45 COC1Cc2ccccc2C1N Amb1140146 [0,0,0,1,0,0|2,0,0]=3 1986 B13R2.45 COC1Cc2ccccc2C1N Amb32656099 [0,0,0,1,0,0|2,0,0]=3 1987 B13R2.45 COC1Cc2ccccc2C1O Amb18800787 [0,0,0,1,0,0|1,0,0]=2 1988 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1Cl Amb27637752 [0,0,0,1,0,0|2,0,0]=3 1989 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1O Amb27443198 [0,0,0,1,0,0|1,0,0]=2 1990 B13R2.45 CO[C@@H]1Cc2ccccc2[C@H]1N Amb27238773 [0,0,0,1,0,0|2,0,0]=3 1991 B13R2.45 CO[C@H]1Cc2ccccc2[C@@H]1Cl Amb28051829 [0,0,0,1,0,0|2,0,0]=3 1992 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb24567956 [0,0,0,1,0,0|2,0,0]=3 1993 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb32656192 [0,0,0,1,0,0|2,0,0]=3 1994 B13R2.45 CSC1Cc2ccccc2C1=O Amb28054308 [0,0,0,1,0,0|1,0,2]=4 1995 B13R2.45 CSC1Cc2ccccc2C1O Amb28127814 [0,0,0,1,0,0|1,0,0]=2 1996 B13R2.45 C[C@@H]1c2ccccc2C[C@H]1CO Amb27653087 [0,0,0,1,0,0|3,0,0]=4 1997 B13R2.45 NC1c2ccccc2CC1CO Amb18645892 [0,0,0,1,0,0|3,0,0]=4 1998 B13R2.45 N[C@H]1c2ccccc2C[C@H]1CO Amb1993948 [0,0,0,1,0,0|3,0,0]=4 1999 B13R2.56 CCC1CNC1c2ccccc2 Amb27779050 [0,0,0,1,0,0|2,0,0]=3 2000 B13R2.56 CNC1CCC1c2ccccc2 Amb27858960 [0,0,0,1,0,0|1,0,0]=2 2001 B13R2.56 NCC1CCC1c2ccccc2 Amb27615402 [0,0,0,1,0,0|3,0,0]=4 2002 B13R2.56 O=CC1CCC1c2ccccc2 Amb28290504 [0,0,0,1,0,0|3,0,0]=4 2003 B13R2.56 O=C[C@@H]1CC[C@@H]1c2ccccc2 Amb26951878 [0,0,0,1,0,0|3,0,0]=4 2004 B13R2.56 O=C[C@@H]1CC[C@H]1c2ccccc2 Amb26935631 [0,0,0,1,0,0|3,0,0]=4 2005 B13R2.56 O=C[C@H]1CC[C@H]1c2ccccc2 Amb26388586 [0,0,0,1,0,0|3,0,0]=4 2006 B13R2.56 OCC1CCC1c2ccccc2 Amb23453480 [0,0,0,1,0,0|3,0,0]=4 2007 B13R2.98 CC1(C=O)CC1c2ccccc2 Amb25674437 [0,0,0,1,0,0|3,0,0]=4 2008 B13R2.98 CC1(CN)CC1c2ccccc2 Amb26439851 [0,0,0,1,0,0|3,0,0]=4 2009 B13R2.98 CC1(CN)CC1c2ccccc2 Amb32666300 [0,0,0,1,0,0|3,0,0]=4 2010 B13R2.98 CC1(CO)CC1c2ccccc2 Amb27763865 [0,0,0,1,0,0|3,0,0]=4 2011 B13R2.98 CC[C@@]1(O)C[C@H]1c2ccccc2 Amb35749203 [0,0,0,1,0,0|3,0,0]=4 2012 B13R2.98 C[C@@]1(C=O)C[C@H]1c2ccccc2 Amb24545890 [0,0,0,1,0,0|3,0,0]=4 2013 B13R2.98 C[C@@]1(C=O)O[C@H]1c2ccccc2 Amb27841129 [0,0,0,1,0,0|2,0,0]=3 2014 B13R2.98 C[C@@]1(CN)C[C@H]1c2ccccc2 Amb24523691 [0,0,0,1,0,0|3,0,0]=4 2015 B13R2.98 C[C@@]1(CN)C[C@H]1c2ccccc2 Amb28641945 [0,0,0,1,0,0|3,0,0]=4 2016 B13R2.98 C[C@@]1(CO)C[C@H]1c2ccccc2 Amb25950357 [0,0,0,1,0,0|3,0,0]=4 2017 B13R2.98 C[C@@]1(CO)O[C@H]1c2ccccc2 Amb22388561 [0,0,0,1,0,0|2,0,0]=3 2018 B13R2.98 C[C@]1(C=O)C[C@@H]1c2ccccc2 Amb24460888 [0,0,0,1,0,0|3,0,0]=4 2019 B13R2.98 C[C@]1(C=O)C[C@H]1c2ccccc2 Amb24678176 [0,0,0,1,0,0|3,0,0]=4 2020 B13R2.98 C[C@]1(CO)O[C@@H]1c2ccccc2 Amb24607331 [0,0,0,1,0,0|2,0,0]=3 2021 B13R2.373 CC1C(=O)CC1c2ccccc2 Amb20668234 [0,0,0,1,0,0|3,0,0]=4 2022 B13R2.373 CC1C(=O)NC1c2ccccc2 Amb19149073 [0,0,0,1,0,0|3,0,0]=4 2023 B13R2.373 CC1C(N)CC1c2ccccc2 Amb20669477 [0,0,0,1,0,0|3,0,0]=4 2024 B13R2.373 CC1C(N)CC1c2ccccc2 Amb22157239 [0,0,0,1,0,0|3,0,0]=4 2025 B13R2.373 C[C@@H]1C(=O)N[C@H]1c2ccccc2 Amb28286725 [0,0,0,1,0,0|3,0,0]=4 2026 B13R2.373 C[C@H]1C(=O)N[C@H]1c2ccccc2 Amb27849042 [0,0,0,1,0,0|3,0,0]=4 2027 B13R2.373 O=C1OC(c2ccccc2)C1Cl Amb27178098 [0,0,0,1,0,0|3,0,0]=4 2028 B13R2.382 C=C1CC1C(O)c2ccccc2 Amb22363901 [0,0,0,1,0,0|1,0,1]=3 2029 B13R2.382 C=C1C[C@H]1[C@H](O)c2ccccc2 Amb27260210 [0,0,0,1,0,0|1,0,1]=3 2030 B13R2.382 CC(c1ccccc1)C2CC2N Amb33081606 [0,0,0,1,0,0|3,0,0]=4 2031 B13R2.382 CC(c1ccccc1)[C@@H]2C[C@H]2N Amb33081605 [0,0,0,1,0,0|3,0,0]=4 2032 B13R2.382 CC1=C([C@@H](O)c2ccccc2)C1 Amb28207381 [0,0,0,1,0,0|1,0,1]=3 2033 B13R2.382 CC1=C([C@H](O)c2ccccc2)C1 Amb27615227 [0,0,0,1,0,0|1,0,1]=3 2034 B13R2.382 CC1CC1C(N)c2ccccc2 Amb19515274 [0,0,0,1,0,0|2,0,0]=3 2035 B13R2.382 CC1CC1C(N)c2ccccc2 Amb6255271 [0,0,0,1,0,0|2,0,0]=3 2036 B13R2.382 CC1OC1C(O)c2ccccc2 Amb27416827 [0,0,0,1,0,0|2,0,0]=3 2037 B13R2.382 C[C@H]1C[C@H]1C(=O)c2ccccc2 Amb27782003 [0,0,0,1,0,0|1,0,2]=4 2038 B13R2.382 C[C@H]1O[C@@H]1[C@@H](O)c2ccccc2 Amb27788493 [0,0,0,1,0,0|2,0,0]=3 2039 B13R2.413 CC1(c2ccccc2)CCC1N Amb27784417 [0,0,0,1,0,0|3,0,0]=4 2040 B13R2.413 CC1(c2ccccc2)CNC1=O Amb26007017 [0,0,0,1,0,0|2,0,1]=4 2041 B13R2.413 CC1NCC1(O)c2ccccc2 Amb27178292 [0,0,0,1,0,0|0,0,0]=1 2042 B13R2.413 C[C@H]1NC[C@]1(O)c2ccccc2 Amb27239639 [0,0,0,1,0,0|0,0,0]=1 2043 B13R2.413 N[C@@H]1CC[C@]1(O)c2ccccc2 Amb27206478 [0,0,0,1,0,0|2,0,0]=3 2044 B13R2.413 O=C1NCC1(Cl)c2ccccc2 Amb28316755 [0,0,0,1,0,0|2,0,1]=4 2045 B13R2.633 CC1(c2ccccc2)CC1C=O Amb28351425 [0,0,0,1,0,0|3,0,0]=4 2046 B13R2.633 CCC1CC1(N)c2ccncc2 Amb27230897 [0,0,0,1,0,0|3,0,0]=4 2047 B13R2.633 C[C@@]1(c2ccccc2)C[C@H]1CO Amb28053363 [0,0,0,1,0,0|3,0,0]=4 2048 B13R2.633 NC[C@H]1C[C@@]1(F)c2ccccc2 Amb27424056 [0,0,0,1,0,0|3,0,0]=4 2049 B13R2.633 OCC1CC1(F)c2ccccc2 Amb27981984 [0,0,0,1,0,0|3,0,0]=4 2050 B13R2.633 OC[C@H]1C[C@@]1(F)c2ccccc2 Amb27422638 [0,0,0,1,0,0|3,0,0]=4 2051 B13R2.3085 C=C1c2ccccc2C(O)C1C Amb27615507 [0,0,0,1,0,0|1,0,1]=3 2052 B13R2.3085 CC1C(=N)N(C)c2ccccc21 Amb22536459 [0,0,0,1,0,0|2,0,1]=4 2053 B13R2.3085 CC1C(=O)N(C)c2ccccc21 Amb24273383 [0,0,0,1,0,0|2,0,1]=4 2054 B13R2.3085 CC1C(=O)c2ccccc2C1Cl Amb27865661 [0,0,0,1,0,0|3,0,0]=4 2055 B13R2.3085 CC1C(N)c2ccccc2S1=O Amb18805328 [0,0,0,1,0,0|3,0,0]=4 2056 B13R2.3085 CC1C(O)c2ccccc2C1O Amb27416947 [0,0,0,1,0,0|2,0,0]=3 2057 B13R2.3085 CC1c2ccccc2C(C)C1N Amb18645544 [0,0,0,1,0,0|3,0,0]=4 2058 B13R2.3085 CC1c2ccccc2C(N)C1N Amb25950623 [0,0,0,1,0,0|3,0,0]=4 2059 B13R2.3085 CC1c2ccccc2C(O)C1N Amb25892193 [0,0,0,1,0,0|2,0,0]=3 2060 B13R2.3085 CC1c2ccccc2[C@@H](O)C1C Amb27594736 [0,0,0,1,0,0|1,0,0]=2 2061 B13R2.3085 CN1C(=N)C(Cl)c2ccccc21 Amb27816558 [0,0,0,1,0,0|2,0,1]=4 2062 B13R2.3085 CN1C(=O)C(Br)c2ccccc21 Amb22749190 [0,0,0,1,0,0|2,0,1]=4 2063 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb22586861 [0,0,0,1,0,0|2,0,1]=4 2064 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb535212 [0,0,0,1,0,0|2,0,1]=4 2065 B13R2.3085 CN1C(=O)C(N)c2ccccc21 Amb5633811 [0,0,0,1,0,0|2,0,1]=4 2066 B13R2.3085 CN1C(=O)C(O)c2ccccc21 Amb2613141 [0,0,0,1,0,0|1,0,1]=3 2067 B13R2.3085 CN1C(=O)[C@@H](O)c2ccccc21 Amb27426901 [0,0,0,1,0,0|1,0,1]=3 2068 B13R2.3085 CN1C(=O)c2ccccc2C1O Amb1155091 [0,0,0,1,0,0|3,0,0]=4 2069 B13R2.3085 CN1C(O)c2ccccc2C1O Amb27836015 [0,0,0,1,0,0|3,0,0]=4 2070 B13R2.3085 CN1c2ccccc2C(=O)C1O Amb27164622 [0,0,0,1,0,0|1,0,2]=4 2071 B13R2.3085 CN1c2ccccc2N(C)C1Cl Amb28384139 [0,0,0,1,0,0|3,0,0]=4 2072 B13R2.3085 C[C@@H]1C(=O)c2ccccc2[C@H]1C Amb27195793 [0,0,0,1,0,0|1,0,2]=4 2073 B13R2.3085 Cc1c(Br)c2ccccc2n1C Amb17133648 [0,0,0,1,0,0|1,0,2]=4 2074 B13R2.3085 Cc1c(C)n(C)c2ccccc12 Amb26899733 [0,0,0,1,0,0|1,0,2]=4 2075 B13R2.3085 Cc1c(I)c2ccccc2n1C Amb17134454 [0,0,0,1,0,0|1,0,2]=4 2076 B13R2.3085 Cc1c(N)c2ccccc2n1C Amb18563503 [0,0,0,1,0,0|1,0,2]=4 2077 B13R2.3085 Cc1c(O)c2ccccc2n1C Amb32732864 [0,0,0,1,0,0|0,0,2]=3 2078 B13R2.3085 Cc1c(S)c2ccccc2n1C Amb24361774 [0,0,0,1,0,0|0,1,2]=4 2079 B13R2.3085 Cc1n(C)c2ccccc2[n+]1C Amb2779891 [0,0,0,1,0,0|2,0,1]=4 2080 B13R2.3085 Cc1n(C)c2ccccc2[n+]1N Amb1032750 [0,0,0,1,0,0|2,0,1]=4 2081 B13R2.3085 Cc1n(C)c2ccccc2[n+]1[O-] Amb8393339 [0,0,0,1,0,0|1,0,2]=4 2082 B13R2.3085 NC1C(=O)c2ccccc2C1O Amb25700423 [0,0,0,1,0,0|3,0,0]=4 2083 B13R2.3085 NC1c2ccccc2C(O)C1O Amb27165710 [0,0,0,1,0,0|3,0,0]=4 2084 B13R2.3085 N[C@@H]1c2ccccc2[C@H](O)[C@@H]1O Amb28057562 [0,0,0,1,0,0|3,0,0]=4 2085 B13R2.3085 N[C@H]1c2ccccc2[C@@H](O)[C@H]1O Amb27880654 [0,0,0,1,0,0|3,0,0]=4 2086 B13R2.3085 O[C@H]1c2ccccc2[C@H](O)C1Cl Amb27467899 [0,0,0,1,0,0|3,0,0]=4 2087 B13R2.7350 CCC1(O)c2ccccc2C1C Amb17778669 [0,0,0,1,0,0|3,0,0]=4 2088 B13R2.8137 CC(c1ccccc1)C2CCN2 Amb33081596 [0,0,0,1,0,0|1,0,0]=2 2089 B13R2.8137 CC(c1ccccc1)C2CNC2 Amb33081593 [0,0,0,1,0,0|3,0,0]=4 2090 B13R2.8137 CC(c1ccccc1)N2CCC2 Amb27219769 [0,0,0,1,0,0|3,0,0]=4 2091 B13R2.8137 CN(c1ccccc1)C2CCC2 Amb27982649 [0,0,0,1,0,0|3,0,0]=4 2092 B13R2.8137 ClC(c1ccccc1)C2CCC2 Amb18181272 [0,0,0,1,0,0|2,0,0]=3 2093 B13R2.8137 NC(c1ccccc1)C2CCC2 Amb23438851 [0,0,0,1,0,0|2,0,0]=3 2094 B13R2.8137 NC(c1ccccc1)C2CCC2 Amb9717768 [0,0,0,1,0,0|2,0,0]=3 2095 B13R2.8137 NC(c1ccccc1)C2CSC2 Amb29852410 [0,0,0,1,0,0|3,0,0]=4 2096 B13R2.8137 NC(c1ccccn1)C2CCC2 Amb22642966 [0,0,0,1,0,0|3,0,0]=4 2097 B13R2.8137 NC(c1ccccn1)C2CCC2 Amb35745717 [0,0,0,1,0,0|3,0,0]=4 2098 B13R2.8137 NC(c1cccnc1)C2CCC2 Amb22642958 [0,0,0,1,0,0|3,0,0]=4 2099 B13R2.8137 NC(c1cccnc1)C2CCC2 Amb35745695 [0,0,0,1,0,0|3,0,0]=4 2100 B13R2.8137 NC(c1ccncc1)C2CCC2 Amb22642964 [0,0,0,1,0,0|3,0,0]=4 2101 B13R2.8137 NC(c1ccncc1)C2CCC2 Amb30289941 [0,0,0,1,0,0|3,0,0]=4 2102 B13R2.8137 NC(c1ccncc1)C2CCC2 Amb35745714 [0,0,0,1,0,0|3,0,0]=4 2103 B13R2.8137 N[C@@H](c1ccccc1)C2CCC2 Amb33871462 [0,0,0,1,0,0|2,0,0]=3 2104 B13R2.8137 N[C@@H](c1cccnc1)C2CCC2 Amb24702315 [0,0,0,1,0,0|3,0,0]=4 2105 B13R2.8137 N[C@@H](c1cccnc1)C2CCC2 Amb33620959 [0,0,0,1,0,0|3,0,0]=4 2106 B13R2.8137 N[C@@H](c1ccncc1)C2CCC2 Amb27169220 [0,0,0,1,0,0|3,0,0]=4 2107 B13R2.8137 N[C@H](c1ccccc1)C2CCC2 Amb23438857 [0,0,0,1,0,0|2,0,0]=3 2108 B13R2.8137 N[C@H](c1ccccc1)C2CCC2 Amb28364913 [0,0,0,1,0,0|2,0,0]=3 2109 B13R2.8137 N[C@H](c1ccccn1)C2CCC2 Amb27416543 [0,0,0,1,0,0|3,0,0]=4 2110 B13R2.8137 N[C@H](c1cccnc1)C2CCC2 Amb28203678 [0,0,0,1,0,0|3,0,0]=4 2111 B13R2.8137 N[C@H](c1ccncc1)C2CCC2 Amb28041438 [0,0,0,1,0,0|3,0,0]=4 2112 B13R2.8137 O=C(c1ccccc1)C2CCC2 Amb2686621 [0,0,0,1,0,0|1,0,2]=4 2113 B13R2.8137 O=C(c1ccccc1)C2CCN2 Amb27427543 [0,0,0,1,0,0|0,0,2]=3 2114 B13R2.8137 OC(c1ccccc1)C2CCC2 Amb17194467 [0,0,0,1,0,0|1,0,0]=2 2115 B13R2.8137 OC(c1ccccc1)C2CSC2 Amb29852042 [0,0,0,1,0,0|2,0,0]=3 2116 B13R2.8137 OC(c1ccccn1)C2CNC2 Amb23598814 [0,0,0,1,0,0|3,0,0]=4 2117 B13R2.8137 OC(c1ccccn1)C2CNC2 Amb32662075 [0,0,0,1,0,0|3,0,0]=4 2118 B13R2.8137 OC(c1cccnc1)C2CCC2 Amb28250102 [0,0,0,1,0,0|2,0,0]=3 2119 B13R2.8137 OC(c1cccnc1)C2CNC2 Amb23598813 [0,0,0,1,0,0|3,0,0]=4 2120 B13R2.8137 OC(c1cccnc1)C2CNC2 Amb32662074 [0,0,0,1,0,0|3,0,0]=4 2121 B13R2.8137 OC(c1cccnc1)C2CSC2 Amb29852044 [0,0,0,1,0,0|3,0,0]=4 2122 B13R2.8137 OC(c1ccncc1)C2CNC2 Amb23598812 [0,0,0,1,0,0|3,0,0]=4 2123 B13R2.8137 OC(c1ccncc1)C2CNC2 Amb32662073 [0,0,0,1,0,0|3,0,0]=4 2124 B13R2.8137 OC(c1ccnnc1)C2CCC2 Amb27787662 [0,0,0,1,0,0|3,0,0]=4 2125 B13R2.8137 S=C(c1ccccc1)C2CCC2 Amb27490795 [0,0,0,1,0,0|1,1,1]=4 2126 B13R2.8138 CC(c1ccccc1)C2(C)CO2 Amb33081887 [0,0,0,1,0,0|2,0,0]=3 2127 B13R2.8138 CC(c1ccccc1)C2(N)CC2 Amb29852224 [0,0,0,1,0,0|3,0,0]=4 2128 B13R2.8138 CC(c1ccccc1)C2(N)CC2 Amb35752608 [0,0,0,1,0,0|3,0,0]=4 2129 B13R2.8138 CC(c1ccccc1)C2(O)CC2 Amb24684522 [0,0,0,1,0,0|3,0,0]=4 2130 B13R2.8138 CC1(C(=O)c2ccccc2)CC1 Amb18563491 [0,0,0,1,0,0|1,0,2]=4 2131 B13R2.8138 CC1(C(=O)c2ccccc2)CO1 Amb27175984 [0,0,0,1,0,0|1,0,2]=4 2132 B13R2.8138 CC1(C(Cl)c2ccccc2)CC1 Amb27808998 [0,0,0,1,0,0|2,0,0]=3 2133 B13R2.8138 CC1(C(N)c2ccccc2)CC1 Amb18563532 [0,0,0,1,0,0|2,0,0]=3 2134 B13R2.8138 CC1(C(O)c2ccccc2)CO1 Amb27260258 [0,0,0,1,0,0|1,0,0]=2 2135 B13R2.8138 CC1(C(O)c2cnccn2)CC1 Amb27752448 [0,0,0,1,0,0|3,0,0]=4 2136 B13R2.8138 C[C@]1([C@@H](O)c2ccccc2)CO1 Amb27457922 [0,0,0,1,0,0|1,0,0]=2 2137 B13R2.8138 NC(c1ccccc1)C2(O)CC2 Amb22236255 [0,0,0,1,0,0|3,0,0]=4 2138 B13R2.8138 NC1(C(O)c2ccccc2)CC1 Amb24095286 [0,0,0,1,0,0|2,0,0]=3 2139 B13R2.8138 NC1(C(O)c2cccnc2)CC1 Amb29875615 [0,0,0,1,0,0|3,0,0]=4 2140 B13R2.8138 N[C@@H](c1ccccc1)C2(O)CC2 Amb22225452 [0,0,0,1,0,0|3,0,0]=4 2141 B13R2.15272 CC[C@@H](O)C1Cc2ccccc21 Amb27177476 [0,0,0,1,0,0|3,0,0]=4 2142 B13R2.15272 CNC(=O)C1Cc2ccccc21 Amb27166885 [0,0,0,1,0,0|2,0,1]=4 2143 B13R2.15272 CNC(C)C1Cc2ccccc21 Amb26590734 [0,0,0,1,0,0|1,0,0]=2 2144 B11R1.31 C#CC(C)C(O)c1ccco1 Amb27594769 [0,0,0,0,1,0|2,0,1]=4 2145 B11R1.31 C=C[C@@H](C)[C@@H](O)c1cccs1 Amb28124999 [0,0,0,0,1,0|2,0,1]=4 2146 B11R1.31 CC(C#N)C(O)c1ccco1 Amb27390750 [0,0,0,0,1,0|3,0,0]=4 2147 B11R1.31 CC(C#N)C(O)c1ccoc1 Amb27654613 [0,0,0,0,1,0|3,0,0]=4 2148 B11R1.31 CC(CN)C(O)c1ccco1 Amb26933478 [0,0,0,0,1,0|3,0,0]=4 2149 B11R1.31 CC(CN)C(O)c1cccs1 Amb26018403 [0,0,0,0,1,0|3,0,0]=4 2150 B11R1.31 CC(CN)C(O)c1ccoc1 Amb27163392 [0,0,0,0,1,0|3,0,0]=4 2151 B11R1.31 CC(CN)C(O)c1ccsc1 Amb27603884 [0,0,0,0,1,0|3,0,0]=4 2152 B11R1.31 CC(CO)C(O)c1ccco1 Amb28284970 [0,0,0,0,1,0|3,0,0]=4 2153 B11R1.31 CC(CO)C(O)c1cccs1 Amb27588961 [0,0,0,0,1,0|3,0,0]=4 2154 B11R1.31 CCC(C)C(C)n1cccc1 Amb18179411 [0,0,0,0,1,0|3,0,0]=4 2155 B11R1.31 CCC(C)C(Cl)c1cccs1 Amb18324229 [0,0,0,0,1,0|3,0,0]=4 2156 B11R1.31 CCC(C)C(Cl)c1ccsc1 Amb27425163 [0,0,0,0,1,0|3,0,0]=4 2157 B11R1.31 CCC(C)C(N)c1ccoc1 Amb28381766 [0,0,0,0,1,0|3,0,0]=4 2158 B11R1.31 CCC(C)C(O)c1cccs1 Amb18180285 [0,0,0,0,1,0|2,0,0]=3 2159 B11R1.31 CCC(C)C(O)c1ccoc1 Amb27170211 [0,0,0,0,1,0|2,0,0]=3 2160 B11R1.31 CCC(C)C(O)c1ccsc1 Amb27881242 [0,0,0,0,1,0|2,0,0]=3 2161 B11R1.31 CCC(C)C(O)c1cnsc1 Amb30020067 [0,0,0,0,1,0|3,0,0]=4 2162 B11R1.31 CCC(C)C(O)c1nccs1 Amb24636655 [0,0,0,0,1,0|3,0,0]=4 2163 B11R1.31 CCC(C)[C@H](N)c1cccs1 Amb28319113 [0,0,0,0,1,0|3,0,0]=4 2164 B11R1.31 CCC(N)C(O)c1ccco1 Amb18980531 [0,0,0,0,1,0|3,0,0]=4 2165 B11R1.31 CCC(N)C(O)c1cccs1 Amb17138678 [0,0,0,0,1,0|3,0,0]=4 2166 B11R1.31 CC[C@@H](N)C(O)c1ccco1 Amb35659419 [0,0,0,0,1,0|3,0,0]=4 2167 B11R1.31 CC[C@@H](N)C(O)c1cccs1 Amb35659382 [0,0,0,0,1,0|3,0,0]=4 2168 B11R1.31 CC[C@@H](N)C(O)c1ccoc1 Amb35659331 [0,0,0,0,1,0|3,0,0]=4 2169 B11R1.31 CC[C@@H](N)C(O)c1ccsc1 Amb35659329 [0,0,0,0,1,0|3,0,0]=4 2170 B11R1.31 CC[C@@H](N)[C@H](O)c1ccoc1 Amb27233874 [0,0,0,0,1,0|3,0,0]=4 2171 B11R1.31 CC[C@H](N)C(O)c1ccco1 Amb35601520 [0,0,0,0,1,0|3,0,0]=4 2172 B11R1.31 CC[C@H](N)C(O)c1cccs1 Amb35601267 [0,0,0,0,1,0|3,0,0]=4 2173 B11R1.31 CC[C@H](N)C(O)c1ccoc1 Amb35601441 [0,0,0,0,1,0|3,0,0]=4 2174 B11R1.31 CC[C@H](N)C(O)c1ccsc1 Amb35601440 [0,0,0,0,1,0|3,0,0]=4 2175 B11R1.31 CC[C@H](N)[C@H](O)c1ccoc1 Amb28140778 [0,0,0,0,1,0|3,0,0]=4 2176 B11R1.31 CC[C@H](N)[C@H](O)c1ccsc1 Amb28054877 [0,0,0,0,1,0|3,0,0]=4 2177 B11R1.31 CNC(=O)C(O)c1cccs1 Amb26959860 [0,0,0,0,1,0|2,0,1]=4 2178 B11R1.31 CNC(C)C(=O)c1ccco1 Amb25104644 [0,0,0,0,1,0|1,0,2]=4 2179 B11R1.31 CNC(C)C(=O)c1cccs1 Amb18563909 [0,0,0,0,1,0|1,0,2]=4 2180 B11R1.31 CNC(C)C(=O)c1ccoc1 Amb27405607 [0,0,0,0,1,0|1,0,2]=4 2181 B11R1.31 CNC(C)C(=O)c1ccsc1 Amb24460069 [0,0,0,0,1,0|1,0,2]=4 2182 B11R1.31 CNC(C)C(O)C1=CCCO1 Amb29875928 [0,0,0,0,1,0|1,0,2]=4 2183 B11R1.31 CNC(C)C(O)C1=COCC1 Amb29875934 [0,0,0,0,1,0|1,0,2]=4 2184 B11R1.31 CNC(C)C(O)c1ccns1 Amb35621624 [0,0,0,0,1,0|2,0,0]=3 2185 B11R1.31 CNC(C)C(O)c1ccsc1 Amb27839776 [0,0,0,0,1,0|1,0,0]=2 2186 B11R1.31 CNC(C)C(O)c1ccsn1 Amb35621618 [0,0,0,0,1,0|2,0,0]=3 2187 B11R1.31 CNC(C)C(O)c1cncs1 Amb35621108 [0,0,0,0,1,0|2,0,0]=3 2188 B11R1.31 CNC(C)C(O)c1cnsc1 Amb35621102 [0,0,0,0,1,0|2,0,0]=3 2189 B11R1.31 CNC(C)C(O)c1cscn1 Amb35621103 [0,0,0,0,1,0|2,0,0]=3 2190 B11R1.31 CN[C@@H](C)C(=O)c1ccco1 Amb33132180 [0,0,0,0,1,0|1,0,2]=4 2191 B11R1.31 CN[C@@H](C)C(=O)c1cccs1 Amb30040628 [0,0,0,0,1,0|1,0,2]=4 2192 B11R1.31 CN[C@@H](C)C(=O)c1ccoc1 Amb33132179 [0,0,0,0,1,0|1,0,2]=4 2193 B11R1.31 CN[C@@H](C)C(=O)c1ccsc1 Amb30040543 [0,0,0,0,1,0|1,0,2]=4 2194 B11R1.31 CN[C@@H](C)C(O)C1=CCCO1 Amb30039217 [0,0,0,0,1,0|1,0,2]=4 2195 B11R1.31 CN[C@@H](C)C(O)C1=COCC1 Amb30039222 [0,0,0,0,1,0|1,0,2]=4 2196 B11R1.31 CN[C@@H](C)C(O)c1ccco1 Amb35664053 [0,0,0,0,1,0|1,0,0]=2 2197 B11R1.31 CN[C@@H](C)C(O)c1cccs1 Amb35663970 [0,0,0,0,1,0|1,0,0]=2 2198 B11R1.31 CN[C@@H](C)C(O)c1ccns1 Amb29889787 [0,0,0,0,1,0|2,0,0]=3 2199 B11R1.31 CN[C@@H](C)C(O)c1ccoc1 Amb35662600 [0,0,0,0,1,0|1,0,0]=2 2200 B11R1.31 CN[C@@H](C)C(O)c1ccsc1 Amb35662599 [0,0,0,0,1,0|1,0,0]=2 2201 B11R1.31 CN[C@@H](C)C(O)c1ccsn1 Amb29889812 [0,0,0,0,1,0|2,0,0]=3 2202 B11R1.31 CN[C@@H](C)C(O)c1cncs1 Amb29891477 [0,0,0,0,1,0|2,0,0]=3 2203 B11R1.31 CN[C@@H](C)C(O)c1cnsc1 Amb35664058 [0,0,0,0,1,0|2,0,0]=3 2204 B11R1.31 CN[C@@H](C)C(O)c1cscn1 Amb35664059 [0,0,0,0,1,0|2,0,0]=3 2205 B11R1.31 CN[C@H](C)[C@H](O)c1cccs1 Amb28252214 [0,0,0,0,1,0|1,0,0]=2 2206 B11R1.31 COC(C)C(N)c1cccs1 Amb28293471 [0,0,0,0,1,0|3,0,0]=4 2207 B11R1.31 COC(C)C(O)c1ccco1 Amb28064557 [0,0,0,0,1,0|2,0,0]=3 2208 B11R1.31 COC(C)C(O)c1ccoc1 Amb27947776 [0,0,0,0,1,0|2,0,0]=3 2209 B11R1.31 COC(C)C(O)c1cncs1 Amb35616563 [0,0,0,0,1,0|3,0,0]=4 2210 B11R1.31 COC(C)C(O)c1cnsc1 Amb35680826 [0,0,0,0,1,0|3,0,0]=4 2211 B11R1.31 COC(C)C(O)c1nccs1 Amb33188338 [0,0,0,0,1,0|3,0,0]=4 2212 B11R1.31 C[C@@H](CO)[C@@H](O)c1ccco1 Amb27977736 [0,0,0,0,1,0|3,0,0]=4 2213 B11R1.31 C\C=C(\C)C(O)c1ccoc1 Amb28345313 [0,0,0,0,1,0|2,0,1]=4 2214 B13R1.11 C#C[C@H](C)N[C@H](C)c1ccccc1 Amb27751216 [0,0,0,0,0,1|2,0,1]=4 2215 B13R1.11 C#C[C@H](O)C[C@@H](O)c1ccccc1 Amb27164451 [0,0,0,0,0,1|2,0,1]=4 2216 B13R1.11 CC(C#N)CC(Cl)c1ccccc1 Amb27179201 [0,0,0,0,0,1|3,0,0]=4 2217 B13R1.11 CC(C#N)N[C@H](C)c1ccccc1 Amb27216574 [0,0,0,0,0,1|3,0,0]=4 2218 B13R1.11 CC(CN)CC(C)c1ccccc1 Amb33727754 [0,0,0,0,0,1|3,0,0]=4 2219 B13R1.11 CC(CO)CC(C)c1ccccc1 Amb22733184 [0,0,0,0,0,1|3,0,0]=4 2220 B13R1.11 CC(CO)NC(C)c1ccccc1 Amb9359811 [0,0,0,0,0,1|3,0,0]=4 2221 B13R1.11 CC(C[C@@H](C)CN)c1ccccc1 Amb33743135 [0,0,0,0,0,1|3,0,0]=4 2222 B13R1.11 CC(C[C@@H](C)CO)c1ccccc1 Amb33736433 [0,0,0,0,0,1|3,0,0]=4 2223 B13R1.11 CC(C[C@H](C)CN)c1ccccc1 Amb33726992 [0,0,0,0,0,1|3,0,0]=4 2224 B13R1.11 CC(C[C@H](C)CO)c1ccccc1 Amb33729468 [0,0,0,0,0,1|3,0,0]=4 2225 B13R1.11 CCC(C)NC(=N)c1ccccc1 Amb28254013 [0,0,0,0,0,1|2,0,1]=4 2226 B13R1.11 CCC(C)NC(C)c1ccccc1 Amb2612137 [0,0,0,0,0,1|2,0,0]=3 2227 B13R1.11 CCC(C)NC(C)c1ccccn1 Amb6685835 [0,0,0,0,0,1|3,0,0]=4 2228 B13R1.11 CCC(C)NC(C)c1cccnc1 Amb6685837 [0,0,0,0,0,1|3,0,0]=4 2229 B13R1.11 CCC(C)NC(C)c1ccncc1 Amb6685836 [0,0,0,0,0,1|3,0,0]=4 2230 B13R1.11 CC[C@@H](C)NC(=O)c1ccccc1 Amb28239508 [0,0,0,0,0,1|1,0,2]=4 2231 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb18184205 [0,0,0,0,0,1|2,0,1]=4 2232 B13R1.11 CNC(=N)N[C@H](C)c1ccccc1 Amb27883590 [0,0,0,0,0,1|2,0,1]=4 2233 B13R1.11 CNC(=O)CC(C)c1ccccc1 Amb6846870 [0,0,0,0,0,1|2,0,1]=4 2234 B13R1.11 CNC(=O)CC(N)c1ccccc1 Amb6274807 [0,0,0,0,0,1|2,0,1]=4 2235 B13R1.11 CNC(=O)C[C@@H](C)c1ccccc1 Amb27624580 [0,0,0,0,0,1|2,0,1]=4 2236 B13R1.11 CNC(=O)SC(C)c1ccccc1 Amb27442996 [0,0,0,0,0,1|2,0,1]=4 2237 B13R1.11 CNC(=O)\C=C(\O)c1ccccc1 Amb8492599 [0,0,0,0,0,1|1,0,2]=4 2238 B13R1.11 CNC(=S)N[C@H](C)c1ccccc1 Amb27179079 [0,0,0,0,0,1|2,0,1]=4 2239 B13R1.11 CNC(C)\C=C(\C)c1ccccc1 Amb28247465 [0,0,0,0,0,1|1,0,1]=3 2240 B13R1.11 CN\C(C)=C/C(=S)c1ccccc1 Amb27667972 [0,0,0,0,0,1|0,1,2]=4 2241 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,0,0,0,0,1|2,0,1]=4 2242 B13R1.11 COC(=O)C[C@@H](O)c1ccccc1 Amb6357238 [0,0,0,0,0,1|2,0,1]=4 2243 B13R1.11 COC(=O)C[C@H](O)c1ccccc1 Amb8516703 [0,0,0,0,0,1|2,0,1]=4 2244 B13R1.11 COC(=O)NC(O)c1ccccc1 Amb27413659 [0,0,0,0,0,1|2,0,1]=4 2245 B13R1.11 C\C(=C\C(O)c1ccccc1)CO Amb27457898 [0,0,0,0,0,1|2,0,1]=4 2246 B13R1.11 NC(CO)CC(O)c1ccccc1 Amb32681151 [0,0,0,0,0,1|3,0,0]=4 2247 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,0,0,0,0,1|2,0,1]=4 2248 B13R1.11 NNC(=O)C[C@H](O)c1ccccc1 Amb27980624 [0,0,0,0,0,1|2,0,1]=4 2249 B13R1.11 O=C(CC(O)c1ccccc1)NO Amb27213884 [0,0,0,0,0,1|2,0,1]=4 2250 B13R1.135 C#C[C@@H](C)[C@@H](O)Cc1ccccc1 Amb27588345 [0,0,0,0,0,1|1,0,1]=3 2251 B13R1.135 C=C=C(C)C(O)Cc1ccccc1 Amb28381777 [0,0,0,0,0,1|1,0,2]=4 2252 B13R1.135 CC(CN)C(O)Cc1ccccc1 Amb32693168 [0,0,0,0,0,1|2,0,0]=3 2253 B13R1.135 CC(NN)C(=O)Nc1ccccc1 Amb27603293 [0,0,0,0,0,1|1,0,2]=4 2254 B13R1.135 CCC(C)C(=O)Nc1ccccc1 Amb2642650 [0,0,0,0,0,1|1,0,2]=4 2255 B13R1.135 CCC(C)C(C)Nc1ccccc1 Amb6719514 [0,0,0,0,0,1|2,0,0]=3 2256 B13R1.135 CCC(C)C(C)Nc1ccccn1 Amb19016834 [0,0,0,0,0,1|3,0,0]=4 2257 B13R1.135 CCC(C)C(C)Nc1ccncc1 Amb19016841 [0,0,0,0,0,1|3,0,0]=4 2258 B13R1.135 CCC(C)N(C)Cc1ccccc1 Amb28062153 [0,0,0,0,0,1|3,0,0]=4 2259 B13R1.135 CC[C@@H](C)C(=O)Nc1ccccc1 Amb27455047 [0,0,0,0,0,1|1,0,2]=4 2260 B13R1.135 CNC(=O)C(Br)Cc1ccccc1 Amb27610156 [0,0,0,0,0,1|2,0,1]=4 2261 B13R1.135 CNC(=O)C(C)Oc1ccccc1 Amb3886772 [0,0,0,0,0,1|2,0,1]=4 2262 B13R1.135 CNC(=O)C(C)Sc1ccccc1 Amb8328078 [0,0,0,0,0,1|2,0,1]=4 2263 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,0,0,0,0,1|2,0,1]=4 2264 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb6279885 [0,0,0,0,0,1|2,0,1]=4 2265 B13R1.135 CNC(=O)C(O)Cc1ccccc1 Amb27789590 [0,0,0,0,0,1|1,0,1]=3 2266 B13R1.135 CNC(=O)C(S)Cc1ccccc1 Amb27207974 [0,0,0,0,0,1|1,1,1]=4 2267 B13R1.135 CNC(=O)N(O)Cc1ccccc1 Amb28255708 [0,0,0,0,0,1|2,0,1]=4 2268 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb10878601 [0,0,0,0,0,1|2,0,1]=4 2269 B13R1.135 CNC(=O)[C@@H](N)Cc1ccccc1 Amb15740701 [0,0,0,0,0,1|2,0,1]=4 2270 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb10608885 [0,0,0,0,0,1|2,0,1]=4 2271 B13R1.135 CNC(=O)[C@H](N)Cc1ccccc1 Amb33801562 [0,0,0,0,0,1|2,0,1]=4 2272 B13R1.135 CNC(C)C(=O)Nc1ccccc1 Amb7754252 [0,0,0,0,0,1|0,0,2]=3 2273 B13R1.135 CNC(C)C(=O)Nc1cccnc1 Amb18993832 [0,0,0,0,0,1|1,0,2]=4 2274 B13R1.135 CNC(C)\C(C)=C\c1ccccc1 Amb27610314 [0,0,0,0,0,1|1,0,1]=3 2275 B13R1.135 CNC(C)\C(C)=C\c1ccccn1 Amb27840862 [0,0,0,0,0,1|2,0,1]=4 2276 B13R1.135 CNN(C)C(=O)Nc1ccccc1 Amb27636937 [0,0,0,0,0,1|1,0,2]=4 2277 B13R1.135 COC(=O)C(O)Cc1ccccc1 Amb17138951 [0,0,0,0,0,1|2,0,1]=4 2278 B13R1.135 COC(=O)[C@@H](O)Cc1ccccc1 Amb5722454 [0,0,0,0,0,1|2,0,1]=4 2279 B13R1.135 COC(=O)[C@H](O)Cc1ccccc1 Amb8390894 [0,0,0,0,0,1|2,0,1]=4 2280 B13R1.135 COC(C)C(C)Nc1ccccn1 Amb27251175 [0,0,0,0,0,1|3,0,0]=4 2281 B13R1.135 COC(C)C(C)Nc1cccnc1 Amb27414785 [0,0,0,0,0,1|3,0,0]=4 2282 B13R1.135 COC(C)[C@@H](C)Nc1ccccn1 Amb28400506 [0,0,0,0,0,1|3,0,0]=4 2283 B13R1.135 COC(C)[C@@H](C)Nc1ccncc1 Amb27456087 [0,0,0,0,0,1|3,0,0]=4 2284 B13R1.135 COC(C)[C@H](C)Nc1ccncc1 Amb27260039 [0,0,0,0,0,1|3,0,0]=4 2285 B13R1.135 CSC(C)C(=O)Nc1ccccc1 Amb26348324 [0,0,0,0,0,1|1,0,2]=4 2286 B13R1.135 C[C@@H](NN)[C@@H](C)Nc1ccccc1 Amb27259065 [0,0,0,0,0,1|2,0,0]=3 2287 B13R1.135 C[C@H](NN)[C@@H](C)Nc1ccccc1 Amb27759543 [0,0,0,0,0,1|2,0,0]=3 2288 B13R1.135 N#C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb28401086 [0,0,0,0,0,1|3,0,0]=4 2289 B10R0.83 C\C=C\C=C\C(O)C(C)CC Amb27989864 [1,0,1,0,0,0|1,0,1]=4 2290 B10R0.75 C=C\C=C\C=C\C(O)C(C)O Amb28080074 [1,0,1,0,0,0|1,0,0]=3 2291 B10R1.15 BrCC(Br)c1ccccc1 Amb8394124 [2,0,0,0,0,0|2,0,0]=4 2292 B10R1.15 C#CC(O)c1ccccc1 Amb2721623 [2,0,0,0,0,0|0,0,2]=4 2293 B10R1.15 C#C[C@@H](O)c1ccccc1 Amb10844978 [2,0,0,0,0,0|0,0,2]=4 2294 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [2,0,0,0,0,0|0,0,2]=4 2295 B10R1.15 C=C(CN)c1ccccc1 Amb10609068 [2,0,0,0,0,0|1,0,1]=4 2296 B10R1.15 C=C(CN)c1ccccc1 Amb9421165 [2,0,0,0,0,0|1,0,1]=4 2297 B10R1.15 C=C(NC)c1ccccc1 Amb27975699 [2,0,0,0,0,0|1,0,1]=4 2298 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [2,0,0,0,0,0|0,0,2]=4 2299 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [2,0,0,0,0,0|0,0,2]=4 2300 B10R1.15 CC(CBr)c1ccccc1 Amb3940569 [2,0,0,0,0,0|2,0,0]=4 2301 B10R1.15 CC(CCl)c1ccccc1 Amb17232147 [2,0,0,0,0,0|2,0,0]=4 2302 B10R1.15 CC(CI)c1ccccc1 Amb26629255 [2,0,0,0,0,0|2,0,0]=4 2303 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [2,0,0,0,0,0|1,0,0]=3 2304 B10R1.15 CC(CN)c1ccccc1 Amb5717369 [2,0,0,0,0,0|1,0,0]=3 2305 B10R1.15 CC(CN)c1ccccn1 Amb33528304 [2,0,0,0,0,0|2,0,0]=4 2306 B10R1.15 CC(CN)c1cccnc1 Amb8950129 [2,0,0,0,0,0|2,0,0]=4 2307 B10R1.15 CC(CN)c1ccncc1 Amb32668866 [2,0,0,0,0,0|2,0,0]=4 2308 B10R1.15 CC(CN)c1ccncc1 Amb8950130 [2,0,0,0,0,0|2,0,0]=4 2309 B10R1.15 CC(CO)c1ccccc1 Amb2720837 [2,0,0,0,0,0|2,0,0]=4 2310 B10R1.15 CC(CS)c1ccccc1 Amb28349926 [2,0,0,0,0,0|2,0,0]=4 2311 B10R1.15 CC(NCl)c1ccccc1 Amb28049660 [2,0,0,0,0,0|2,0,0]=4 2312 B10R1.15 CC(NN)c1ccccc1 Amb10610271 [2,0,0,0,0,0|2,0,0]=4 2313 B10R1.15 CC(NN)c1ccccc1 Amb6251215 [2,0,0,0,0,0|2,0,0]=4 2314 B10R1.15 CC(NO)c1ccccc1 Amb10605006 [2,0,0,0,0,0|2,0,0]=4 2315 B10R1.15 CC(ON)c1ccccc1 Amb17089185 [2,0,0,0,0,0|2,0,0]=4 2316 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [2,0,0,0,0,0|2,0,0]=4 2317 B10R1.15 CCC(=O)c1ccccc1 Amb4037285 [2,0,0,0,0,0|0,0,2]=4 2318 B10R1.15 CCC(Br)c1ccccc1 Amb9210652 [2,0,0,0,0,0|1,0,0]=3 2319 B10R1.15 CCC(Br)c1ccccn1 Amb27647660 [2,0,0,0,0,0|2,0,0]=4 2320 B10R1.15 CCC(Br)c1cccnc1 Amb24556035 [2,0,0,0,0,0|2,0,0]=4 2321 B10R1.15 CCC(Br)c1ccncc1 Amb27463363 [2,0,0,0,0,0|2,0,0]=4 2322 B10R1.15 CCC(C)c1ccccc1 Amb9702788 [2,0,0,0,0,0|1,0,0]=3 2323 B10R1.15 CCC(C)c1ccccn1 Amb28145932 [2,0,0,0,0,0|2,0,0]=4 2324 B10R1.15 CCC(C)c1ccncc1 Amb26842817 [2,0,0,0,0,0|2,0,0]=4 2325 B10R1.15 CCC(Cl)c1ccccc1 Amb7766794 [2,0,0,0,0,0|1,0,0]=3 2326 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [2,0,0,0,0,0|1,0,0]=3 2327 B10R1.15 CCC(N)c1ccccc1 Amb9703596 [2,0,0,0,0,0|1,0,0]=3 2328 B10R1.15 CCC(N)c1ccccn1 Amb10607917 [2,0,0,0,0,0|2,0,0]=4 2329 B10R1.15 CCC(N)c1ccccn1 Amb22587075 [2,0,0,0,0,0|2,0,0]=4 2330 B10R1.15 CCC(N)c1cccnc1 Amb10607957 [2,0,0,0,0,0|2,0,0]=4 2331 B10R1.15 CCC(N)c1cccnc1 Amb30588534 [2,0,0,0,0,0|2,0,0]=4 2332 B10R1.15 CCC(N)c1ccncc1 Amb8009606 [2,0,0,0,0,0|2,0,0]=4 2333 B10R1.15 CCC(O)c1ccccc1 Amb6705776 [2,0,0,0,0,0|0,0,0]=2 2334 B10R1.15 CCC(O)c1ccccn1 Amb26851902 [2,0,0,0,0,0|1,0,0]=3 2335 B10R1.15 CCC(O)c1cccnc1 Amb17231904 [2,0,0,0,0,0|1,0,0]=3 2336 B10R1.15 CCC(O)c1ccncc1 Amb16233288 [2,0,0,0,0,0|1,0,0]=3 2337 B10R1.15 CCC(O)c1cncnc1 Amb26619472 [2,0,0,0,0,0|2,0,0]=4 2338 B10R1.15 CCC(O)c1ncccn1 Amb28049305 [2,0,0,0,0,0|2,0,0]=4 2339 B10R1.15 CCC(S)c1ccccc1 Amb9208017 [2,0,0,0,0,0|0,1,0]=3 2340 B10R1.15 CCN(N)c1ccccc1 Amb836839 [2,0,0,0,0,0|2,0,0]=4 2341 B10R1.15 CCP(Cl)c1ccccc1 Amb27765906 [2,0,0,0,0,0|2,0,0]=4 2342 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [2,0,0,0,0,0|1,0,1]=4 2343 B10R1.15 CC[C@@H](Br)c1ccccc1 Amb27761826 [2,0,0,0,0,0|1,0,0]=3 2344 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [2,0,0,0,0,0|1,0,0]=3 2345 B10R1.15 CC[C@@H](N)c1ccccc1 Amb8383789 [2,0,0,0,0,0|1,0,0]=3 2346 B10R1.15 CC[C@@H](N)c1ccccn1 Amb25797820 [2,0,0,0,0,0|2,0,0]=4 2347 B10R1.15 CC[C@@H](N)c1ccccn1 Amb30869540 [2,0,0,0,0,0|2,0,0]=4 2348 B10R1.15 CC[C@@H](N)c1ccncc1 Amb30647447 [2,0,0,0,0,0|2,0,0]=4 2349 B10R1.15 CC[C@@H](O)c1ccccc1 Amb8517168 [2,0,0,0,0,0|0,0,0]=2 2350 B10R1.15 CC[C@@H](O)c1ccccn1 Amb25717055 [2,0,0,0,0,0|1,0,0]=3 2351 B10R1.15 CC[C@@H](O)c1cccnc1 Amb27161307 [2,0,0,0,0,0|1,0,0]=3 2352 B10R1.15 CC[C@@H](O)c1cncnc1 Amb27431312 [2,0,0,0,0,0|2,0,0]=4 2353 B10R1.15 CC[C@H](Br)c1ccccc1 Amb27659277 [2,0,0,0,0,0|1,0,0]=3 2354 B10R1.15 CC[C@H](C)c1ccccc1 Amb28326096 [2,0,0,0,0,0|1,0,0]=3 2355 B10R1.15 CC[C@H](C)c1ccccn1 Amb27407415 [2,0,0,0,0,0|2,0,0]=4 2356 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [2,0,0,0,0,0|1,0,0]=3 2357 B10R1.15 CC[C@H](N)c1ccccc1 Amb8628779 [2,0,0,0,0,0|1,0,0]=3 2358 B10R1.15 CC[C@H](N)c1ccccn1 Amb26961005 [2,0,0,0,0,0|2,0,0]=4 2359 B10R1.15 CC[C@H](N)c1ccccn1 Amb33802008 [2,0,0,0,0,0|2,0,0]=4 2360 B10R1.15 CC[C@H](N)c1ccccn1 Amb33872493 [2,0,0,0,0,0|2,0,0]=4 2361 B10R1.15 CC[C@H](N)c1cccnc1 Amb30647446 [2,0,0,0,0,0|2,0,0]=4 2362 B10R1.15 CC[C@H](N)c1ccncc1 Amb27404537 [2,0,0,0,0,0|2,0,0]=4 2363 B10R1.15 CC[C@H](N)c1ccncc1 Amb30647448 [2,0,0,0,0,0|2,0,0]=4 2364 B10R1.15 CC[C@H](O)c1ccccc1 Amb8517167 [2,0,0,0,0,0|0,0,0]=2 2365 B10R1.15 CC[C@H](O)c1ccccn1 Amb25910593 [2,0,0,0,0,0|1,0,0]=3 2366 B10R1.15 CC[C@H](O)c1cccnc1 Amb24432697 [2,0,0,0,0,0|1,0,0]=3 2367 B10R1.15 CC[C@H](O)c1ccncc1 Amb27861997 [2,0,0,0,0,0|1,0,0]=3 2368 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [2,0,0,0,0,0|1,0,1]=4 2369 B10R1.15 CNC(=N)c1ccccc1 Amb28775800 [2,0,0,0,0,0|1,0,1]=4 2370 B10R1.15 CNC(=O)c1ccccc1 Amb2591685 [2,0,0,0,0,0|0,0,2]=4 2371 B10R1.15 CNC(=S)c1ccccc1 Amb10552988 [2,0,0,0,0,0|0,1,1]=4 2372 B10R1.15 CNC(C)c1ccccc1 Amb6382953 [2,0,0,0,0,0|1,0,0]=3 2373 B10R1.15 CNC(C)c1ccccc1 Amb9745717 [2,0,0,0,0,0|1,0,0]=3 2374 B10R1.15 CNC(C)c1ccccn1 Amb10189608 [2,0,0,0,0,0|2,0,0]=4 2375 B10R1.15 CNC(C)c1ccccn1 Amb22587689 [2,0,0,0,0,0|2,0,0]=4 2376 B10R1.15 CNC(C)c1ccccn1 Amb9705005 [2,0,0,0,0,0|2,0,0]=4 2377 B10R1.15 CNC(C)c1cccnc1 Amb10189690 [2,0,0,0,0,0|2,0,0]=4 2378 B10R1.15 CNC(C)c1cccnc1 Amb1121577 [2,0,0,0,0,0|2,0,0]=4 2379 B10R1.15 CNC(C)c1cccnc1 Amb22587688 [2,0,0,0,0,0|2,0,0]=4 2380 B10R1.15 CNC(C)c1ccncc1 Amb10189609 [2,0,0,0,0,0|2,0,0]=4 2381 B10R1.15 CNC(C)c1ccncc1 Amb22492289 [2,0,0,0,0,0|2,0,0]=4 2382 B10R1.15 CNC(C)c1ccncc1 Amb22587687 [2,0,0,0,0,0|2,0,0]=4 2383 B10R1.15 CNC(C)c1ccncc1 Amb9705906 [2,0,0,0,0,0|2,0,0]=4 2384 B10R1.15 CNN(C)c1ccccc1 Amb27398128 [2,0,0,0,0,0|2,0,0]=4 2385 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [2,0,0,0,0,0|1,0,0]=3 2386 B10R1.15 CN[C@@H](C)c1ccccn1 Amb24744532 [2,0,0,0,0,0|2,0,0]=4 2387 B10R1.15 CN[C@@H](C)c1ccccn1 Amb33457847 [2,0,0,0,0,0|2,0,0]=4 2388 B10R1.15 CN[C@@H](C)c1cccnc1 Amb27162166 [2,0,0,0,0,0|2,0,0]=4 2389 B10R1.15 CN[C@@H](C)c1cccnc1 Amb33457822 [2,0,0,0,0,0|2,0,0]=4 2390 B10R1.15 CN[C@@H](C)c1ccncc1 Amb28193264 [2,0,0,0,0,0|2,0,0]=4 2391 B10R1.15 CN[C@@H](C)c1ccncc1 Amb33457902 [2,0,0,0,0,0|2,0,0]=4 2392 B10R1.15 CN[C@H](C)c1ccccc1 Amb10844610 [2,0,0,0,0,0|1,0,0]=3 2393 B10R1.15 CN[C@H](C)c1ccccn1 Amb27391593 [2,0,0,0,0,0|2,0,0]=4 2394 B10R1.15 CN[C@H](C)c1cccnc1 Amb25084519 [2,0,0,0,0,0|2,0,0]=4 2395 B10R1.15 CN[C@H](C)c1cccnc1 Amb33328981 [2,0,0,0,0,0|2,0,0]=4 2396 B10R1.15 COC(C)c1ccccc1 Amb23568513 [2,0,0,0,0,0|2,0,0]=4 2397 B10R1.15 C[C@@H](CN)c1ccccc1 Amb33623692 [2,0,0,0,0,0|1,0,0]=3 2398 B10R1.15 C[C@@H](CN)c1ccccc1 Amb4036825 [2,0,0,0,0,0|1,0,0]=3 2399 B10R1.15 C[C@@H](CN)c1cccnc1 Amb33744398 [2,0,0,0,0,0|2,0,0]=4 2400 B10R1.15 C[C@@H](CN)c1ccncc1 Amb33727423 [2,0,0,0,0,0|2,0,0]=4 2401 B10R1.15 C[C@@H](CO)c1ccccc1 Amb3939247 [2,0,0,0,0,0|2,0,0]=4 2402 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [2,0,0,0,0,0|2,0,0]=4 2403 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [2,0,0,0,0,0|2,0,0]=4 2404 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [2,0,0,0,0,0|2,0,0]=4 2405 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [2,0,0,0,0,0|2,0,0]=4 2406 B10R1.15 C[C@@H](ON)c1ccccc1 Amb32665789 [2,0,0,0,0,0|2,0,0]=4 2407 B10R1.15 C[C@H](CN)c1ccccc1 Amb10070369 [2,0,0,0,0,0|1,0,0]=3 2408 B10R1.15 C[C@H](CN)c1cccnc1 Amb33740278 [2,0,0,0,0,0|2,0,0]=4 2409 B10R1.15 C[C@H](CN)c1ccncc1 Amb33747422 [2,0,0,0,0,0|2,0,0]=4 2410 B10R1.15 C[C@H](CO)c1ccccc1 Amb3939248 [2,0,0,0,0,0|2,0,0]=4 2411 B10R1.15 C[C@H](NN)c1ccccc1 Amb26589811 [2,0,0,0,0,0|2,0,0]=4 2412 B10R1.15 C[C@H](ON)c1ccccc1 Amb32665788 [2,0,0,0,0,0|2,0,0]=4 2413 B10R1.15 C[C@H](ON)c1ccccc1 Amb32666539 [2,0,0,0,0,0|2,0,0]=4 2414 B10R1.15 ClCC(Cl)c1ccccc1 Amb2720893 [2,0,0,0,0,0|2,0,0]=4 2415 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [2,0,0,0,0,0|2,0,0]=4 2416 B10R1.15 FC(CCl)c1ccccc1 Amb27596575 [2,0,0,0,0,0|2,0,0]=4 2417 B10R1.15 N#CC(O)c1ccccc1 Amb3997186 [2,0,0,0,0,0|0,0,2]=4 2418 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [2,0,0,0,0,0|0,0,2]=4 2419 B10R1.15 NC(CCl)c1ccccc1 Amb27602197 [2,0,0,0,0,0|2,0,0]=4 2420 B10R1.15 NC(CF)c1ccccc1 Amb2372575 [2,0,0,0,0,0|2,0,0]=4 2421 B10R1.15 NC(CF)c1ccccc1 Amb33362248 [2,0,0,0,0,0|2,0,0]=4 2422 B10R1.15 NC(CO)c1ccccc1 Amb8513829 [2,0,0,0,0,0|2,0,0]=4 2423 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [2,0,0,0,0,0|0,0,2]=4 2424 B10R1.15 NCC(=O)c1ccccc1 Amb33531112 [2,0,0,0,0,0|0,0,2]=4 2425 B10R1.15 NCC(Cl)c1ccccc1 Amb27984951 [2,0,0,0,0,0|1,0,0]=3 2426 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [2,0,0,0,0,0|1,0,0]=3 2427 B10R1.15 NCC(F)c1ccccc1 Amb33249671 [2,0,0,0,0,0|1,0,0]=3 2428 B10R1.15 NCC(F)c1ccccn1 Amb24473175 [2,0,0,0,0,0|2,0,0]=4 2429 B10R1.15 NCC(F)c1cccnc1 Amb27405475 [2,0,0,0,0,0|2,0,0]=4 2430 B10R1.15 NCC(F)c1ccncc1 Amb27653637 [2,0,0,0,0,0|2,0,0]=4 2431 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [2,0,0,0,0,0|1,0,0]=3 2432 B10R1.15 NCC(N)c1ccccc1 Amb33473621 [2,0,0,0,0,0|1,0,0]=3 2433 B10R1.15 NCC(N)c1ccccc1 Amb9380661 [2,0,0,0,0,0|1,0,0]=3 2434 B10R1.15 NCC(N)c1ccncc1 Amb18063802 [2,0,0,0,0,0|2,0,0]=4 2435 B10R1.15 NCC(O)c1ccccc1 Amb33542602 [2,0,0,0,0,0|0,0,0]=2 2436 B10R1.15 NCC(O)c1ccccc1 Amb33544420 [2,0,0,0,0,0|0,0,0]=2 2437 B10R1.15 NCC(O)c1ccccn1 Amb1109027 [2,0,0,0,0,0|1,0,0]=3 2438 B10R1.15 NCC(O)c1ccccn1 Amb20622942 [2,0,0,0,0,0|1,0,0]=3 2439 B10R1.15 NCC(O)c1ccccn1 Amb6892508 [2,0,0,0,0,0|1,0,0]=3 2440 B10R1.15 NCC(O)c1cccnc1 Amb10068830 [2,0,0,0,0,0|1,0,0]=3 2441 B10R1.15 NCC(O)c1cccnc1 Amb8503375 [2,0,0,0,0,0|1,0,0]=3 2442 B10R1.15 NCC(O)c1cccnc1 Amb9703829 [2,0,0,0,0,0|1,0,0]=3 2443 B10R1.15 NCC(O)c1ccncc1 Amb22755845 [2,0,0,0,0,0|1,0,0]=3 2444 B10R1.15 NCC(O)c1ccncc1 Amb9703695 [2,0,0,0,0,0|1,0,0]=3 2445 B10R1.15 NCC(O)c1ccncn1 Amb24434504 [2,0,0,0,0,0|2,0,0]=4 2446 B10R1.15 NCC(O)c1cnccn1 Amb27230477 [2,0,0,0,0,0|2,0,0]=4 2447 B10R1.15 NCC(O)c1cncnc1 Amb25731161 [2,0,0,0,0,0|2,0,0]=4 2448 B10R1.15 NCC(O)c1ncccn1 Amb26039872 [2,0,0,0,0,0|2,0,0]=4 2449 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [2,0,0,0,0,0|1,0,0]=3 2450 B10R1.15 NC[C@@H](F)c1ccccc1 Amb32661014 [2,0,0,0,0,0|1,0,0]=3 2451 B10R1.15 NC[C@@H](N)c1cccnc1 Amb28046917 [2,0,0,0,0,0|2,0,0]=4 2452 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [2,0,0,0,0,0|0,0,0]=2 2453 B10R1.15 NC[C@@H](O)c1ccccc1 Amb8630286 [2,0,0,0,0,0|0,0,0]=2 2454 B10R1.15 NC[C@@H](O)c1ccccn1 Amb25052826 [2,0,0,0,0,0|1,0,0]=3 2455 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22744742 [2,0,0,0,0,0|1,0,0]=3 2456 B10R1.15 NC[C@@H](O)c1cccnc1 Amb22748405 [2,0,0,0,0,0|1,0,0]=3 2457 B10R1.15 NC[C@@H](O)c1ccncc1 Amb24479579 [2,0,0,0,0,0|1,0,0]=3 2458 B10R1.15 NC[C@@H](O)c1ccncn1 Amb24546069 [2,0,0,0,0,0|2,0,0]=4 2459 B10R1.15 NC[C@@H](O)c1cnccn1 Amb25370172 [2,0,0,0,0,0|2,0,0]=4 2460 B10R1.15 NC[C@@H](O)c1cncnc1 Amb33149206 [2,0,0,0,0,0|2,0,0]=4 2461 B10R1.15 NC[C@@H](O)c1ncccn1 Amb33270410 [2,0,0,0,0,0|2,0,0]=4 2462 B10R1.15 NC[C@H](N)c1ccncc1 Amb27617070 [2,0,0,0,0,0|2,0,0]=4 2463 B10R1.15 NC[C@H](O)c1ccccc1 Amb10070626 [2,0,0,0,0,0|0,0,0]=2 2464 B10R1.15 NC[C@H](O)c1ccccc1 Amb8631408 [2,0,0,0,0,0|0,0,0]=2 2465 B10R1.15 NC[C@H](O)c1ccccn1 Amb24569794 [2,0,0,0,0,0|1,0,0]=3 2466 B10R1.15 NC[C@H](O)c1cccnc1 Amb23385336 [2,0,0,0,0,0|1,0,0]=3 2467 B10R1.15 NC[C@H](O)c1cccnc1 Amb25127978 [2,0,0,0,0,0|1,0,0]=3 2468 B10R1.15 NC[C@H](O)c1ccncc1 Amb27227500 [2,0,0,0,0,0|1,0,0]=3 2469 B10R1.15 NC[C@H](O)c1ccncn1 Amb25917456 [2,0,0,0,0,0|2,0,0]=4 2470 B10R1.15 NC[C@H](O)c1cnccn1 Amb26496616 [2,0,0,0,0,0|2,0,0]=4 2471 B10R1.15 NC[C@H](O)c1cncnc1 Amb33149202 [2,0,0,0,0,0|2,0,0]=4 2472 B10R1.15 NC[C@H](O)c1ncccn1 Amb33225262 [2,0,0,0,0,0|2,0,0]=4 2473 B10R1.15 NC[PH](=O)c1ccccc1 Amb28119772 [2,0,0,0,0,0|1,0,1]=4 2474 B10R1.15 N[C@@H](CBr)c1ccccc1 Amb27876239 [2,0,0,0,0,0|2,0,0]=4 2475 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [2,0,0,0,0,0|2,0,0]=4 2476 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [2,0,0,0,0,0|2,0,0]=4 2477 B10R1.15 N[C@@H](CO)c1ccccc1 Amb3939344 [2,0,0,0,0,0|2,0,0]=4 2478 B10R1.15 N[C@H](CCl)c1ccccc1 Amb27214165 [2,0,0,0,0,0|2,0,0]=4 2479 B10R1.15 N[C@H](CF)c1ccccc1 Amb27768745 [2,0,0,0,0,0|2,0,0]=4 2480 B10R1.15 N[C@H](CF)c1ccccc1 Amb33482690 [2,0,0,0,0,0|2,0,0]=4 2481 B10R1.15 N[C@H](CO)c1ccccc1 Amb2720557 [2,0,0,0,0,0|2,0,0]=4 2482 B10R1.15 O=CC(O)c1ccccc1 Amb17593446 [2,0,0,0,0,0|1,0,1]=4 2483 B10R1.15 O=C[C@H](O)c1ccccc1 Amb28388660 [2,0,0,0,0,0|1,0,1]=4 2484 B10R1.15 OC(CBr)c1ccccc1 Amb17206105 [2,0,0,0,0,0|1,0,0]=3 2485 B10R1.15 OC(CBr)c1ccccn1 Amb27623201 [2,0,0,0,0,0|2,0,0]=4 2486 B10R1.15 OC(CBr)c1ccncc1 Amb24099591 [2,0,0,0,0,0|2,0,0]=4 2487 B10R1.15 OC(CCl)c1ccccc1 Amb9826903 [2,0,0,0,0,0|1,0,0]=3 2488 B10R1.15 OC(CCl)c1ccccn1 Amb26455692 [2,0,0,0,0,0|2,0,0]=4 2489 B10R1.15 OC(CCl)c1cccnc1 Amb3319284 [2,0,0,0,0,0|2,0,0]=4 2490 B10R1.15 OC(CCl)c1ccncc1 Amb27470348 [2,0,0,0,0,0|2,0,0]=4 2491 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [2,0,0,0,0,0|1,0,0]=3 2492 B10R1.15 OC(CF)c1ccccn1 Amb25136249 [2,0,0,0,0,0|2,0,0]=4 2493 B10R1.15 OC(CF)c1cccnc1 Amb33360057 [2,0,0,0,0,0|2,0,0]=4 2494 B10R1.15 OC(CF)c1ccncc1 Amb33380647 [2,0,0,0,0,0|2,0,0]=4 2495 B10R1.15 OC(CI)c1ccccc1 Amb28073875 [2,0,0,0,0,0|1,0,0]=3 2496 B10R1.15 OC(CS)c1ccccc1 Amb10608997 [2,0,0,0,0,0|1,0,0]=3 2497 B10R1.15 OCC(Br)c1ccccc1 Amb27971765 [2,0,0,0,0,0|2,0,0]=4 2498 B10R1.15 OCC(Cl)c1ccccc1 Amb27165767 [2,0,0,0,0,0|2,0,0]=4 2499 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [2,0,0,0,0,0|2,0,0]=4 2500 B10R1.15 OCC(O)c1ccccc1 Amb4350706 [2,0,0,0,0,0|1,0,0]=3 2501 B10R1.15 OCC(O)c1ccccn1 Amb4017599 [2,0,0,0,0,0|2,0,0]=4 2502 B10R1.15 OCC(O)c1cccnc1 Amb23538717 [2,0,0,0,0,0|2,0,0]=4 2503 B10R1.15 OCC(O)c1ccncc1 Amb23538718 [2,0,0,0,0,0|2,0,0]=4 2504 B10R1.15 OCC(O)c1ccncc1 Amb32656243 [2,0,0,0,0,0|2,0,0]=4 2505 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [2,0,0,0,0,0|1,1,0]=4 2506 B10R1.15 OC[C@@H](O)c1ccccc1 Amb8514912 [2,0,0,0,0,0|1,0,0]=3 2507 B10R1.15 OC[C@@H](O)c1ccccn1 Amb26554033 [2,0,0,0,0,0|2,0,0]=4 2508 B10R1.15 OC[C@@H](O)c1ccncc1 Amb28291407 [2,0,0,0,0,0|2,0,0]=4 2509 B10R1.15 OC[C@H](Br)c1ccccc1 Amb27798351 [2,0,0,0,0,0|2,0,0]=4 2510 B10R1.15 OC[C@H](Cl)c1ccccc1 Amb27659257 [2,0,0,0,0,0|2,0,0]=4 2511 B10R1.15 OC[C@H](O)c1ccccc1 Amb8389336 [2,0,0,0,0,0|1,0,0]=3 2512 B10R1.15 OC[C@H](O)c1ccccn1 Amb27838863 [2,0,0,0,0,0|2,0,0]=4 2513 B10R1.15 OC[C@H](S)c1ccccc1 Amb28207325 [2,0,0,0,0,0|1,1,0]=4 2514 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [2,0,0,0,0,0|1,0,0]=3 2515 B10R1.15 O[C@@H](CBr)c1cccnc1 Amb27614899 [2,0,0,0,0,0|2,0,0]=4 2516 B10R1.15 O[C@@H](CCl)c1ccccc1 Amb16231709 [2,0,0,0,0,0|1,0,0]=3 2517 B10R1.15 O[C@@H](CCl)c1ccccn1 Amb28122883 [2,0,0,0,0,0|2,0,0]=4 2518 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [2,0,0,0,0,0|1,0,0]=3 2519 B10R1.15 O[C@@H](CF)c1ccccn1 Amb27839237 [2,0,0,0,0,0|2,0,0]=4 2520 B10R1.15 O[C@@H](CS)c1ccccc1 Amb27604413 [2,0,0,0,0,0|1,0,0]=3 2521 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [2,0,0,0,0,0|1,0,0]=3 2522 B10R1.15 O[C@H](CCl)c1ccccc1 Amb8394082 [2,0,0,0,0,0|1,0,0]=3 2523 B10R1.15 O[C@H](CCl)c1ccncc1 Amb27973641 [2,0,0,0,0,0|2,0,0]=4 2524 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [2,0,0,0,0,0|1,0,0]=3 2525 B10R1.15 O[C@H](CF)c1ccccn1 Amb27979963 [2,0,0,0,0,0|2,0,0]=4 2526 B10R1.15 O[C@H](CS)c1ccccc1 Amb27494941 [2,0,0,0,0,0|1,0,0]=3 2527 B10R1.17 BrCCCc1ccccc1 Amb2721516 [2,0,0,0,0,0|2,0,0]=4 2528 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [2,0,0,0,0,0|2,0,0]=4 2529 B10R1.17 C#CCCc1ccccc1 Amb6336492 [2,0,0,0,0,0|1,0,1]=4 2530 B10R1.17 C=CCCc1ccccc1 Amb2721241 [2,0,0,0,0,0|1,0,1]=4 2531 B10R1.17 CCCC[n+]1ccccc1 Amb8393211 [2,0,0,0,0,0|2,0,0]=4 2532 B10R1.17 CCCC[n+]1ccccc1 Amb8516223 [2,0,0,0,0,0|2,0,0]=4 2533 B10R1.17 CCCC[n+]1ccccc1 Amb8516227 [2,0,0,0,0,0|2,0,0]=4 2534 B10R1.17 CCCC[n+]1ccccc1 Amb8516263 [2,0,0,0,0,0|2,0,0]=4 2535 B10R1.17 CCCCc1ccccc1 Amb6608912 [2,0,0,0,0,0|1,0,0]=3 2536 B10R1.17 CCCCc1ccccn1 Amb8395993 [2,0,0,0,0,0|2,0,0]=4 2537 B10R1.17 CCCCc1cccnc1 Amb4037068 [2,0,0,0,0,0|2,0,0]=4 2538 B10R1.17 CCCCc1ccncc1 Amb10555008 [2,0,0,0,0,0|2,0,0]=4 2539 B10R1.17 CCCNc1ccccc1 Amb534130 [2,0,0,0,0,0|2,0,0]=4 2540 B10R1.17 CCCOc1ccccc1 Amb2842271 [2,0,0,0,0,0|2,0,0]=4 2541 B10R1.17 CCCSc1ccccc1 Amb4014460 [2,0,0,0,0,0|2,0,0]=4 2542 B10R1.17 CCNCc1ccccc1 Amb3699539 [2,0,0,0,0,0|2,0,0]=4 2543 B10R1.17 CCOCc1ccccc1 Amb9787555 [2,0,0,0,0,0|2,0,0]=4 2544 B10R1.17 CCSCc1ccccc1 Amb9787636 [2,0,0,0,0,0|2,0,0]=4 2545 B10R1.17 CNC#Cc1ccccc1 Amb28422275 [2,0,0,0,0,0|0,0,2]=4 2546 B10R1.17 CNCCc1ccccc1 Amb1132990 [2,0,0,0,0,0|0,0,0]=2 2547 B10R1.17 CNCCc1ccccc1 Amb33545919 [2,0,0,0,0,0|0,0,0]=2 2548 B10R1.17 CNCCc1ccccn1 Amb1651624 [2,0,0,0,0,0|1,0,0]=3 2549 B10R1.17 CNCCc1ccccn1 Amb22167479 [2,0,0,0,0,0|1,0,0]=3 2550 B10R1.17 CNCCc1ccccn1 Amb6741463 [2,0,0,0,0,0|1,0,0]=3 2551 B10R1.17 CNCCc1cccnc1 Amb10068754 [2,0,0,0,0,0|1,0,0]=3 2552 B10R1.17 CNCCc1cccnc1 Amb10576410 [2,0,0,0,0,0|1,0,0]=3 2553 B10R1.17 CNCCc1ccncc1 Amb10071184 [2,0,0,0,0,0|1,0,0]=3 2554 B10R1.17 CNCCc1ccncc1 Amb19958269 [2,0,0,0,0,0|1,0,0]=3 2555 B10R1.17 CNCCc1ccncc1 Amb2592519 [2,0,0,0,0,0|1,0,0]=3 2556 B10R1.17 CNCCc1ccncn1 Amb8010524 [2,0,0,0,0,0|2,0,0]=4 2557 B10R1.17 CNCCc1cnccn1 Amb22059364 [2,0,0,0,0,0|2,0,0]=4 2558 B10R1.17 CNCCc1cncnc1 Amb8010527 [2,0,0,0,0,0|2,0,0]=4 2559 B10R1.17 CNCCc1ncccn1 Amb31156561 [2,0,0,0,0,0|2,0,0]=4 2560 B10R1.17 CNCCc1ncccn1 Amb8010522 [2,0,0,0,0,0|2,0,0]=4 2561 B10R1.17 CNNCc1ccccc1 Amb26859422 [2,0,0,0,0,0|1,0,0]=3 2562 B10R1.17 CNNCc1ccccc1 Amb33328543 [2,0,0,0,0,0|1,0,0]=3 2563 B10R1.17 CNNCc1ccccn1 Amb26421896 [2,0,0,0,0,0|2,0,0]=4 2564 B10R1.17 CNNCc1cccnc1 Amb24558769 [2,0,0,0,0,0|2,0,0]=4 2565 B10R1.17 CNOCc1ccccc1 Amb22059601 [2,0,0,0,0,0|1,0,0]=3 2566 B10R1.17 CNOCc1ccccc1 Amb32412803 [2,0,0,0,0,0|1,0,0]=3 2567 B10R1.17 CN\N=C\c1ccccc1 Amb17867553 [2,0,0,0,0,0|1,0,1]=4 2568 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [2,0,0,0,0,0|2,0,0]=4 2569 B10R1.17 COCC[n+]1ccccc1 Amb28125435 [2,0,0,0,0,0|2,0,0]=4 2570 B10R1.17 COCCc1ccccc1 Amb4020014 [2,0,0,0,0,0|1,0,0]=3 2571 B10R1.17 COCCc1ccccn1 Amb4034583 [2,0,0,0,0,0|2,0,0]=4 2572 B10R1.17 COCCc1ccncc1 Amb26565974 [2,0,0,0,0,0|2,0,0]=4 2573 B10R1.17 COCOc1ccccc1 Amb2608594 [2,0,0,0,0,0|2,0,0]=4 2574 B10R1.17 CONCc1ccccc1 Amb26432339 [2,0,0,0,0,0|2,0,0]=4 2575 B10R1.17 CSCCc1ccccc1 Amb26586093 [2,0,0,0,0,0|1,0,0]=3 2576 B10R1.17 CSCCc1ccccn1 Amb24552366 [2,0,0,0,0,0|2,0,0]=4 2577 B10R1.17 CSCNc1ccccc1 Amb25992690 [2,0,0,0,0,0|2,0,0]=4 2578 B10R1.17 CSCOc1ccccc1 Amb22231357 [2,0,0,0,0,0|2,0,0]=4 2579 B10R1.17 C\C=C\Cc1ccccc1 Amb4035140 [2,0,0,0,0,0|1,0,1]=4 2580 B10R1.17 ClCCCc1ccccc1 Amb3941487 [2,0,0,0,0,0|2,0,0]=4 2581 B10R1.17 ICCCc1ccccc1 Amb10605506 [2,0,0,0,0,0|2,0,0]=4 2582 B10R1.17 N#CCCc1ccccc1 Amb33551192 [2,0,0,0,0,0|2,0,0]=4 2583 B10R1.17 NCCCc1ccccc1 Amb844788 [2,0,0,0,0,0|2,0,0]=4 2584 B10R1.17 NNCCc1ccccc1 Amb10608987 [2,0,0,0,0,0|1,0,0]=3 2585 B10R1.17 NNCCc1ccccc1 Amb1117029 [2,0,0,0,0,0|1,0,0]=3 2586 B10R1.17 NNCCc1ccccc1 Amb33552804 [2,0,0,0,0,0|1,0,0]=3 2587 B10R1.17 NNCCc1ccccn1 Amb20669588 [2,0,0,0,0,0|2,0,0]=4 2588 B10R1.17 NNCCc1ccccn1 Amb33528741 [2,0,0,0,0,0|2,0,0]=4 2589 B10R1.17 NNCCc1ccncc1 Amb6248763 [2,0,0,0,0,0|2,0,0]=4 2590 B10R1.17 NOCCc1ccccc1 Amb2899735 [2,0,0,0,0,0|2,0,0]=4 2591 B10R1.17 NOCCc1ccccc1 Amb6308543 [2,0,0,0,0,0|2,0,0]=4 2592 B10R1.17 O=CCCc1ccccc1 Amb2720576 [2,0,0,0,0,0|2,0,0]=4 2593 B10R1.17 OCCCc1ccccc1 Amb3939054 [2,0,0,0,0,0|2,0,0]=4 2594 B10R1.17 ONCCc1ccccc1 Amb33544180 [2,0,0,0,0,0|1,0,0]=3 2595 B10R1.17 SCCCc1ccccc1 Amb6255807 [2,0,0,0,0,0|2,0,0]=4 2596 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [2,0,0,0,0,0|0,0,2]=4 2597 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [2,0,0,0,0,0|1,1,0]=4 2598 B10R1.18 BrC(Br)Cc1ccccc1 Amb28049679 [2,0,0,0,0,0|2,0,0]=4 2599 B10R1.18 C=C(N)Cc1ccccc1 Amb27424990 [2,0,0,0,0,0|0,0,2]=4 2600 B10R1.18 CC(=O)Cc1ccccc1 Amb4136401 [2,0,0,0,0,0|1,0,1]=4 2601 B10R1.18 CC(Br)Cc1ccccc1 Amb3940198 [2,0,0,0,0,0|1,0,0]=3 2602 B10R1.18 CC(Br)Cc1ccccn1 Amb27424955 [2,0,0,0,0,0|2,0,0]=4 2603 B10R1.18 CC(Br)Cc1ccncc1 Amb33506239 [2,0,0,0,0,0|2,0,0]=4 2604 B10R1.18 CC(C)=Cc1ccccc1 Amb6296059 [2,0,0,0,0,0|0,0,2]=4 2605 B10R1.18 CC(C)C[n+]1ccccc1 Amb28189122 [2,0,0,0,0,0|1,0,0]=3 2606 B10R1.18 CC(C)Cc1ccccc1 Amb2778549 [2,0,0,0,0,0|0,0,0]=2 2607 B10R1.18 CC(C)Cc1ccccn1 Amb15691003 [2,0,0,0,0,0|1,0,0]=3 2608 B10R1.18 CC(C)Cc1cccnc1 Amb22043313 [2,0,0,0,0,0|1,0,0]=3 2609 B10R1.18 CC(C)Cc1ccncc1 Amb2613008 [2,0,0,0,0,0|1,0,0]=3 2610 B10R1.18 CC(C)Cc1ccncn1 Amb24070388 [2,0,0,0,0,0|2,0,0]=4 2611 B10R1.18 CC(C)Nc1ccccc1 Amb2720884 [2,0,0,0,0,0|1,0,0]=3 2612 B10R1.18 CC(C)Nc1ccccn1 Amb1104052 [2,0,0,0,0,0|2,0,0]=4 2613 B10R1.18 CC(C)Nc1cccnc1 Amb16231494 [2,0,0,0,0,0|2,0,0]=4 2614 B10R1.18 CC(C)Nc1cccnc1 Amb2382996 [2,0,0,0,0,0|2,0,0]=4 2615 B10R1.18 CC(C)Nc1ccncc1 Amb16231495 [2,0,0,0,0,0|2,0,0]=4 2616 B10R1.18 CC(C)Oc1ccccc1 Amb3429104 [2,0,0,0,0,0|1,0,0]=3 2617 B10R1.18 CC(C)Oc1ccccn1 Amb22304705 [2,0,0,0,0,0|2,0,0]=4 2618 B10R1.18 CC(C)Oc1cccnc1 Amb22898896 [2,0,0,0,0,0|2,0,0]=4 2619 B10R1.18 CC(C)Oc1ccncc1 Amb20242496 [2,0,0,0,0,0|2,0,0]=4 2620 B10R1.18 CC(C)Sc1ccccc1 Amb5721900 [2,0,0,0,0,0|1,0,0]=3 2621 B10R1.18 CC(N)Cc1ccccc1 Amb17608372 [2,0,0,0,0,0|0,0,0]=2 2622 B10R1.18 CC(N)Cc1ccccc1 Amb4079275 [2,0,0,0,0,0|0,0,0]=2 2623 B10R1.18 CC(N)Cc1ccccn1 Amb1995149 [2,0,0,0,0,0|1,0,0]=3 2624 B10R1.18 CC(N)Cc1cccnc1 Amb9712156 [2,0,0,0,0,0|1,0,0]=3 2625 B10R1.18 CC(N)Cc1ccncc1 Amb2592094 [2,0,0,0,0,0|1,0,0]=3 2626 B10R1.18 CC(N)Cc1cnccn1 Amb10609115 [2,0,0,0,0,0|2,0,0]=4 2627 B10R1.18 CC(N)Cc1cnccn1 Amb10609131 [2,0,0,0,0,0|2,0,0]=4 2628 B10R1.18 CC(N)Cc1cnccn1 Amb1995174 [2,0,0,0,0,0|2,0,0]=4 2629 B10R1.18 CC(N)Cc1ncccn1 Amb18064016 [2,0,0,0,0,0|2,0,0]=4 2630 B10R1.18 CC(O)C[n+]1ccccc1 Amb27213830 [2,0,0,0,0,0|2,0,0]=4 2631 B10R1.18 CC(O)Cc1ccccc1 Amb3940116 [2,0,0,0,0,0|1,0,0]=3 2632 B10R1.18 CC(O)Cc1ccccn1 Amb1995148 [2,0,0,0,0,0|2,0,0]=4 2633 B10R1.18 CC(O)Cc1cccnc1 Amb33530732 [2,0,0,0,0,0|2,0,0]=4 2634 B10R1.18 CC(O)Cc1ccncc1 Amb17477789 [2,0,0,0,0,0|2,0,0]=4 2635 B10R1.18 CC(O)Nc1ccccc1 Amb27771797 [2,0,0,0,0,0|2,0,0]=4 2636 B10R1.18 CC(O)Oc1ccccc1 Amb27838966 [2,0,0,0,0,0|2,0,0]=4 2637 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [2,0,0,0,0,0|1,0,0]=3 2638 B10R1.18 CN(C)Cc1ccccc1 Amb6608891 [2,0,0,0,0,0|1,0,0]=3 2639 B10R1.18 CN(C)Cc1ccccn1 Amb4010724 [2,0,0,0,0,0|2,0,0]=4 2640 B10R1.18 CN(C)Cc1cccnc1 Amb2694185 [2,0,0,0,0,0|2,0,0]=4 2641 B10R1.18 CN(C)Cc1ccncc1 Amb20247602 [2,0,0,0,0,0|2,0,0]=4 2642 B10R1.18 CN(C)Sc1ccccc1 Amb28388759 [2,0,0,0,0,0|2,0,0]=4 2643 B10R1.18 CN(N)Cc1ccccc1 Amb836790 [2,0,0,0,0,0|1,0,0]=3 2644 B10R1.18 CN(N)Cc1cccnc1 Amb28049624 [2,0,0,0,0,0|2,0,0]=4 2645 B10R1.18 CN(N)Cc1ccncc1 Amb27180025 [2,0,0,0,0,0|2,0,0]=4 2646 B10R1.18 CN(O)Cc1ccccc1 Amb27149097 [2,0,0,0,0,0|2,0,0]=4 2647 B10R1.18 CP(C)Cc1ccccc1 Amb26928754 [2,0,0,0,0,0|1,0,0]=3 2648 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [2,0,0,0,0,0|2,0,0]=4 2649 B10R1.18 C[C@@H](Br)Cc1ccccc1 Amb28182471 [2,0,0,0,0,0|1,0,0]=3 2650 B10R1.18 C[C@@H](Cl)Cc1ccccc1 Amb8389890 [2,0,0,0,0,0|1,0,0]=3 2651 B10R1.18 C[C@@H](I)Cc1ccccc1 Amb27199901 [2,0,0,0,0,0|1,0,0]=3 2652 B10R1.18 C[C@@H](N)Cc1ccccn1 Amb27754695 [2,0,0,0,0,0|1,0,0]=3 2653 B10R1.18 C[C@@H](N)Cc1cccnc1 Amb26602572 [2,0,0,0,0,0|1,0,0]=3 2654 B10R1.18 C[C@@H](N)Cc1ccncc1 Amb28044876 [2,0,0,0,0,0|1,0,0]=3 2655 B10R1.18 C[C@@H](N)Cc1ccncn1 Amb33268596 [2,0,0,0,0,0|2,0,0]=4 2656 B10R1.18 C[C@@H](N)Cc1cnccn1 Amb25127231 [2,0,0,0,0,0|2,0,0]=4 2657 B10R1.18 C[C@@H](N)Cc1cncnc1 Amb33149179 [2,0,0,0,0,0|2,0,0]=4 2658 B10R1.18 C[C@@H](N)Cc1ncccn1 Amb33225259 [2,0,0,0,0,0|2,0,0]=4 2659 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [2,0,0,0,0,0|1,0,0]=3 2660 B10R1.18 C[C@@H](O)Cc1ccccn1 Amb27839538 [2,0,0,0,0,0|2,0,0]=4 2661 B10R1.18 C[C@@H](O)Cc1cccnc1 Amb22896922 [2,0,0,0,0,0|2,0,0]=4 2662 B10R1.18 C[C@@H](O)Cc1ccncc1 Amb33380651 [2,0,0,0,0,0|2,0,0]=4 2663 B10R1.18 C[C@H](Br)Cc1ccccc1 Amb27484166 [2,0,0,0,0,0|1,0,0]=3 2664 B10R1.18 C[C@H](I)Cc1ccccc1 Amb27635996 [2,0,0,0,0,0|1,0,0]=3 2665 B10R1.18 C[C@H](N)Cc1ccccc1 Amb8395458 [2,0,0,0,0,0|0,0,0]=2 2666 B10R1.18 C[C@H](N)Cc1ccccn1 Amb24451425 [2,0,0,0,0,0|1,0,0]=3 2667 B10R1.18 C[C@H](N)Cc1cccnc1 Amb27145739 [2,0,0,0,0,0|1,0,0]=3 2668 B10R1.18 C[C@H](N)Cc1ccncc1 Amb28381274 [2,0,0,0,0,0|1,0,0]=3 2669 B10R1.18 C[C@H](N)Cc1ccncn1 Amb33268595 [2,0,0,0,0,0|2,0,0]=4 2670 B10R1.18 C[C@H](N)Cc1cnccn1 Amb24360532 [2,0,0,0,0,0|2,0,0]=4 2671 B10R1.18 C[C@H](N)Cc1cncnc1 Amb33149178 [2,0,0,0,0,0|2,0,0]=4 2672 B10R1.18 C[C@H](N)Cc1ncccn1 Amb33270393 [2,0,0,0,0,0|2,0,0]=4 2673 B10R1.18 C[C@H](O)Cc1ccccc1 Amb10068519 [2,0,0,0,0,0|1,0,0]=3 2674 B10R1.18 C[C@H](O)Cc1ccccn1 Amb26605951 [2,0,0,0,0,0|2,0,0]=4 2675 B10R1.18 C[C@H](O)Cc1cccnc1 Amb28041599 [2,0,0,0,0,0|2,0,0]=4 2676 B10R1.18 C[C@H](O)Cc1ccncc1 Amb33380652 [2,0,0,0,0,0|2,0,0]=4 2677 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [2,0,0,0,0,0|0,1,0]=3 2678 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [2,0,0,0,0,0|0,1,0]=3 2679 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [2,0,0,0,0,0|2,0,0]=4 2680 B10R1.18 N=C(N)Cc1ccccc1 Amb33551496 [2,0,0,0,0,0|1,0,1]=4 2681 B10R1.18 N=C(N)Cc1ccccc1 Amb745036 [2,0,0,0,0,0|1,0,1]=4 2682 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [2,0,0,0,0,0|1,0,1]=4 2683 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [2,0,0,0,0,0|1,0,1]=4 2684 B10R1.18 NC(N)Cc1ccccc1 Amb27823264 [2,0,0,0,0,0|1,0,0]=3 2685 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [2,0,0,0,0,0|1,0,0]=3 2686 B10R1.18 NS(=O)Cc1ccccc1 Amb28370210 [2,0,0,0,0,0|2,0,0]=4 2687 B10R1.18 OC(Cl)Cc1ccccc1 Amb27228646 [2,0,0,0,0,0|2,0,0]=4 2688 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [2,0,0,0,0,0|2,0,0]=4 2689 B12R1.3 C#CCC(CO)c1ccccc1 Amb27662159 [1,1,0,0,0,0|1,0,1]=4 2690 B12R1.3 C=CCC(CO)c1ccccc1 Amb32665506 [1,1,0,0,0,0|1,0,1]=4 2691 B12R1.3 CCC(CNC)c1ccccc1 Amb8841502 [1,1,0,0,0,0|1,0,0]=3 2692 B12R1.3 CCCC(C#N)c1ccccc1 Amb2720802 [1,1,0,0,0,0|2,0,0]=4 2693 B12R1.3 CCCC(C=O)c1ccccc1 Amb17594046 [1,1,0,0,0,0|1,0,1]=4 2694 B12R1.3 CCCC(CBr)c1ccccc1 Amb17247626 [1,1,0,0,0,0|2,0,0]=4 2695 B12R1.3 CCCC(CC)c1ccccc1 Amb9787575 [1,1,0,0,0,0|2,0,0]=4 2696 B12R1.3 CCCC(CCl)c1ccccc1 Amb17233968 [1,1,0,0,0,0|2,0,0]=4 2697 B12R1.3 CCCC(CN)c1ccccc1 Amb8950183 [1,1,0,0,0,0|2,0,0]=4 2698 B12R1.3 CCCC(CO)c1ccccc1 Amb17232487 [1,1,0,0,0,0|1,0,0]=3 2699 B12R1.3 CCC\C(=N\O)c1ccccc1 Amb27979178 [1,1,0,0,0,0|1,0,1]=4 2700 B12R1.3 CCNC(CO)c1ccccc1 Amb6739961 [1,1,0,0,0,0|2,0,0]=4 2701 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [1,1,0,0,0,0|2,0,0]=4 2702 B12R1.3 CNCC(OC)c1ccccc1 Amb17605856 [1,1,0,0,0,0|0,0,0]=2 2703 B12R1.3 COC(CCN)c1ccccc1 Amb17334641 [1,1,0,0,0,0|2,0,0]=4 2704 B12R1.3 COCC(CBr)c1ccccc1 Amb32688366 [1,1,0,0,0,0|2,0,0]=4 2705 B12R1.3 COCC(CCl)c1ccccc1 Amb32688364 [1,1,0,0,0,0|2,0,0]=4 2706 B12R1.3 COC\C(=N\O)c1ccccc1 Amb27770752 [1,1,0,0,0,0|1,0,1]=4 2707 B12R1.3 CSCC(C#N)c1ccccc1 Amb27828366 [1,1,0,0,0,0|2,0,0]=4 2708 B12R1.3 N#CCC(CO)c1ccccc1 Amb27172827 [1,1,0,0,0,0|2,0,0]=4 2709 B12R1.16 C#CCC(O)c1ccc(O)cc1 Amb18117920 [1,1,0,0,0,0|1,0,1]=4 2710 B12R1.16 C#CC[C@@H](O)c1ccc(Cl)cc1 Amb27770776 [1,1,0,0,0,0|1,0,1]=4 2711 B12R1.16 C=CCC(O)c1ccc(Br)cc1 Amb2685397 [1,1,0,0,0,0|1,0,1]=4 2712 B12R1.16 C=CCC(O)c1ccc(C)cc1 Amb18177785 [1,1,0,0,0,0|1,0,1]=4 2713 B12R1.16 C=CCC(O)c1ccc(Cl)cc1 Amb2686332 [1,1,0,0,0,0|1,0,1]=4 2714 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [1,1,0,0,0,0|1,0,1]=4 2715 B12R1.16 C=CCC(O)c1ccc(N)cc1 Amb27955305 [1,1,0,0,0,0|1,0,1]=4 2716 B12R1.16 C=CC[C@@H](O)c1ccc(Br)cc1 Amb28457059 [1,1,0,0,0,0|1,0,1]=4 2717 B12R1.16 C=CC[C@@H](O)c1ccc(C)cc1 Amb28142668 [1,1,0,0,0,0|1,0,1]=4 2718 B12R1.16 C=CC[C@@H](O)c1ccc(Cl)cc1 Amb27193055 [1,1,0,0,0,0|1,0,1]=4 2719 B12R1.16 C=CC[C@@H](O)c1ccc(F)cc1 Amb28255493 [1,1,0,0,0,0|1,0,1]=4 2720 B12R1.16 C=CC[C@H](O)c1ccc(C)cc1 Amb8392357 [1,1,0,0,0,0|1,0,1]=4 2721 B12R1.16 C=CC[C@H](O)c1ccc(F)cc1 Amb8392359 [1,1,0,0,0,0|1,0,1]=4 2722 B12R1.16 CC#CC(O)c1ccc(C)cc1 Amb28244315 [1,1,0,0,0,0|1,0,1]=4 2723 B12R1.16 CC(CNN)c1ccc(F)cc1 Amb33274185 [1,1,0,0,0,0|2,0,0]=4 2724 B12R1.16 CC(CNO)c1ccc(F)cc1 Amb33274590 [1,1,0,0,0,0|2,0,0]=4 2725 B12R1.16 CCCC(Br)c1ccc(Br)cc1 Amb27976372 [1,1,0,0,0,0|2,0,0]=4 2726 B12R1.16 CCCC(C)c1ccc(O)cc1 Amb17594074 [1,1,0,0,0,0|2,0,0]=4 2727 B12R1.16 CCCC(Cl)c1ccc(C)cc1 Amb17139051 [1,1,0,0,0,0|2,0,0]=4 2728 B12R1.16 CCCC(Cl)c1ccc(Cl)cc1 Amb17139906 [1,1,0,0,0,0|2,0,0]=4 2729 B12R1.16 CCCC(Cl)c1ccc(F)cc1 Amb17139162 [1,1,0,0,0,0|2,0,0]=4 2730 B12R1.16 CCCC(N)c1ccc(Br)cc1 Amb6255527 [1,1,0,0,0,0|2,0,0]=4 2731 B12R1.16 CCCC(N)c1ccc(C)cc1 Amb6256136 [1,1,0,0,0,0|2,0,0]=4 2732 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [1,1,0,0,0,0|2,0,0]=4 2733 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb9717984 [1,1,0,0,0,0|2,0,0]=4 2734 B12R1.16 CCCC(N)c1ccc(F)cc1 Amb9717477 [1,1,0,0,0,0|2,0,0]=4 2735 B12R1.16 CCCC(N)c1ccc(N)cc1 Amb27476459 [1,1,0,0,0,0|2,0,0]=4 2736 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [1,1,0,0,0,0|2,0,0]=4 2737 B12R1.16 CCCC(N)c1ccc(S)cc1 Amb27214632 [1,1,0,0,0,0|2,0,0]=4 2738 B12R1.16 CCCC(O)c1ccc(Br)cc1 Amb4011737 [1,1,0,0,0,0|1,0,0]=3 2739 B12R1.16 CCCC(O)c1ccc(C)cc1 Amb4035735 [1,1,0,0,0,0|1,0,0]=3 2740 B12R1.16 CCCC(O)c1ccc(Cl)cc1 Amb4035851 [1,1,0,0,0,0|1,0,0]=3 2741 B12R1.16 CCCC(O)c1ccc(F)cc1 Amb4036341 [1,1,0,0,0,0|1,0,0]=3 2742 B12R1.16 CCCC(O)c1ccc(N)cn1 Amb35622102 [1,1,0,0,0,0|2,0,0]=4 2743 B12R1.16 CCCC(O)c1ccc(O)cc1 Amb27226065 [1,1,0,0,0,0|1,0,0]=3 2744 B12R1.16 CCCC(S)c1ccc(Cl)cc1 Amb32788871 [1,1,0,0,0,0|1,1,0]=4 2745 B12R1.16 CCC[C@@H](N)c1ccc(C)cc1 Amb27259101 [1,1,0,0,0,0|2,0,0]=4 2746 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [1,1,0,0,0,0|2,0,0]=4 2747 B12R1.16 CCC[C@@H](O)c1ccc(Cl)cc1 Amb27834099 [1,1,0,0,0,0|1,0,0]=3 2748 B12R1.16 CCC[C@H](N)c1ccc(Br)cc1 Amb27871377 [1,1,0,0,0,0|2,0,0]=4 2749 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [1,1,0,0,0,0|2,0,0]=4 2750 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [1,1,0,0,0,0|2,0,0]=4 2751 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb27461355 [1,1,0,0,0,0|2,0,0]=4 2752 B12R1.16 CCC[C@H](O)c1ccc(Br)cc1 Amb27752379 [1,1,0,0,0,0|1,0,0]=3 2753 B12R1.16 CCC[C@H](O)c1ccc(C)cn1 Amb27959954 [1,1,0,0,0,0|2,0,0]=4 2754 B12R1.16 CCC[C@H](O)c1ccc(Cl)cn1 Amb28063198 [1,1,0,0,0,0|2,0,0]=4 2755 B12R1.16 CCC[C@H](O)c1ccc(F)cn1 Amb27452848 [1,1,0,0,0,0|2,0,0]=4 2756 B12R1.16 CNCC(=O)c1ccc(Br)cc1 Amb17248090 [1,1,0,0,0,0|0,0,2]=4 2757 B12R1.16 CNCC(=O)c1ccc(C)cc1 Amb17232427 [1,1,0,0,0,0|0,0,2]=4 2758 B12R1.16 CNCC(=O)c1ccc(Cl)cc1 Amb2777315 [1,1,0,0,0,0|0,0,2]=4 2759 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb17232631 [1,1,0,0,0,0|0,0,2]=4 2760 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [1,1,0,0,0,0|0,0,2]=4 2761 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [1,1,0,0,0,0|0,0,2]=4 2762 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb1075808 [1,1,0,0,0,0|0,0,2]=4 2763 B12R1.16 CNCC(=O)c1ccc(O)cc1 Amb6859390 [1,1,0,0,0,0|0,0,2]=4 2764 B12R1.16 CNCC(C)c1ccc(Br)cc1 Amb17248095 [1,1,0,0,0,0|1,0,0]=3 2765 B12R1.16 CNCC(C)c1ccc(C)cc1 Amb17232442 [1,1,0,0,0,0|1,0,0]=3 2766 B12R1.16 CNCC(C)c1ccc(Cl)cc1 Amb17234045 [1,1,0,0,0,0|1,0,0]=3 2767 B12R1.16 CNCC(C)c1ccc(F)cc1 Amb17232642 [1,1,0,0,0,0|1,0,0]=3 2768 B12R1.16 CNCC(C)c1ccc(F)cn1 Amb28204636 [1,1,0,0,0,0|2,0,0]=4 2769 B12R1.16 CNCC(Cl)c1ccc(F)cc1 Amb27974219 [1,1,0,0,0,0|1,0,0]=3 2770 B12R1.16 CNCC(O)c1ccc(Br)cc1 Amb17142608 [1,1,0,0,0,0|0,0,0]=2 2771 B12R1.16 CNCC(O)c1ccc(Br)cn1 Amb23586103 [1,1,0,0,0,0|1,0,0]=3 2772 B12R1.16 CNCC(O)c1ccc(Br)nc1 Amb33387715 [1,1,0,0,0,0|1,0,0]=3 2773 B12R1.16 CNCC(O)c1ccc(C)cc1 Amb5750897 [1,1,0,0,0,0|0,0,0]=2 2774 B12R1.16 CNCC(O)c1ccc(C)cn1 Amb24380693 [1,1,0,0,0,0|1,0,0]=3 2775 B12R1.16 CNCC(O)c1ccc(C)nc1 Amb26370715 [1,1,0,0,0,0|1,0,0]=3 2776 B12R1.16 CNCC(O)c1ccc(Cl)cc1 Amb5750903 [1,1,0,0,0,0|0,0,0]=2 2777 B12R1.16 CNCC(O)c1ccc(Cl)nc1 Amb33261541 [1,1,0,0,0,0|1,0,0]=3 2778 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb33547967 [1,1,0,0,0,0|0,0,0]=2 2779 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb6357663 [1,1,0,0,0,0|0,0,0]=2 2780 B12R1.16 CNCC(O)c1ccc(F)cn1 Amb26860789 [1,1,0,0,0,0|1,0,0]=3 2781 B12R1.16 CNCC(O)c1ccc(F)nc1 Amb33426570 [1,1,0,0,0,0|1,0,0]=3 2782 B12R1.16 CNCC(O)c1ccc(N)cc1 Amb19888327 [1,1,0,0,0,0|0,0,0]=2 2783 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22166782 [1,1,0,0,0,0|0,0,0]=2 2784 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb8629233 [1,1,0,0,0,0|0,0,0]=2 2785 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb9784888 [1,1,0,0,0,0|0,0,0]=2 2786 B12R1.16 CNCC(O)c1cnc(C)cn1 Amb33375101 [1,1,0,0,0,0|2,0,0]=4 2787 B12R1.16 CNCC(O)c1ncc(Br)cn1 Amb33334407 [1,1,0,0,0,0|2,0,0]=4 2788 B12R1.16 CNC[C@@H](O)c1ccc(Br)cc1 Amb27642048 [1,1,0,0,0,0|0,0,0]=2 2789 B12R1.16 CNC[C@@H](O)c1ccc(O)cc1 Amb25764531 [1,1,0,0,0,0|0,0,0]=2 2790 B12R1.16 COCC(F)c1ccc(N)cc1 Amb27615528 [1,1,0,0,0,0|2,0,0]=4 2791 B12R1.16 COCC(N)c1ccc(Br)cc1 Amb18070171 [1,1,0,0,0,0|2,0,0]=4 2792 B12R1.16 COCC(N)c1ccc(Cl)cc1 Amb18979034 [1,1,0,0,0,0|2,0,0]=4 2793 B12R1.16 COCC(N)c1ccc(F)cc1 Amb1139881 [1,1,0,0,0,0|2,0,0]=4 2794 B12R1.16 COCC(N)c1ccc(F)cc1 Amb19375549 [1,1,0,0,0,0|2,0,0]=4 2795 B12R1.16 COCC(N)c1ccc(N)cc1 Amb27874108 [1,1,0,0,0,0|2,0,0]=4 2796 B12R1.16 COCC(O)c1ccc(Br)cn1 Amb27409423 [1,1,0,0,0,0|2,0,0]=4 2797 B12R1.16 COCC(O)c1ccc(C)cn1 Amb27397271 [1,1,0,0,0,0|2,0,0]=4 2798 B12R1.16 COCC(O)c1ccc(Cl)nc1 Amb27596374 [1,1,0,0,0,0|2,0,0]=4 2799 B12R1.16 COCC(O)c1ccc(N)cc1 Amb18987938 [1,1,0,0,0,0|1,0,0]=3 2800 B12R1.16 COCC(O)c1ccc(N)cn1 Amb35622241 [1,1,0,0,0,0|2,0,0]=4 2801 B12R1.16 COC[C@@H](N)c1ccc(O)cc1 Amb27810795 [1,1,0,0,0,0|2,0,0]=4 2802 B12R1.16 COC[C@H](N)c1ccc(C)cc1 Amb27883359 [1,1,0,0,0,0|2,0,0]=4 2803 B12R1.16 COC[C@H](N)c1ccc(I)cc1 Amb27165996 [1,1,0,0,0,0|2,0,0]=4 2804 B12R1.16 COC[C@H](N)c1ccc(S)cc1 Amb27202609 [1,1,0,0,0,0|2,0,0]=4 2805 B12R1.16 CSCC(Cl)c1ccc(C)cc1 Amb25805205 [1,1,0,0,0,0|2,0,0]=4 2806 B12R1.16 CSCC(N)c1ccc(Br)cc1 Amb35591576 [1,1,0,0,0,0|2,0,0]=4 2807 B12R1.16 CSCC(N)c1ccc(F)cc1 Amb18300300 [1,1,0,0,0,0|2,0,0]=4 2808 B12R1.16 CSCC(O)c1ccc(Br)cc1 Amb35605452 [1,1,0,0,0,0|1,0,0]=3 2809 B12R1.16 CSCC(O)c1ccc(C)cc1 Amb19061295 [1,1,0,0,0,0|1,0,0]=3 2810 B12R1.16 CSCC(O)c1ccc(F)cc1 Amb19070006 [1,1,0,0,0,0|1,0,0]=3 2811 B12R1.16 CSCC(O)c1ccc(N)cc1 Amb18987939 [1,1,0,0,0,0|1,0,0]=3 2812 B12R1.16 C\C=C\C(O)c1ccc(F)cc1 Amb27615221 [1,1,0,0,0,0|1,0,1]=4 2813 B12R1.16 Cc1ccc(C(O)CC#N)cc1 Amb17232362 [1,1,0,0,0,0|2,0,0]=4 2814 B12R1.16 Cc1ccc(C(O)CCCl)cc1 Amb17194565 [1,1,0,0,0,0|2,0,0]=4 2815 B12R1.16 Cc1ccc(C(O)CCN)cc1 Amb17079132 [1,1,0,0,0,0|2,0,0]=4 2816 B12R1.16 Cc1ccc(C(O)CCO)cc1 Amb18563722 [1,1,0,0,0,0|2,0,0]=4 2817 B12R1.16 Cc1ccc(C(O)CNN)cc1 Amb17232610 [1,1,0,0,0,0|1,0,0]=3 2818 B12R1.16 Cc1ccc(C(O)CNO)cc1 Amb17334704 [1,1,0,0,0,0|1,0,0]=3 2819 B12R1.16 Cc1ccc(C(O)CON)cc1 Amb17334705 [1,1,0,0,0,0|2,0,0]=4 2820 B12R1.16 Cc1ccc([C@@H](O)CCCl)cc1 Amb28365650 [1,1,0,0,0,0|2,0,0]=4 2821 B12R1.16 Cc1ccc([C@@H](O)CCN)cc1 Amb25996449 [1,1,0,0,0,0|2,0,0]=4 2822 B12R1.16 Cc1ccc([C@H](O)CC#N)cc1 Amb27447803 [1,1,0,0,0,0|2,0,0]=4 2823 B12R1.16 Cc1ccc([C@H](O)CCN)cc1 Amb28123207 [1,1,0,0,0,0|2,0,0]=4 2824 B12R1.16 N#CCC(O)c1ccc(Br)cc1 Amb18134741 [1,1,0,0,0,0|2,0,0]=4 2825 B12R1.16 N#CCC(O)c1ccc(Cl)cc1 Amb597588 [1,1,0,0,0,0|2,0,0]=4 2826 B12R1.16 N#CCC(O)c1ccc(F)cc1 Amb17232518 [1,1,0,0,0,0|2,0,0]=4 2827 B12R1.16 N#CCC(O)c1ccc(I)cc1 Amb27658371 [1,1,0,0,0,0|2,0,0]=4 2828 B12R1.16 N#CCC(O)c1ccc(O)cc1 Amb33269075 [1,1,0,0,0,0|2,0,0]=4 2829 B12R1.16 N#CC[C@H](O)c1ccc(Cl)cc1 Amb27179708 [1,1,0,0,0,0|2,0,0]=4 2830 B12R1.16 NCCC(O)c1ccc(Br)cc1 Amb17079141 [1,1,0,0,0,0|2,0,0]=4 2831 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb17079140 [1,1,0,0,0,0|2,0,0]=4 2832 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [1,1,0,0,0,0|2,0,0]=4 2833 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb17079139 [1,1,0,0,0,0|2,0,0]=4 2834 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [1,1,0,0,0,0|2,0,0]=4 2835 B12R1.16 NCCC(O)c1ccc(I)cc1 Amb27187555 [1,1,0,0,0,0|2,0,0]=4 2836 B12R1.16 NCCC(O)c1ccc(O)cc1 Amb18251886 [1,1,0,0,0,0|2,0,0]=4 2837 B12R1.16 NCC[C@@H](O)c1ccc(Br)cc1 Amb33451500 [1,1,0,0,0,0|2,0,0]=4 2838 B12R1.16 NCC[C@@H](O)c1ccc(Cl)cc1 Amb28240508 [1,1,0,0,0,0|2,0,0]=4 2839 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [1,1,0,0,0,0|2,0,0]=4 2840 B12R1.16 NCC[C@@H](O)c1ccc(O)cc1 Amb33269541 [1,1,0,0,0,0|2,0,0]=4 2841 B12R1.16 NCC[C@H](O)c1ccc(Br)cc1 Amb33451906 [1,1,0,0,0,0|2,0,0]=4 2842 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [1,1,0,0,0,0|2,0,0]=4 2843 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [1,1,0,0,0,0|2,0,0]=4 2844 B12R1.16 NCC[C@H](O)c1ccc(O)cc1 Amb33269539 [1,1,0,0,0,0|2,0,0]=4 2845 B12R1.16 NNCC(O)c1ccc(Br)cc1 Amb17249280 [1,1,0,0,0,0|1,0,0]=3 2846 B12R1.16 NNCC(O)c1ccc(Cl)cc1 Amb17234362 [1,1,0,0,0,0|1,0,0]=3 2847 B12R1.16 NNCC(O)c1ccc(F)cc1 Amb17232743 [1,1,0,0,0,0|1,0,0]=3 2848 B12R1.16 NOCC(O)c1ccc(Br)cc1 Amb17345008 [1,1,0,0,0,0|2,0,0]=4 2849 B12R1.16 NOCC(O)c1ccc(Cl)cc1 Amb17335950 [1,1,0,0,0,0|2,0,0]=4 2850 B12R1.16 NOCC(O)c1ccc(F)cc1 Amb17334839 [1,1,0,0,0,0|2,0,0]=4 2851 B12R1.16 O=CCC(O)c1ccc(I)cc1 Amb27954814 [1,1,0,0,0,0|2,0,0]=4 2852 B12R1.16 O=CC[C@@H](O)c1ccc(Cl)cc1 Amb27770788 [1,1,0,0,0,0|2,0,0]=4 2853 B12R1.16 OC(CCBr)c1ccc(Br)cc1 Amb32676367 [1,1,0,0,0,0|2,0,0]=4 2854 B12R1.16 OC(CCBr)c1ccc(Cl)cc1 Amb32676368 [1,1,0,0,0,0|2,0,0]=4 2855 B12R1.16 OC(CCBr)c1ccc(F)cc1 Amb32676369 [1,1,0,0,0,0|2,0,0]=4 2856 B12R1.16 OC(CCCl)c1ccc(Br)cc1 Amb17196599 [1,1,0,0,0,0|2,0,0]=4 2857 B12R1.16 OC(CCCl)c1ccc(Cl)cc1 Amb17194897 [1,1,0,0,0,0|2,0,0]=4 2858 B12R1.16 OC(CCCl)c1ccc(F)cc1 Amb17194592 [1,1,0,0,0,0|2,0,0]=4 2859 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [1,1,0,0,0,0|2,0,0]=4 2860 B12R1.16 OC(CCS)c1ccc(F)cc1 Amb28066032 [1,1,0,0,0,0|2,0,0]=4 2861 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [1,1,0,0,0,0|2,0,0]=4 2862 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [1,1,0,0,0,0|2,0,0]=4 2863 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [1,1,0,0,0,0|2,0,0]=4 2864 B12R1.16 ONCC(O)c1ccc(Br)cc1 Amb17345007 [1,1,0,0,0,0|1,0,0]=3 2865 B12R1.16 ONCC(O)c1ccc(Cl)cc1 Amb17335949 [1,1,0,0,0,0|1,0,0]=3 2866 B12R1.16 ONCC(O)c1ccc(F)cc1 Amb17334838 [1,1,0,0,0,0|1,0,0]=3 2867 B12R1.16 ONCC(O)c1ccc(O)cc1 Amb17334758 [1,1,0,0,0,0|1,0,0]=3 2868 B12R1.16 O[C@@H](CCCl)c1ccc(Cl)cc1 Amb27178138 [1,1,0,0,0,0|2,0,0]=4 2869 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [1,1,0,0,0,0|2,0,0]=4 2870 B12R1.16 O[C@@H](CCI)c1ccc(F)cc1 Amb16233257 [1,1,0,0,0,0|2,0,0]=4 2871 B12R1.17 C#CCC(O)c1cccc(O)c1 Amb18117926 [1,1,0,0,0,0|1,0,1]=4 2872 B12R1.17 C#CC[C@@H](O)c1cccc(O)c1 Amb28126629 [1,1,0,0,0,0|1,0,1]=4 2873 B12R1.17 C=CCC(O)c1cccc(Br)c1 Amb2685396 [1,1,0,0,0,0|1,0,1]=4 2874 B12R1.17 C=CCC(O)c1cccc(C)c1 Amb18177788 [1,1,0,0,0,0|1,0,1]=4 2875 B12R1.17 C=CCC(O)c1cccc(Cl)c1 Amb2686331 [1,1,0,0,0,0|1,0,1]=4 2876 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [1,1,0,0,0,0|1,0,1]=4 2877 B12R1.17 C=CCC(O)c1cccc(I)c1 Amb27878433 [1,1,0,0,0,0|1,0,1]=4 2878 B12R1.17 C=CC[C@@H](O)c1cccc(C)c1 Amb27244794 [1,1,0,0,0,0|1,0,1]=4 2879 B12R1.17 C=CC[C@@H](O)c1cccc(Cl)c1 Amb27954584 [1,1,0,0,0,0|1,0,1]=4 2880 B12R1.17 C=CC[C@H](O)c1cccc(Br)c1 Amb28399563 [1,1,0,0,0,0|1,0,1]=4 2881 B12R1.17 CC#CC(O)c1cccc(Br)c1 Amb27974839 [1,1,0,0,0,0|1,0,1]=4 2882 B12R1.17 CC#CC(O)c1cccc(Cl)c1 Amb27249762 [1,1,0,0,0,0|1,0,1]=4 2883 B12R1.17 CC#CC(O)c1cccc(F)c1 Amb27261472 [1,1,0,0,0,0|1,0,1]=4 2884 B12R1.17 CCCC(C)c1cccc(O)c1 Amb27229592 [1,1,0,0,0,0|2,0,0]=4 2885 B12R1.17 CCCC(Cl)c1cccc(Br)c1 Amb29880680 [1,1,0,0,0,0|2,0,0]=4 2886 B12R1.17 CCCC(Cl)c1cccc(Cl)c1 Amb27656221 [1,1,0,0,0,0|2,0,0]=4 2887 B12R1.17 CCCC(N)c1cccc(Br)c1 Amb28240805 [1,1,0,0,0,0|2,0,0]=4 2888 B12R1.17 CCCC(N)c1cccc(C)c1 Amb17232449 [1,1,0,0,0,0|2,0,0]=4 2889 B12R1.17 CCCC(N)c1cccc(C)c1 Amb32662396 [1,1,0,0,0,0|2,0,0]=4 2890 B12R1.17 CCCC(N)c1cccc(Cl)c1 Amb17234050 [1,1,0,0,0,0|2,0,0]=4 2891 B12R1.17 CCCC(N)c1cccc(F)c1 Amb17232649 [1,1,0,0,0,0|2,0,0]=4 2892 B12R1.17 CCCC(N)c1cccc(F)c1 Amb30982493 [1,1,0,0,0,0|2,0,0]=4 2893 B12R1.17 CCCC(N)c1cccc(I)c1 Amb27209580 [1,1,0,0,0,0|2,0,0]=4 2894 B12R1.17 CCCC(N)c1cccc(N)c1 Amb25891904 [1,1,0,0,0,0|2,0,0]=4 2895 B12R1.17 CCCC(O)c1cc(C)ccn1 Amb24425208 [1,1,0,0,0,0|2,0,0]=4 2896 B12R1.17 CCCC(O)c1ccc[n+]([O-])c1 Amb4010118 [1,1,0,0,0,0|2,0,0]=4 2897 B12R1.17 CCCC(O)c1cccc(Br)c1 Amb17248424 [1,1,0,0,0,0|1,0,0]=3 2898 B12R1.17 CCCC(O)c1cccc(C)c1 Amb17232484 [1,1,0,0,0,0|1,0,0]=3 2899 B12R1.17 CCCC(O)c1cccc(Cl)c1 Amb17234155 [1,1,0,0,0,0|1,0,0]=3 2900 B12R1.17 CCCC(O)c1cccc(F)c1 Amb17232673 [1,1,0,0,0,0|1,0,0]=3 2901 B12R1.17 CCCC(O)c1cccc(N)n1 Amb35743352 [1,1,0,0,0,0|2,0,0]=4 2902 B12R1.17 CCCC(O)c1cncc(Br)c1 Amb27396365 [1,1,0,0,0,0|2,0,0]=4 2903 B12R1.17 CCC[C@@H](N)c1cccc(I)c1 Amb27814307 [1,1,0,0,0,0|2,0,0]=4 2904 B12R1.17 CCC[C@@H](O)c1cc(C)ccn1 Amb25048748 [1,1,0,0,0,0|2,0,0]=4 2905 B12R1.17 CCC[C@@H](O)c1cccc(Br)c1 Amb27176217 [1,1,0,0,0,0|1,0,0]=3 2906 B12R1.17 CCC[C@@H](O)c1cccc(C)n1 Amb27614634 [1,1,0,0,0,0|2,0,0]=4 2907 B12R1.17 CCC[C@@H](O)c1cccc(F)c1 Amb28138837 [1,1,0,0,0,0|1,0,0]=3 2908 B12R1.17 CCC[C@H](N)c1cccc(C)c1 Amb28313719 [1,1,0,0,0,0|2,0,0]=4 2909 B12R1.17 CCC[C@H](N)c1cccc(Cl)c1 Amb28346844 [1,1,0,0,0,0|2,0,0]=4 2910 B12R1.17 CCC[C@H](N)c1cccc(F)c1 Amb27626030 [1,1,0,0,0,0|2,0,0]=4 2911 B12R1.17 CCC[C@H](N)c1cccc(N)c1 Amb28255487 [1,1,0,0,0,0|2,0,0]=4 2912 B12R1.17 CCC[C@H](O)c1cc(C)ccn1 Amb25848810 [1,1,0,0,0,0|2,0,0]=4 2913 B12R1.17 CCC[C@H](O)c1cccc(Cl)c1 Amb27826760 [1,1,0,0,0,0|1,0,0]=3 2914 B12R1.17 CNCC(=O)c1cccc(Br)c1 Amb17315041 [1,1,0,0,0,0|0,0,2]=4 2915 B12R1.17 CNCC(=O)c1cccc(C)c1 Amb18862586 [1,1,0,0,0,0|0,0,2]=4 2916 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [1,1,0,0,0,0|0,0,2]=4 2917 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [1,1,0,0,0,0|0,0,2]=4 2918 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [1,1,0,0,0,0|0,0,2]=4 2919 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb16231895 [1,1,0,0,0,0|0,0,2]=4 2920 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb17619313 [1,1,0,0,0,0|0,0,2]=4 2921 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [1,1,0,0,0,0|0,0,2]=4 2922 B12R1.17 CNCC(C)c1cccc(Br)c1 Amb28454540 [1,1,0,0,0,0|1,0,0]=3 2923 B12R1.17 CNCC(C)c1cccc(Cl)c1 Amb27836338 [1,1,0,0,0,0|1,0,0]=3 2924 B12R1.17 CNCC(C)c1cccc(F)c1 Amb27770263 [1,1,0,0,0,0|1,0,0]=3 2925 B12R1.17 CNCC(C)c1cccc(N)c1 Amb33071780 [1,1,0,0,0,0|1,0,0]=3 2926 B12R1.17 CNCC(Cl)c1cccc(O)c1 Amb27983837 [1,1,0,0,0,0|1,0,0]=3 2927 B12R1.17 CNCC(N)c1cccc(C)c1 Amb33229799 [1,1,0,0,0,0|1,0,0]=3 2928 B12R1.17 CNCC(N)c1cccc(O)c1 Amb27223878 [1,1,0,0,0,0|1,0,0]=3 2929 B12R1.17 CNCC(O)c1cc(C)ccn1 Amb33318415 [1,1,0,0,0,0|1,0,0]=3 2930 B12R1.17 CNCC(O)c1cc(F)ccn1 Amb33415290 [1,1,0,0,0,0|1,0,0]=3 2931 B12R1.17 CNCC(O)c1cccc(Br)c1 Amb17142607 [1,1,0,0,0,0|0,0,0]=2 2932 B12R1.17 CNCC(O)c1cccc(Br)n1 Amb33432802 [1,1,0,0,0,0|1,0,0]=3 2933 B12R1.17 CNCC(O)c1cccc(C)c1 Amb5750896 [1,1,0,0,0,0|0,0,0]=2 2934 B12R1.17 CNCC(O)c1cccc(C)n1 Amb27209524 [1,1,0,0,0,0|1,0,0]=3 2935 B12R1.17 CNCC(O)c1cccc(Cl)c1 Amb5750902 [1,1,0,0,0,0|0,0,0]=2 2936 B12R1.17 CNCC(O)c1cccc(Cl)n1 Amb33223281 [1,1,0,0,0,0|1,0,0]=3 2937 B12R1.17 CNCC(O)c1cccc(F)c1 Amb18289718 [1,1,0,0,0,0|0,0,0]=2 2938 B12R1.17 CNCC(O)c1cccc(N)c1 Amb17594135 [1,1,0,0,0,0|0,0,0]=2 2939 B12R1.17 CNCC(O)c1cccc(O)c1 Amb532942 [1,1,0,0,0,0|0,0,0]=2 2940 B12R1.17 CNCC(O)c1ccnc(C)c1 Amb33268228 [1,1,0,0,0,0|1,0,0]=3 2941 B12R1.17 CNCC(O)c1cncc(Br)c1 Amb23586082 [1,1,0,0,0,0|1,0,0]=3 2942 B12R1.17 CNCC(O)c1cncc(C)c1 Amb26351556 [1,1,0,0,0,0|1,0,0]=3 2943 B12R1.17 CNCC(O)c1cncc(F)c1 Amb25787544 [1,1,0,0,0,0|1,0,0]=3 2944 B12R1.17 CNC[C@@H](O)c1cccc(F)c1 Amb27232737 [1,1,0,0,0,0|0,0,0]=2 2945 B12R1.17 CNC[C@@H](O)c1cccc(O)c1 Amb16231685 [1,1,0,0,0,0|0,0,0]=2 2946 B12R1.17 CNC[C@@H](O)c1cccc(O)c1 Amb19133645 [1,1,0,0,0,0|0,0,0]=2 2947 B12R1.17 CNC[C@H](O)c1cccc(F)c1 Amb28118835 [1,1,0,0,0,0|0,0,0]=2 2948 B12R1.17 CNC[C@H](O)c1cccc(O)c1 Amb22168059 [1,1,0,0,0,0|0,0,0]=2 2949 B12R1.17 CNC[C@H](O)c1cccc(O)c1 Amb3940531 [1,1,0,0,0,0|0,0,0]=2 2950 B12R1.17 CNC[C@H](O)c1cccc(O)c1 Amb8514350 [1,1,0,0,0,0|0,0,0]=2 2951 B12R1.17 COCC(N)c1cccc(Br)c1 Amb26539591 [1,1,0,0,0,0|2,0,0]=4 2952 B12R1.17 COCC(N)c1cccc(Cl)c1 Amb18983032 [1,1,0,0,0,0|2,0,0]=4 2953 B12R1.17 COCC(O)c1cccc(Br)c1 Amb28460964 [1,1,0,0,0,0|1,0,0]=3 2954 B12R1.17 COCC(O)c1cccc(C)c1 Amb18792769 [1,1,0,0,0,0|1,0,0]=3 2955 B12R1.17 COCC(O)c1cccc(C)n1 Amb27969909 [1,1,0,0,0,0|2,0,0]=4 2956 B12R1.17 COCC(O)c1cccc(I)c1 Amb27840725 [1,1,0,0,0,0|1,0,0]=3 2957 B12R1.17 COCC(O)c1cccc(N)c1 Amb13952267 [1,1,0,0,0,0|1,0,0]=3 2958 B12R1.17 COCC(O)c1cccc(N)n1 Amb35743463 [1,1,0,0,0,0|2,0,0]=4 2959 B12R1.17 COCC(O)c1ccnc(Cl)c1 Amb27173945 [1,1,0,0,0,0|2,0,0]=4 2960 B12R1.17 COCC(O)c1cncc(Br)c1 Amb27389209 [1,1,0,0,0,0|2,0,0]=4 2961 B12R1.17 COCC(O)c1cncc(F)c1 Amb18180316 [1,1,0,0,0,0|2,0,0]=4 2962 B12R1.17 COC[C@@H](N)c1cccc(C)c1 Amb28140107 [1,1,0,0,0,0|2,0,0]=4 2963 B12R1.17 COC[C@@H](N)c1cccc(I)c1 Amb27200280 [1,1,0,0,0,0|2,0,0]=4 2964 B12R1.17 COC[C@@H](N)c1cccc(S)c1 Amb27173664 [1,1,0,0,0,0|2,0,0]=4 2965 B12R1.17 COC[C@H](N)c1cccc(Br)c1 Amb27614746 [1,1,0,0,0,0|2,0,0]=4 2966 B12R1.17 COC[C@H](N)c1cccc(F)c1 Amb28314321 [1,1,0,0,0,0|2,0,0]=4 2967 B12R1.17 COC[C@H](N)c1cccc(O)c1 Amb27950844 [1,1,0,0,0,0|2,0,0]=4 2968 B12R1.17 CSCC(N)c1cccc(Br)c1 Amb35626225 [1,1,0,0,0,0|2,0,0]=4 2969 B12R1.17 CSCC(O)c1cccc(Br)c1 Amb35728583 [1,1,0,0,0,0|1,0,0]=3 2970 B12R1.17 CSCC(O)c1cccc(C)c1 Amb19061294 [1,1,0,0,0,0|1,0,0]=3 2971 B12R1.17 CSCC(O)c1cccc(Cl)c1 Amb28120471 [1,1,0,0,0,0|1,0,0]=3 2972 B12R1.17 C[NH2+]CC(O)c1cccc(O)c1 Amb4282886 [1,1,0,0,0,0|0,0,1]=3 2973 B12R1.17 Cc1cccc(C(O)CC#N)c1 Amb1111387 [1,1,0,0,0,0|2,0,0]=4 2974 B12R1.17 Cc1cccc(C(O)CCN)c1 Amb17232540 [1,1,0,0,0,0|2,0,0]=4 2975 B12R1.17 Cc1cccc(C(O)CCO)c1 Amb27404138 [1,1,0,0,0,0|2,0,0]=4 2976 B12R1.17 Cc1cccc(C(O)CNN)c1 Amb17232609 [1,1,0,0,0,0|1,0,0]=3 2977 B12R1.17 Cc1cccc(C(O)CNO)c1 Amb17334703 [1,1,0,0,0,0|1,0,0]=3 2978 B12R1.17 Cc1cccc([C@@H](O)CCN)c1 Amb33203928 [1,1,0,0,0,0|2,0,0]=4 2979 B12R1.17 Cc1cccc([C@H](O)CC#N)c1 Amb27587419 [1,1,0,0,0,0|2,0,0]=4 2980 B12R1.17 Cc1cccc([C@H](O)CCN)c1 Amb33203929 [1,1,0,0,0,0|2,0,0]=4 2981 B12R1.17 N#CCC(O)c1cccc(Br)c1 Amb25139301 [1,1,0,0,0,0|2,0,0]=4 2982 B12R1.17 N#CCC(O)c1cccc(Cl)c1 Amb17233865 [1,1,0,0,0,0|2,0,0]=4 2983 B12R1.17 N#CCC(O)c1cccc(F)c1 Amb17232517 [1,1,0,0,0,0|2,0,0]=4 2984 B12R1.17 N#CCC(O)c1cccc(I)c1 Amb27187554 [1,1,0,0,0,0|2,0,0]=4 2985 B12R1.17 N#CCC(O)c1cccc(N)c1 Amb27251610 [1,1,0,0,0,0|2,0,0]=4 2986 B12R1.17 N#CCC(O)c1cccc(O)c1 Amb25674244 [1,1,0,0,0,0|2,0,0]=4 2987 B12R1.17 N#CC[C@H](O)c1cccc(O)c1 Amb27599471 [1,1,0,0,0,0|2,0,0]=4 2988 B12R1.17 NCCC(O)c1cccc(Br)c1 Amb18121493 [1,1,0,0,0,0|2,0,0]=4 2989 B12R1.17 NCCC(O)c1cccc(Cl)c1 Amb17234260 [1,1,0,0,0,0|2,0,0]=4 2990 B12R1.17 NCCC(O)c1cccc(F)c1 Amb17232697 [1,1,0,0,0,0|2,0,0]=4 2991 B12R1.17 NCCC(O)c1cccc(I)c1 Amb24493265 [1,1,0,0,0,0|2,0,0]=4 2992 B12R1.17 NCCC(O)c1cccc(O)c1 Amb18251885 [1,1,0,0,0,0|2,0,0]=4 2993 B12R1.17 NCC[C@@H](O)c1cccc(Br)c1 Amb33451583 [1,1,0,0,0,0|2,0,0]=4 2994 B12R1.17 NCC[C@@H](O)c1cccc(Cl)c1 Amb25105024 [1,1,0,0,0,0|2,0,0]=4 2995 B12R1.17 NCC[C@@H](O)c1cccc(F)c1 Amb33316044 [1,1,0,0,0,0|2,0,0]=4 2996 B12R1.17 NCC[C@@H](O)c1cccc(O)c1 Amb33225571 [1,1,0,0,0,0|2,0,0]=4 2997 B12R1.17 NCC[C@H](O)c1cccc(Br)c1 Amb33451586 [1,1,0,0,0,0|2,0,0]=4 2998 B12R1.17 NCC[C@H](O)c1cccc(Cl)c1 Amb28323010 [1,1,0,0,0,0|2,0,0]=4 2999 B12R1.17 NCC[C@H](O)c1cccc(F)c1 Amb33316043 [1,1,0,0,0,0|2,0,0]=4 3000 B12R1.17 NCC[C@H](O)c1cccc(O)c1 Amb33312067 [1,1,0,0,0,0|2,0,0]=4 3001 B12R1.17 NNCC(O)c1cccc(Br)c1 Amb17249279 [1,1,0,0,0,0|1,0,0]=3 3002 B12R1.17 NNCC(O)c1cccc(Cl)c1 Amb17234361 [1,1,0,0,0,0|1,0,0]=3 3003 B12R1.17 NNCC(O)c1cccc(F)c1 Amb18563928 [1,1,0,0,0,0|1,0,0]=3 3004 B12R1.17 O=CCC(O)c1cccc(I)c1 Amb28066980 [1,1,0,0,0,0|2,0,0]=4 3005 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [1,1,0,0,0,0|2,0,0]=4 3006 B12R1.17 OCC[C@H](O)c1cccc(Cl)c1 Amb26561233 [1,1,0,0,0,0|2,0,0]=4 3007 B12R1.17 ONCC(O)c1cccc(Br)c1 Amb17345006 [1,1,0,0,0,0|1,0,0]=3 3008 B12R1.17 ONCC(O)c1cccc(Cl)c1 Amb17335948 [1,1,0,0,0,0|1,0,0]=3 3009 B12R1.17 ONCC(O)c1cccc(O)c1 Amb17334759 [1,1,0,0,0,0|1,0,0]=3 3010 B12R1.17 O[C@@H](CCCl)c1cccc(F)c1 Amb28365651 [1,1,0,0,0,0|2,0,0]=4 3011 B12R1.17 O[C@H](CCCl)c1cccc(F)c1 Amb28121134 [1,1,0,0,0,0|2,0,0]=4 3012 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [1,1,0,0,0,0|1,0,1]=4 3013 B12R1.30 C=C=CCC(O)c1ccccc1 Amb27484788 [1,1,0,0,0,0|1,0,1]=4 3014 B12R1.30 C=C=CC[C@@H](O)c1ccccc1 Amb27977896 [1,1,0,0,0,0|1,0,1]=4 3015 B12R1.30 C=CCCC(O)c1ccccc1 Amb18800658 [1,1,0,0,0,0|1,0,1]=4 3016 B12R1.30 CC#CCC(O)c1ccccn1 Amb18797972 [1,1,0,0,0,0|2,0,0]=4 3017 B12R1.30 CC(CCCBr)c1ccccc1 Amb33082370 [1,1,0,0,0,0|2,0,0]=4 3018 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [1,1,0,0,0,0|2,0,0]=4 3019 B12R1.30 CC(CCCO)c1ccccc1 Amb33213887 [1,1,0,0,0,0|2,0,0]=4 3020 B12R1.30 CC(CCCS)c1ccccc1 Amb33082130 [1,1,0,0,0,0|2,0,0]=4 3021 B12R1.30 CC(CNC=O)c1ccccc1 Amb27776616 [1,1,0,0,0,0|1,0,1]=4 3022 B12R1.30 CCCCC(N)c1ccccc1 Amb9717704 [1,1,0,0,0,0|2,0,0]=4 3023 B12R1.30 CCCCC(O)c1ccccc1 Amb4034459 [1,1,0,0,0,0|1,0,0]=3 3024 B12R1.30 CCCCC(S)c1ccccc1 Amb32788793 [1,1,0,0,0,0|1,1,0]=4 3025 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb28555742 [1,1,0,0,0,0|2,0,0]=4 3026 B12R1.30 CCCC[C@@H](N)c1ccccc1 Amb33276169 [1,1,0,0,0,0|2,0,0]=4 3027 B12R1.30 CCCC[C@@H](O)c1ccccc1 Amb30627576 [1,1,0,0,0,0|1,0,0]=3 3028 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb28555741 [1,1,0,0,0,0|2,0,0]=4 3029 B12R1.30 CCCC[C@H](N)c1ccccc1 Amb33276167 [1,1,0,0,0,0|2,0,0]=4 3030 B12R1.30 CCCC[C@H](O)c1ccccc1 Amb28555740 [1,1,0,0,0,0|1,0,0]=3 3031 B12R1.30 CCCNC(C)c1ccccc1 Amb6335367 [1,1,0,0,0,0|2,0,0]=4 3032 B12R1.30 CCCNC(C)c1ccccc1 Amb9726952 [1,1,0,0,0,0|2,0,0]=4 3033 B12R1.30 CCNCC(C)c1ccccc1 Amb6729198 [1,1,0,0,0,0|1,0,0]=3 3034 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [1,1,0,0,0,0|1,0,0]=3 3035 B12R1.30 CCNCC(O)c1ccccc1 Amb9247502 [1,1,0,0,0,0|0,0,0]=2 3036 B12R1.30 CCNCC(O)c1ccccn1 Amb17138608 [1,1,0,0,0,0|1,0,0]=3 3037 B12R1.30 CCNCC(O)c1cccnc1 Amb17138609 [1,1,0,0,0,0|1,0,0]=3 3038 B12R1.30 CCNCC(O)c1ccncc1 Amb17138610 [1,1,0,0,0,0|1,0,0]=3 3039 B12R1.30 CCOCC(N)c1ccccc1 Amb1125200 [1,1,0,0,0,0|2,0,0]=4 3040 B12R1.30 CCOC[C@@H](N)c1ccccc1 Amb17061646 [1,1,0,0,0,0|2,0,0]=4 3041 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747248 [1,1,0,0,0,0|2,0,0]=4 3042 B12R1.30 CCOC[C@H](N)c1ccccc1 Amb35747836 [1,1,0,0,0,0|2,0,0]=4 3043 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [1,1,0,0,0,0|1,0,1]=4 3044 B12R1.30 CC\C=C\[C@@H](O)c1ccccc1 Amb27598606 [1,1,0,0,0,0|1,0,1]=4 3045 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [1,1,0,0,0,0|0,0,2]=4 3046 B12R1.30 CNCCC(=O)c1ccccc1 Amb8390832 [1,1,0,0,0,0|0,0,2]=4 3047 B12R1.30 CNCCC(C)c1ccccc1 Amb5739286 [1,1,0,0,0,0|1,0,0]=3 3048 B12R1.30 CNCCC(Cl)c1ccccc1 Amb8629327 [1,1,0,0,0,0|1,0,0]=3 3049 B12R1.30 CNCCC(O)c1ccccc1 Amb3939363 [1,1,0,0,0,0|0,0,0]=2 3050 B12R1.30 CNCCN(C)c1ccccc1 Amb6715077 [1,1,0,0,0,0|2,0,0]=4 3051 B12R1.30 CNCNC(=O)c1ccccc1 Amb27402677 [1,1,0,0,0,0|0,0,2]=4 3052 B12R1.30 CNC\C=C(/C)c1ccccc1 Amb23555664 [1,1,0,0,0,0|1,0,1]=4 3053 B12R1.30 CNC\C=C(\C)c1ccccc1 Amb27963918 [1,1,0,0,0,0|1,0,1]=4 3054 B12R1.30 COCCC(Cl)c1ccccc1 Amb32686938 [1,1,0,0,0,0|2,0,0]=4 3055 B12R1.30 COCCC(N)c1ccccc1 Amb34912740 [1,1,0,0,0,0|2,0,0]=4 3056 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [1,1,0,0,0,0|1,0,0]=3 3057 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33620965 [1,1,0,0,0,0|2,0,0]=4 3058 B12R1.30 COCC[C@@H](N)c1ccccc1 Amb33738637 [1,1,0,0,0,0|2,0,0]=4 3059 B12R1.30 CO\N=C\[C@H](O)c1ccccc1 Amb27766548 [1,1,0,0,0,0|0,0,2]=4 3060 B12R1.30 C[NH2+]CCC(O)c1ccccc1 Amb33513043 [1,1,0,0,0,0|0,0,1]=3 3061 B12R1.30 C\C=C/CC(N)c1ccccc1 Amb28140782 [1,1,0,0,0,0|2,0,0]=4 3062 B12R1.30 C\C=C\CC(C)c1ccccc1 Amb26891020 [1,1,0,0,0,0|2,0,0]=4 3063 B12R1.30 C\C=C\C[C@H](O)c1ccccc1 Amb28241948 [1,1,0,0,0,0|1,0,0]=3 3064 B12R1.30 C\C=N\C[C@H](O)c1ccccc1 Amb27472643 [1,1,0,0,0,0|0,0,1]=3 3065 B12R1.30 N#CCCC(O)c1ccccc1 Amb17232364 [1,1,0,0,0,0|1,0,1]=4 3066 B12R1.30 N#CNCC(O)c1ccccc1 Amb18800628 [1,1,0,0,0,0|0,0,1]=3 3067 B12R1.30 NC(CCCO)c1ccccc1 Amb9783958 [1,1,0,0,0,0|2,0,0]=4 3068 B12R1.30 NCC#CC(O)c1ccccc1 Amb27484208 [1,1,0,0,0,0|1,0,1]=4 3069 B12R1.30 NCCCC(O)c1ccccc1 Amb17079154 [1,1,0,0,0,0|1,0,0]=3 3070 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [1,1,0,0,0,0|1,0,0]=3 3071 B12R1.30 NCCCC(O)c1ccccn1 Amb18563728 [1,1,0,0,0,0|2,0,0]=4 3072 B12R1.30 NCCCC(O)c1cccnc1 Amb17232606 [1,1,0,0,0,0|2,0,0]=4 3073 B12R1.30 NCCCC(O)c1ccncc1 Amb18563731 [1,1,0,0,0,0|2,0,0]=4 3074 B12R1.30 NC\C=C\C(O)c1ccccc1 Amb26551917 [1,1,0,0,0,0|1,0,1]=4 3075 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [1,1,0,0,0,0|2,0,0]=4 3076 B12R1.30 O=CNCC(O)c1ccccc1 Amb18792635 [1,1,0,0,0,0|0,0,1]=3 3077 B12R1.30 OC(CCCCl)c1ccccc1 Amb17194564 [1,1,0,0,0,0|1,0,0]=3 3078 B12R1.30 OC(C\C=C\Cl)c1ccccc1 Amb27419899 [1,1,0,0,0,0|1,0,1]=4 3079 B12R1.30 OC(C\C=C\F)c1ccccc1 Amb27766637 [1,1,0,0,0,0|1,0,1]=4 3080 B12R1.30 OCC#CC(O)c1ccccc1 Amb776273 [1,1,0,0,0,0|1,0,1]=4 3081 B12R1.30 OCCCC(O)c1ccccc1 Amb17334675 [1,1,0,0,0,0|1,0,0]=3 3082 B12R1.30 OCCCC(O)c1cccnc1 Amb17619700 [1,1,0,0,0,0|2,0,0]=4 3083 B12R1.30 OC\C=C/C(O)c1ccccc1 Amb30621777 [1,1,0,0,0,0|1,0,1]=4 3084 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [1,1,0,0,0,0|1,0,1]=4 3085 B12R1.30 OC\C=C\[C@H](O)c1ccccc1 Amb28244279 [1,1,0,0,0,0|1,0,1]=4 3086 B12R1.30 [N-]=[N+]=NCC(O)c1ccccc1 Amb18792465 [1,1,0,0,0,0|1,0,1]=4 3087 B12R1.30 [N-]=[N+]=NC[C@@H](O)c1ccccc1 Amb27873258 [1,1,0,0,0,0|1,0,1]=4 3088 B12R1.30 [N-]=[N+]=NC[C@H](O)c1ccccc1 Amb25102649 [1,1,0,0,0,0|1,0,1]=4 3089 B12R1.39 C#CCC(C)(O)c1ccccc1 Amb25987029 [1,1,0,0,0,0|1,0,1]=4 3090 B12R1.39 C=CCC(C)(O)c1ccccc1 Amb4035093 [1,1,0,0,0,0|1,0,1]=4 3091 B12R1.39 CC(C)(CNN)c1ccccc1 Amb6250005 [1,1,0,0,0,0|2,0,0]=4 3092 B12R1.39 CC(C)(CNO)c1ccccc1 Amb33475500 [1,1,0,0,0,0|2,0,0]=4 3093 B12R1.39 CC(O)(CC#N)c1ccccc1 Amb4405874 [1,1,0,0,0,0|2,0,0]=4 3094 B12R1.39 CC(O)(CCN)c1ccccc1 Amb17594116 [1,1,0,0,0,0|2,0,0]=4 3095 B12R1.39 CC(O)(CNN)c1ccccc1 Amb17232616 [1,1,0,0,0,0|1,0,0]=3 3096 B12R1.39 CCCC(C)(C)c1ccccc1 Amb27231101 [1,1,0,0,0,0|2,0,0]=4 3097 B12R1.39 CCCC(C)(N)c1ccccc1 Amb9676775 [1,1,0,0,0,0|2,0,0]=4 3098 B12R1.39 CCCC(C)(O)c1ccccc1 Amb4019246 [1,1,0,0,0,0|1,0,0]=3 3099 B12R1.39 CCCC(C)(O)c1ccccn1 Amb28455870 [1,1,0,0,0,0|2,0,0]=4 3100 B12R1.39 CCCC(C)(O)c1cccnc1 Amb27979710 [1,1,0,0,0,0|2,0,0]=4 3101 B12R1.39 CNCC(C)(C)c1ccccc1 Amb9214715 [1,1,0,0,0,0|1,0,0]=3 3102 B12R1.39 CNCC(C)(C)c1ccccn1 Amb27396065 [1,1,0,0,0,0|2,0,0]=4 3103 B12R1.39 CNCC(C)(C)c1cccnc1 Amb26365951 [1,1,0,0,0,0|2,0,0]=4 3104 B12R1.39 CNCC(C)(C)c1ccncc1 Amb26539559 [1,1,0,0,0,0|2,0,0]=4 3105 B12R1.39 CNCC(C)(O)c1ccccc1 Amb5751082 [1,1,0,0,0,0|0,0,0]=2 3106 B12R1.39 CNCC(C)(O)c1ccccn1 Amb18064992 [1,1,0,0,0,0|1,0,0]=3 3107 B12R1.39 CNCC(C)(O)c1cccnc1 Amb18062824 [1,1,0,0,0,0|1,0,0]=3 3108 B12R1.39 CNCC(C)(O)c1ccncc1 Amb18562953 [1,1,0,0,0,0|1,0,0]=3 3109 B12R1.39 CNCC(F)(F)c1ccccc1 Amb27251609 [1,1,0,0,0,0|1,0,0]=3 3110 B12R1.39 CNCP(=O)(O)c1ccccc1 Amb27778480 [1,1,0,0,0,0|1,0,0]=3 3111 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [1,1,0,0,0,0|2,0,0]=4 3112 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [1,1,0,0,0,0|1,0,0]=3 3113 B12R1.39 COCC(C)(O)c1ccccn1 Amb22897034 [1,1,0,0,0,0|2,0,0]=4 3114 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [1,1,0,0,0,0|1,0,0]=3 3115 B12R1.39 C[C@@](O)(CCO)c1ccccc1 Amb27179357 [1,1,0,0,0,0|2,0,0]=4 3116 B12R1.39 C[C@](O)(CC=O)c1ccccc1 Amb27855035 [1,1,0,0,0,0|2,0,0]=4 3117 B12R1.39 C[NH2+]CC(C)(O)c1ccccc1 Amb4282803 [1,1,0,0,0,0|0,0,1]=3 3118 B12R1.39 NNCC(F)(F)c1ccccc1 Amb25692683 [1,1,0,0,0,0|2,0,0]=4 3119 B12R1.39 N[C@@](O)(CCO)c1ccccc1 Amb28064120 [1,1,0,0,0,0|2,0,0]=4 3120 B12R1.39 ONCC(F)(F)c1ccccc1 Amb33081926 [1,1,0,0,0,0|2,0,0]=4 3121 B12R1.107 C=C(C)C[C@@H](O)c1ccccc1 Amb27396487 [1,1,0,0,0,0|1,0,0]=3 3122 B12R1.107 C=C(C)C[C@@H](O)c1ccccn1 Amb27652999 [1,1,0,0,0,0|2,0,0]=4 3123 B12R1.107 C=C(Cl)C[C@@H](O)c1ccccc1 Amb27834223 [1,1,0,0,0,0|1,0,1]=4 3124 B12R1.107 CC(=O)CC(C)c1ccccc1 Amb5740067 [1,1,0,0,0,0|2,0,0]=4 3125 B12R1.107 CC(=O)CC(O)c1ccccc1 Amb28324943 [1,1,0,0,0,0|1,0,0]=3 3126 B12R1.107 CC(=O)CC(O)c1ccccn1 Amb1016907 [1,1,0,0,0,0|2,0,0]=4 3127 B12R1.107 CC(=O)CC(O)c1cccnc1 Amb28399354 [1,1,0,0,0,0|2,0,0]=4 3128 B12R1.107 CC(=O)C[C@@H](O)c1ccccc1 Amb27802735 [1,1,0,0,0,0|1,0,0]=3 3129 B12R1.107 CC(=O)C[C@H](N)c1ccccc1 Amb27882797 [1,1,0,0,0,0|2,0,0]=4 3130 B12R1.107 CC(=O)C[C@H](O)c1ccncc1 Amb27227062 [1,1,0,0,0,0|2,0,0]=4 3131 B12R1.107 CC(=O)SC(O)c1ccccc1 Amb27775515 [1,1,0,0,0,0|2,0,0]=4 3132 B12R1.107 CC(Br)CC(Br)c1ccccc1 Amb27267411 [1,1,0,0,0,0|2,0,0]=4 3133 B12R1.107 CC(Br)CC(C)c1ccccc1 Amb25273655 [1,1,0,0,0,0|2,0,0]=4 3134 B12R1.107 CC(C)=C[C@@H](O)c1ccccc1 Amb27432272 [1,1,0,0,0,0|1,0,1]=4 3135 B12R1.107 CC(C)CC(N)c1ccccc1 Amb6892355 [1,1,0,0,0,0|2,0,0]=4 3136 B12R1.107 CC(C)CC(N)c1ccccc1 Amb9703509 [1,1,0,0,0,0|2,0,0]=4 3137 B12R1.107 CC(C)CC(O)c1ccccc1 Amb1110402 [1,1,0,0,0,0|1,0,0]=3 3138 B12R1.107 CC(C)CC(O)c1ccccn1 Amb18792671 [1,1,0,0,0,0|2,0,0]=4 3139 B12R1.107 CC(C)CC(O)c1cccnc1 Amb17232541 [1,1,0,0,0,0|2,0,0]=4 3140 B12R1.107 CC(C)CC(S)c1ccccc1 Amb7784758 [1,1,0,0,0,0|1,1,0]=4 3141 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [1,1,0,0,0,0|2,0,0]=4 3142 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb27175567 [1,1,0,0,0,0|2,0,0]=4 3143 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [1,1,0,0,0,0|2,0,0]=4 3144 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb27249677 [1,1,0,0,0,0|2,0,0]=4 3145 B12R1.107 CC(CN(C)O)c1ccccc1 Amb33081590 [1,1,0,0,0,0|1,0,0]=3 3146 B12R1.107 CC(C[C@@H](C)N)c1ccccc1 Amb33081852 [1,1,0,0,0,0|2,0,0]=4 3147 B12R1.107 CC(C[C@@H](C)O)c1ccccc1 Amb28207302 [1,1,0,0,0,0|2,0,0]=4 3148 B12R1.107 CC(C[C@H](C)N)c1ccccc1 Amb33081854 [1,1,0,0,0,0|2,0,0]=4 3149 B12R1.107 CC(C[C@H](C)O)c1ccccc1 Amb33081855 [1,1,0,0,0,0|2,0,0]=4 3150 B12R1.107 CC(Cl)CC(C)c1ccccc1 Amb27175543 [1,1,0,0,0,0|2,0,0]=4 3151 B12R1.107 CC(Cl)CC(Cl)c1ccccc1 Amb28068688 [1,1,0,0,0,0|2,0,0]=4 3152 B12R1.107 CC(Cl)CC(O)c1ccccc1 Amb27865488 [1,1,0,0,0,0|1,0,0]=3 3153 B12R1.107 CC(N)CC(C)c1ccccc1 Amb27831891 [1,1,0,0,0,0|2,0,0]=4 3154 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [1,1,0,0,0,0|1,0,0]=3 3155 B12R1.107 CC(O)CC(C)c1ccccc1 Amb27651998 [1,1,0,0,0,0|2,0,0]=4 3156 B12R1.107 CC(O)CC(F)c1ccccc1 Amb27588281 [1,1,0,0,0,0|2,0,0]=4 3157 B12R1.107 CC(O)CC(O)c1ccccc1 Amb1110547 [1,1,0,0,0,0|1,0,0]=3 3158 B12R1.107 CC(O)C[C@@H](O)c1ccccc1 Amb27748936 [1,1,0,0,0,0|1,0,0]=3 3159 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [1,1,0,0,0,0|0,0,2]=4 3160 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb9217331 [1,1,0,0,0,0|0,0,2]=4 3161 B12R1.107 CN(C)CC(Cl)c1ccccc1 Amb17546791 [1,1,0,0,0,0|1,0,0]=3 3162 B12R1.107 CN(C)CC(N)c1ccccc1 Amb1218288 [1,1,0,0,0,0|1,0,0]=3 3163 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [1,1,0,0,0,0|1,0,0]=3 3164 B12R1.107 CN(C)CC(N)c1ccccc1 Amb33249605 [1,1,0,0,0,0|1,0,0]=3 3165 B12R1.107 CN(C)CC(N)c1ccccn1 Amb24543991 [1,1,0,0,0,0|2,0,0]=4 3166 B12R1.107 CN(C)CC(N)c1cccnc1 Amb26007699 [1,1,0,0,0,0|2,0,0]=4 3167 B12R1.107 CN(C)CC(N)c1ccncc1 Amb25315967 [1,1,0,0,0,0|2,0,0]=4 3168 B12R1.107 CN(C)CC(O)c1ccccc1 Amb17104281 [1,1,0,0,0,0|0,0,0]=2 3169 B12R1.107 CN(C)CC(O)c1ccccn1 Amb17550347 [1,1,0,0,0,0|1,0,0]=3 3170 B12R1.107 CN(C)CC(O)c1ccncc1 Amb17550252 [1,1,0,0,0,0|1,0,0]=3 3171 B12R1.107 CN(C)CC(O)c1cnccn1 Amb27446935 [1,1,0,0,0,0|2,0,0]=4 3172 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [1,1,0,0,0,0|1,0,0]=3 3173 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb28555756 [1,1,0,0,0,0|1,0,0]=3 3174 B12R1.107 CN(C)C[C@H](N)c1ccccc1 Amb26550171 [1,1,0,0,0,0|1,0,0]=3 3175 B12R1.107 CN(C)C[C@H](N)c1ccccc1 Amb33801432 [1,1,0,0,0,0|1,0,0]=3 3176 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [1,1,0,0,0,0|0,0,0]=2 3177 B12R1.107 CN(C)\C=C(/O)c1ccccc1 Amb24068870 [1,1,0,0,0,0|0,0,2]=4 3178 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [1,1,0,0,0,0|2,0,0]=4 3179 B12R1.107 CS(=O)CC(O)c1ccccn1 Amb28138649 [1,1,0,0,0,0|2,0,0]=4 3180 B12R1.107 CS(=O)C[C@@H](N)c1ccccc1 Amb28195318 [1,1,0,0,0,0|2,0,0]=4 3181 B12R1.107 C[C@@H](Cl)C[C@@H](Cl)c1ccccc1 Amb28202622 [1,1,0,0,0,0|2,0,0]=4 3182 B12R1.107 C[C@@H](N)C[C@@H](O)c1ccccc1 Amb27592173 [1,1,0,0,0,0|1,0,0]=3 3183 B12R1.107 C[C@@H](O)C[C@@H](C)c1ccccc1 Amb27457680 [1,1,0,0,0,0|2,0,0]=4 3184 B12R1.107 C[C@@H](O)C[C@@H](S)c1ccccc1 Amb27218944 [1,1,0,0,0,0|1,1,0]=4 3185 B12R1.107 C[C@H](N)C[C@H](O)c1ccccc1 Amb27217333 [1,1,0,0,0,0|1,0,0]=3 3186 B12R1.107 C[C@H](O)C[C@H](N)c1ccccc1 Amb27646110 [1,1,0,0,0,0|2,0,0]=4 3187 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [1,1,0,0,0,0|2,0,0]=4 3188 B12R1.107 NC(=S)C[C@@H](O)c1ccccc1 Amb27494152 [1,1,0,0,0,0|2,0,0]=4 3189 B12R1.107 O=C(O)CC(O)c1ccccc1 Amb2697927 [1,1,0,0,0,0|2,0,0]=4 3190 B12R1.107 O=C(O)C[C@@H](O)c1ccccc1 Amb8516664 [1,1,0,0,0,0|2,0,0]=4 3191 B12R1.107 O=C(O)C[C@H](O)c1ccccc1 Amb6357183 [1,1,0,0,0,0|2,0,0]=4 3192 B12R1.107 O=C(S)CC(O)c1ccccc1 Amb27197171 [1,1,0,0,0,0|2,0,0]=4 3193 B12R1.107 O=[N+]([O-])CC(O)c1ccccc1 Amb1048142 [1,1,0,0,0,0|1,0,1]=4 3194 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [1,1,0,0,0,0|2,0,0]=4 3195 B12R1.308 C#CCC(O)c1ccccc1O Amb28321844 [1,1,0,0,0,0|1,0,1]=4 3196 B12R1.308 C#CC[C@@H](O)c1ccccc1C Amb28400792 [1,1,0,0,0,0|1,0,1]=4 3197 B12R1.308 C#CC[C@H](O)c1ccccc1F Amb28065958 [1,1,0,0,0,0|1,0,1]=4 3198 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [1,1,0,0,0,0|1,0,1]=4 3199 B12R1.308 C=CCC(O)c1ccccc1C Amb18177787 [1,1,0,0,0,0|1,0,1]=4 3200 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [1,1,0,0,0,0|1,0,1]=4 3201 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [1,1,0,0,0,0|1,0,1]=4 3202 B12R1.308 C=CC[C@@H](O)c1ccccc1Br Amb28129784 [1,1,0,0,0,0|1,0,1]=4 3203 B12R1.308 C=CC[C@@H](O)c1ccccc1C Amb28188194 [1,1,0,0,0,0|1,0,1]=4 3204 B12R1.308 C=CC[C@@H](O)c1ccccc1F Amb27812041 [1,1,0,0,0,0|1,0,1]=4 3205 B12R1.308 C=CC[C@@H](O)c1ccccc1S Amb28066020 [1,1,0,0,0,0|1,0,1]=4 3206 B12R1.308 C=CC[C@H](O)c1ccccc1C Amb27981945 [1,1,0,0,0,0|1,0,1]=4 3207 B12R1.308 C=CC[C@H](O)c1ccccc1F Amb27219078 [1,1,0,0,0,0|1,0,1]=4 3208 B12R1.308 CC#CC(O)c1ccccc1C Amb28453534 [1,1,0,0,0,0|1,0,1]=4 3209 B12R1.308 CCCC(C)c1ccccc1C Amb27244850 [1,1,0,0,0,0|2,0,0]=4 3210 B12R1.308 CCCC(C)c1ccccc1O Amb3939443 [1,1,0,0,0,0|2,0,0]=4 3211 B12R1.308 CCCC(Cl)c1ccccc1Cl Amb27808095 [1,1,0,0,0,0|2,0,0]=4 3212 B12R1.308 CCCC(N)c1ccccc1Br Amb27815075 [1,1,0,0,0,0|2,0,0]=4 3213 B12R1.308 CCCC(N)c1ccccc1C Amb17232446 [1,1,0,0,0,0|2,0,0]=4 3214 B12R1.308 CCCC(N)c1ccccc1C Amb32662363 [1,1,0,0,0,0|2,0,0]=4 3215 B12R1.308 CCCC(N)c1ccccc1Cl Amb17234047 [1,1,0,0,0,0|2,0,0]=4 3216 B12R1.308 CCCC(N)c1ccccc1F Amb17232645 [1,1,0,0,0,0|2,0,0]=4 3217 B12R1.308 CCCC(N)c1ccccc1F Amb30982461 [1,1,0,0,0,0|2,0,0]=4 3218 B12R1.308 CCCC(O)c1ccccc1C Amb17232483 [1,1,0,0,0,0|1,0,0]=3 3219 B12R1.308 CCCC(O)c1ccccc1Cl Amb17234154 [1,1,0,0,0,0|1,0,0]=3 3220 B12R1.308 CCCC(O)c1ccccc1F Amb17232666 [1,1,0,0,0,0|1,0,0]=3 3221 B12R1.308 CCCC(O)c1cccnc1Br Amb35702777 [1,1,0,0,0,0|2,0,0]=4 3222 B12R1.308 CCCC(O)c1cccnc1C Amb27399818 [1,1,0,0,0,0|2,0,0]=4 3223 B12R1.308 CCCC(O)c1ccncc1Cl Amb27979725 [1,1,0,0,0,0|2,0,0]=4 3224 B12R1.308 CCCC(O)c1cnccc1N Amb27803449 [1,1,0,0,0,0|2,0,0]=4 3225 B12R1.308 CCCC(O)c1ncccc1C Amb18182634 [1,1,0,0,0,0|2,0,0]=4 3226 B12R1.308 CCCC(O)c1ncccc1Cl Amb27162023 [1,1,0,0,0,0|2,0,0]=4 3227 B12R1.308 CCCC(O)c1ncccc1N Amb35587562 [1,1,0,0,0,0|2,0,0]=4 3228 B12R1.308 CCC[C@@H](N)c1ccccc1C Amb27391198 [1,1,0,0,0,0|2,0,0]=4 3229 B12R1.308 CCC[C@@H](N)c1ccccc1Cl Amb27196196 [1,1,0,0,0,0|2,0,0]=4 3230 B12R1.308 CCC[C@@H](O)c1ccccc1F Amb28064219 [1,1,0,0,0,0|1,0,0]=3 3231 B12R1.308 CCC[C@@H](O)c1ccncc1C Amb27220301 [1,1,0,0,0,0|2,0,0]=4 3232 B12R1.308 CCC[C@H](N)c1ccccc1C Amb26841003 [1,1,0,0,0,0|2,0,0]=4 3233 B12R1.308 CCC[C@H](N)c1ccccc1F Amb27830664 [1,1,0,0,0,0|2,0,0]=4 3234 B12R1.308 CCC[C@H](N)c1ccccc1I Amb28401584 [1,1,0,0,0,0|2,0,0]=4 3235 B12R1.308 CCC[C@H](N)c1ccccc1O Amb28072846 [1,1,0,0,0,0|2,0,0]=4 3236 B12R1.308 CCC[C@H](N)c1ccccc1S Amb27816971 [1,1,0,0,0,0|2,0,0]=4 3237 B12R1.308 CCC[C@H](O)c1ccccc1Br Amb27661408 [1,1,0,0,0,0|1,0,0]=3 3238 B12R1.308 CCC[C@H](O)c1ccccc1Cl Amb28381799 [1,1,0,0,0,0|1,0,0]=3 3239 B12R1.308 CCC[C@H](O)c1ccncc1C Amb28185410 [1,1,0,0,0,0|2,0,0]=4 3240 B12R1.308 CCC[C@H](O)c1cnccc1C Amb27758501 [1,1,0,0,0,0|2,0,0]=4 3241 B12R1.308 CCC[C@H](O)c1ncccc1Br Amb27228260 [1,1,0,0,0,0|2,0,0]=4 3242 B12R1.308 CCC[C@H](O)c1ncccc1C Amb27651963 [1,1,0,0,0,0|2,0,0]=4 3243 B12R1.308 CCC[C@H](O)c1ncccc1Cl Amb27871918 [1,1,0,0,0,0|2,0,0]=4 3244 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [1,1,0,0,0,0|0,0,2]=4 3245 B12R1.308 CNCC(=O)c1ccccc1C Amb18862585 [1,1,0,0,0,0|0,0,2]=4 3246 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [1,1,0,0,0,0|0,0,2]=4 3247 B12R1.308 CNCC(=O)c1ccccc1Cl Amb32679864 [1,1,0,0,0,0|0,0,2]=4 3248 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [1,1,0,0,0,0|0,0,2]=4 3249 B12R1.308 CNCC(=O)c1ccccc1O Amb26392452 [1,1,0,0,0,0|0,0,2]=4 3250 B12R1.308 CNCC(C)c1ccccc1Cl Amb28207901 [1,1,0,0,0,0|1,0,0]=3 3251 B12R1.308 CNCC(O)c1ccccc1Br Amb18301236 [1,1,0,0,0,0|0,0,0]=2 3252 B12R1.308 CNCC(O)c1ccccc1C Amb5750895 [1,1,0,0,0,0|0,0,0]=2 3253 B12R1.308 CNCC(O)c1ccccc1Cl Amb5750901 [1,1,0,0,0,0|0,0,0]=2 3254 B12R1.308 CNCC(O)c1ccccc1F Amb5750898 [1,1,0,0,0,0|0,0,0]=2 3255 B12R1.308 CNCC(O)c1ccccc1O Amb24739803 [1,1,0,0,0,0|0,0,0]=2 3256 B12R1.308 CNCC(O)c1cccnc1Br Amb33387439 [1,1,0,0,0,0|1,0,0]=3 3257 B12R1.308 CNCC(O)c1cccnc1C Amb32880621 [1,1,0,0,0,0|1,0,0]=3 3258 B12R1.308 CNCC(O)c1cccnc1Cl Amb33256933 [1,1,0,0,0,0|1,0,0]=3 3259 B12R1.308 CNCC(O)c1cccnc1F Amb33378329 [1,1,0,0,0,0|1,0,0]=3 3260 B12R1.308 CNCC(O)c1ccncc1Br Amb33241237 [1,1,0,0,0,0|1,0,0]=3 3261 B12R1.308 CNCC(O)c1ccncc1C Amb33414520 [1,1,0,0,0,0|1,0,0]=3 3262 B12R1.308 CNCC(O)c1ccncc1Cl Amb33413516 [1,1,0,0,0,0|1,0,0]=3 3263 B12R1.308 CNCC(O)c1ccncc1F Amb25259123 [1,1,0,0,0,0|1,0,0]=3 3264 B12R1.308 CNCC(O)c1cnccc1C Amb26616381 [1,1,0,0,0,0|1,0,0]=3 3265 B12R1.308 CNCC(O)c1cncnc1C Amb33472505 [1,1,0,0,0,0|2,0,0]=4 3266 B12R1.308 CNCC(O)c1ncccc1Br Amb23586111 [1,1,0,0,0,0|1,0,0]=3 3267 B12R1.308 CNCC(O)c1ncccc1C Amb24711552 [1,1,0,0,0,0|1,0,0]=3 3268 B12R1.308 CNCC(O)c1ncccc1F Amb27958803 [1,1,0,0,0,0|1,0,0]=3 3269 B12R1.308 CNCC(O)c1nccnc1C Amb33142590 [1,1,0,0,0,0|2,0,0]=4 3270 B12R1.308 COCC(F)c1ccccc1N Amb27615210 [1,1,0,0,0,0|2,0,0]=4 3271 B12R1.308 COCC(N)c1ccccc1Br Amb25974461 [1,1,0,0,0,0|2,0,0]=4 3272 B12R1.308 COCC(N)c1ccccc1Cl Amb18979037 [1,1,0,0,0,0|2,0,0]=4 3273 B12R1.308 COCC(O)c1cccnc1Br Amb35702779 [1,1,0,0,0,0|2,0,0]=4 3274 B12R1.308 COCC(O)c1ccncc1F Amb27754889 [1,1,0,0,0,0|2,0,0]=4 3275 B12R1.308 COCC(O)c1cnccc1C Amb27243298 [1,1,0,0,0,0|2,0,0]=4 3276 B12R1.308 COCC(O)c1cnccc1N Amb28197976 [1,1,0,0,0,0|2,0,0]=4 3277 B12R1.308 COCC(O)c1ncccc1Br Amb27436429 [1,1,0,0,0,0|2,0,0]=4 3278 B12R1.308 COCC(O)c1ncccc1N Amb30022916 [1,1,0,0,0,0|2,0,0]=4 3279 B12R1.308 COC[C@@H](N)c1ccccc1Br Amb27259275 [1,1,0,0,0,0|2,0,0]=4 3280 B12R1.308 COC[C@@H](N)c1ccccc1I Amb27642503 [1,1,0,0,0,0|2,0,0]=4 3281 B12R1.308 COC[C@@H](N)c1ccccc1N Amb27882660 [1,1,0,0,0,0|2,0,0]=4 3282 B12R1.308 COC[C@@H](N)c1ccccc1O Amb27399755 [1,1,0,0,0,0|2,0,0]=4 3283 B12R1.308 COC[C@H](N)c1ccccc1F Amb27752235 [1,1,0,0,0,0|2,0,0]=4 3284 B12R1.308 COC[C@H](N)c1ccccc1O Amb28341304 [1,1,0,0,0,0|2,0,0]=4 3285 B12R1.308 CSCC(N)c1ccccc1Cl Amb18300371 [1,1,0,0,0,0|2,0,0]=4 3286 B12R1.308 CSCC(O)c1ccccc1C Amb19061296 [1,1,0,0,0,0|1,0,0]=3 3287 B12R1.308 CSCC(O)c1ccccc1N Amb18987947 [1,1,0,0,0,0|1,0,0]=3 3288 B12R1.308 C\C=C/C(O)c1ccccc1O Amb28324317 [1,1,0,0,0,0|1,0,1]=4 3289 B12R1.308 Cc1ccccc1C(O)CC#N Amb1111330 [1,1,0,0,0,0|2,0,0]=4 3290 B12R1.308 Cc1ccccc1C(O)CCN Amb17232539 [1,1,0,0,0,0|2,0,0]=4 3291 B12R1.308 Cc1ccccc1C(O)CCO Amb28195046 [1,1,0,0,0,0|2,0,0]=4 3292 B12R1.308 Cc1ccccc1C(O)CNN Amb17232608 [1,1,0,0,0,0|1,0,0]=3 3293 B12R1.308 Cc1ccccc1C(O)CNO Amb17334702 [1,1,0,0,0,0|1,0,0]=3 3294 B12R1.308 Cc1ccccc1[C@@H](O)CC#N Amb28188196 [1,1,0,0,0,0|2,0,0]=4 3295 B12R1.308 Cc1ccccc1[C@@H](O)CCN Amb33360572 [1,1,0,0,0,0|2,0,0]=4 3296 B12R1.308 Cc1ccccc1[C@H](O)CCN Amb33360573 [1,1,0,0,0,0|2,0,0]=4 3297 B12R1.308 N#CCC(O)c1ccccc1Br Amb27444920 [1,1,0,0,0,0|2,0,0]=4 3298 B12R1.308 N#CCC(O)c1ccccc1Cl Amb4405009 [1,1,0,0,0,0|2,0,0]=4 3299 B12R1.308 N#CCC(O)c1ccccc1F Amb17232516 [1,1,0,0,0,0|2,0,0]=4 3300 B12R1.308 N#CCC(O)c1ccccc1O Amb27433523 [1,1,0,0,0,0|2,0,0]=4 3301 B12R1.308 N#CC[C@@H](O)c1ccccc1F Amb27879709 [1,1,0,0,0,0|2,0,0]=4 3302 B12R1.308 N#CC[C@H](O)c1ccccc1Br Amb27464759 [1,1,0,0,0,0|2,0,0]=4 3303 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [1,1,0,0,0,0|2,0,0]=4 3304 B12R1.308 NCCC(O)c1ccccc1Cl Amb17234259 [1,1,0,0,0,0|2,0,0]=4 3305 B12R1.308 NCCC(O)c1ccccc1F Amb17232696 [1,1,0,0,0,0|2,0,0]=4 3306 B12R1.308 NCCC(O)c1ccccc1N Amb28249964 [1,1,0,0,0,0|2,0,0]=4 3307 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [1,1,0,0,0,0|2,0,0]=4 3308 B12R1.308 NCC[C@@H](O)c1ccccc1Br Amb33387618 [1,1,0,0,0,0|2,0,0]=4 3309 B12R1.308 NCC[C@@H](O)c1ccccc1Cl Amb33052581 [1,1,0,0,0,0|2,0,0]=4 3310 B12R1.308 NCC[C@@H](O)c1ccccc1F Amb33361507 [1,1,0,0,0,0|2,0,0]=4 3311 B12R1.308 NCC[C@@H](O)c1ccccc1O Amb33196477 [1,1,0,0,0,0|2,0,0]=4 3312 B12R1.308 NCC[C@H](O)c1ccccc1Br Amb33387621 [1,1,0,0,0,0|2,0,0]=4 3313 B12R1.308 NCC[C@H](O)c1ccccc1Cl Amb33052779 [1,1,0,0,0,0|2,0,0]=4 3314 B12R1.308 NCC[C@H](O)c1ccccc1F Amb33361910 [1,1,0,0,0,0|2,0,0]=4 3315 B12R1.308 NCC[C@H](O)c1ccccc1O Amb33196476 [1,1,0,0,0,0|2,0,0]=4 3316 B12R1.308 NNCC(O)c1ccccc1Br Amb18070085 [1,1,0,0,0,0|1,0,0]=3 3317 B12R1.308 NNCC(O)c1ccccc1Cl Amb17234360 [1,1,0,0,0,0|1,0,0]=3 3318 B12R1.308 NNCC(O)c1ccccc1F Amb17232742 [1,1,0,0,0,0|1,0,0]=3 3319 B12R1.308 O=CCC(O)c1ccccc1F Amb27947440 [1,1,0,0,0,0|2,0,0]=4 3320 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [1,1,0,0,0,0|2,0,0]=4 3321 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [1,1,0,0,0,0|2,0,0]=4 3322 B12R1.308 ONCC(O)c1ccccc1Cl Amb17335947 [1,1,0,0,0,0|1,0,0]=3 3323 B12R1.308 ONCC(O)c1ccccc1F Amb17334837 [1,1,0,0,0,0|1,0,0]=3 3324 B12R1.20 C=C(C)C(O)c1ccc(F)cc1 Amb28123872 [1,1,0,0,0,0|0,0,2]=4 3325 B12R1.20 C=C(C)C(O)c1ccc(N)cc1 Amb27200828 [1,1,0,0,0,0|0,0,2]=4 3326 B12R1.20 C=C(C)[C@@H](O)c1ccc(C)cc1 Amb28435863 [1,1,0,0,0,0|0,0,2]=4 3327 B12R1.20 C=C(C)[C@H](O)c1ccc(C)cc1 Amb27404949 [1,1,0,0,0,0|0,0,2]=4 3328 B12R1.20 CC(=O)C(O)c1ccc(Br)cc1 Amb25816507 [1,1,0,0,0,0|1,0,1]=4 3329 B12R1.20 CC(=O)C(O)c1ccc(C)cc1 Amb26972409 [1,1,0,0,0,0|1,0,1]=4 3330 B12R1.20 CC(=O)C(O)c1ccc(Cl)cc1 Amb27968684 [1,1,0,0,0,0|1,0,1]=4 3331 B12R1.20 CC(=O)C(O)c1ccc(F)cc1 Amb24700376 [1,1,0,0,0,0|1,0,1]=4 3332 B12R1.20 CC(=O)[C@H](O)c1ccc(C)cc1 Amb27828871 [1,1,0,0,0,0|1,0,1]=4 3333 B12R1.20 CC(Br)C(C)c1ccc(Cl)cc1 Amb27977145 [1,1,0,0,0,0|2,0,0]=4 3334 B12R1.20 CC(C)C(=O)c1ccc(Br)cc1 Amb5740261 [1,1,0,0,0,0|0,0,2]=4 3335 B12R1.20 CC(C)C(=O)c1ccc(Cl)cc1 Amb5740260 [1,1,0,0,0,0|0,0,2]=4 3336 B12R1.20 CC(C)C(=O)c1ccc(F)cc1 Amb5740259 [1,1,0,0,0,0|0,0,2]=4 3337 B12R1.20 CC(C)C(=O)c1ccc(I)cc1 Amb8850354 [1,1,0,0,0,0|0,0,2]=4 3338 B12R1.20 CC(C)C(=O)c1ccc(N)cc1 Amb32662656 [1,1,0,0,0,0|0,0,2]=4 3339 B12R1.20 CC(C)C(=O)c1ccc(N)cc1 Amb4024128 [1,1,0,0,0,0|0,0,2]=4 3340 B12R1.20 CC(C)C(=O)c1ccc(O)cc1 Amb17232466 [1,1,0,0,0,0|0,0,2]=4 3341 B12R1.20 CC(C)C(Br)c1ccc(Br)cc1 Amb26505652 [1,1,0,0,0,0|1,0,0]=3 3342 B12R1.20 CC(C)C(Br)c1ccc(F)cc1 Amb27833886 [1,1,0,0,0,0|1,0,0]=3 3343 B12R1.20 CC(C)C(C)c1ccc(N)cc1 Amb27392369 [1,1,0,0,0,0|1,0,0]=3 3344 B12R1.20 CC(C)C(Cl)c1ccc(Br)cc1 Amb17160234 [1,1,0,0,0,0|1,0,0]=3 3345 B12R1.20 CC(C)C(Cl)c1ccc(Cl)cc1 Amb17139905 [1,1,0,0,0,0|1,0,0]=3 3346 B12R1.20 CC(C)C(Cl)c1ccc(F)cc1 Amb17139161 [1,1,0,0,0,0|1,0,0]=3 3347 B12R1.20 CC(C)C(N)c1ccc(Br)cc1 Amb33527613 [1,1,0,0,0,0|1,0,0]=3 3348 B12R1.20 CC(C)C(N)c1ccc(Br)cc1 Amb6255698 [1,1,0,0,0,0|1,0,0]=3 3349 B12R1.20 CC(C)C(N)c1ccc(Cl)cc1 Amb31289709 [1,1,0,0,0,0|1,0,0]=3 3350 B12R1.20 CC(C)C(N)c1ccc(Cl)cc1 Amb9724762 [1,1,0,0,0,0|1,0,0]=3 3351 B12R1.20 CC(C)C(N)c1ccc(Cl)nc1 Amb27253837 [1,1,0,0,0,0|2,0,0]=4 3352 B12R1.20 CC(C)C(N)c1ccc(F)cc1 Amb28872354 [1,1,0,0,0,0|1,0,0]=3 3353 B12R1.20 CC(C)C(N)c1ccc(F)cc1 Amb443856 [1,1,0,0,0,0|1,0,0]=3 3354 B12R1.20 CC(C)C(N)c1ccc(N)cn1 Amb26425828 [1,1,0,0,0,0|2,0,0]=4 3355 B12R1.20 CC(C)C(N)c1ccc(O)cc1 Amb24603967 [1,1,0,0,0,0|1,0,0]=3 3356 B12R1.20 CC(C)C(N)c1ccc(O)cn1 Amb27258752 [1,1,0,0,0,0|2,0,0]=4 3357 B12R1.20 CC(C)C(N)c1ccc(O)nc1 Amb27596041 [1,1,0,0,0,0|2,0,0]=4 3358 B12R1.20 CC(C)C(O)c1ccc(Br)cc1 Amb17142527 [1,1,0,0,0,0|0,0,0]=2 3359 B12R1.20 CC(C)C(O)c1ccc(Cl)cc1 Amb17139096 [1,1,0,0,0,0|0,0,0]=2 3360 B12R1.20 CC(C)C(O)c1ccc(Cl)nc1 Amb27625995 [1,1,0,0,0,0|1,0,0]=3 3361 B12R1.20 CC(C)C(O)c1ccc(F)cc1 Amb17138631 [1,1,0,0,0,0|0,0,0]=2 3362 B12R1.20 CC(C)C(O)c1ccc(F)cn1 Amb28072456 [1,1,0,0,0,0|1,0,0]=3 3363 B12R1.20 CC(C)C(O)c1ccc(N)cc1 Amb17101751 [1,1,0,0,0,0|0,0,0]=2 3364 B12R1.20 CC(C)C(O)c1ccc(N)cn1 Amb35622101 [1,1,0,0,0,0|1,0,0]=3 3365 B12R1.20 CC(C)N(C)c1ccc(O)cc1 Amb25684175 [1,1,0,0,0,0|2,0,0]=4 3366 B12R1.20 CC(C)N(N)c1ccc(Cl)cc1 Amb23591066 [1,1,0,0,0,0|2,0,0]=4 3367 B12R1.20 CC(C)S(=O)c1ccc(Br)cc1 Amb21856287 [1,1,0,0,0,0|1,0,1]=4 3368 B12R1.20 CC(C)S(=O)c1ccc(N)cc1 Amb18954240 [1,1,0,0,0,0|1,0,1]=4 3369 B12R1.20 CC(C)[C@@H](N)c1ccc(Br)cc1 Amb27616960 [1,1,0,0,0,0|1,0,0]=3 3370 B12R1.20 CC(C)[C@@H](N)c1ccc(Cl)cc1 Amb25719589 [1,1,0,0,0,0|1,0,0]=3 3371 B12R1.20 CC(C)[C@@H](N)c1ccc(Cl)nc1 Amb27251971 [1,1,0,0,0,0|2,0,0]=4 3372 B12R1.20 CC(C)[C@@H](N)c1ccc(F)cc1 Amb27389278 [1,1,0,0,0,0|1,0,0]=3 3373 B12R1.20 CC(C)[C@@H](N)c1ccc(N)nc1 Amb28071792 [1,1,0,0,0,0|2,0,0]=4 3374 B12R1.20 CC(C)[C@H](N)c1ccc(Br)cc1 Amb24451484 [1,1,0,0,0,0|1,0,0]=3 3375 B12R1.20 CC(C)[C@H](N)c1ccc(Br)cc1 Amb33872221 [1,1,0,0,0,0|1,0,0]=3 3376 B12R1.20 CC(C)[C@H](N)c1ccc(Br)cn1 Amb28241069 [1,1,0,0,0,0|2,0,0]=4 3377 B12R1.20 CC(C)[C@H](N)c1ccc(Br)nc1 Amb27667911 [1,1,0,0,0,0|2,0,0]=4 3378 B12R1.20 CC(C)[C@H](N)c1ccc(Cl)cc1 Amb27881648 [1,1,0,0,0,0|1,0,0]=3 3379 B12R1.20 CC(C)[C@H](N)c1ccc(F)cn1 Amb27817399 [1,1,0,0,0,0|2,0,0]=4 3380 B12R1.20 CC(C)[C@H](N)c1ccc(I)cc1 Amb27597659 [1,1,0,0,0,0|1,0,0]=3 3381 B12R1.20 CC(C)[C@H](N)c1ccc(I)nc1 Amb27770070 [1,1,0,0,0,0|2,0,0]=4 3382 B12R1.20 CC(C)[C@H](N)c1ccc(N)cn1 Amb24662536 [1,1,0,0,0,0|2,0,0]=4 3383 B12R1.20 CC(C)[C@H](N)c1ccc(S)cc1 Amb27213198 [1,1,0,0,0,0|1,0,0]=3 3384 B12R1.20 CC(C)[C@H](O)c1ccc(F)cc1 Amb28252922 [1,1,0,0,0,0|0,0,0]=2 3385 B12R1.20 CC(Cl)C(C)c1ccc(Br)cc1 Amb27163630 [1,1,0,0,0,0|2,0,0]=4 3386 B12R1.20 CC(Cl)C(C)c1ccc(I)cc1 Amb28455154 [1,1,0,0,0,0|2,0,0]=4 3387 B12R1.20 CC(Cl)C(O)c1ccc(Cl)cc1 Amb27949669 [1,1,0,0,0,0|1,0,0]=3 3388 B12R1.20 CC(N)C(=O)c1ccc(Br)cc1 Amb32757690 [1,1,0,0,0,0|0,0,2]=4 3389 B12R1.20 CC(N)C(=O)c1ccc(Br)cc1 Amb5739554 [1,1,0,0,0,0|0,0,2]=4 3390 B12R1.20 CC(N)C(=O)c1ccc(Cl)cc1 Amb31156686 [1,1,0,0,0,0|0,0,2]=4 3391 B12R1.20 CC(N)C(=O)c1ccc(Cl)cc1 Amb5739553 [1,1,0,0,0,0|0,0,2]=4 3392 B12R1.20 CC(N)C(=O)c1ccc(F)cc1 Amb5739552 [1,1,0,0,0,0|0,0,2]=4 3393 B12R1.20 CC(N)C(=O)c1ccc(N)cc1 Amb26632977 [1,1,0,0,0,0|0,0,2]=4 3394 B12R1.20 CC(N)C(=O)c1ccc(O)cc1 Amb18828423 [1,1,0,0,0,0|0,0,2]=4 3395 B12R1.20 CC(N)C(C)c1ccc(Br)cc1 Amb18161837 [1,1,0,0,0,0|1,0,0]=3 3396 B12R1.20 CC(N)C(C)c1ccc(F)cc1 Amb18646792 [1,1,0,0,0,0|1,0,0]=3 3397 B12R1.20 CC(N)C(N)c1ccc(Br)cc1 Amb13953206 [1,1,0,0,0,0|1,0,0]=3 3398 B12R1.20 CC(N)C(N)c1ccc(Br)cn1 Amb27985406 [1,1,0,0,0,0|2,0,0]=4 3399 B12R1.20 CC(N)C(N)c1ccc(Br)nc1 Amb27430372 [1,1,0,0,0,0|2,0,0]=4 3400 B12R1.20 CC(N)C(N)c1ccc(Cl)nc1 Amb27217365 [1,1,0,0,0,0|2,0,0]=4 3401 B12R1.20 CC(N)C(O)c1ccc(Br)cc1 Amb6740236 [1,1,0,0,0,0|0,0,0]=2 3402 B12R1.20 CC(N)C(O)c1ccc(Br)cn1 Amb27982088 [1,1,0,0,0,0|1,0,0]=3 3403 B12R1.20 CC(N)C(O)c1ccc(Cl)cc1 Amb6740224 [1,1,0,0,0,0|0,0,0]=2 3404 B12R1.20 CC(N)C(O)c1ccc(Cl)cc1 Amb8387408 [1,1,0,0,0,0|0,0,0]=2 3405 B12R1.20 CC(N)C(O)c1ccc(F)cc1 Amb6740237 [1,1,0,0,0,0|0,0,0]=2 3406 B12R1.20 CC(N)C(O)c1ccc(F)cn1 Amb27958804 [1,1,0,0,0,0|1,0,0]=3 3407 B12R1.20 CC(N)C(O)c1ccc(N)cn1 Amb27430288 [1,1,0,0,0,0|1,0,0]=3 3408 B12R1.20 CC(N)C(O)c1ccc(N)nc1 Amb27428874 [1,1,0,0,0,0|1,0,0]=3 3409 B12R1.20 CC(N)C(O)c1ccc(O)cc1 Amb18288260 [1,1,0,0,0,0|0,0,0]=2 3410 B12R1.20 CC(N)C(O)c1ccc(O)cc1 Amb6608862 [1,1,0,0,0,0|0,0,0]=2 3411 B12R1.20 CC(N)C(O)c1ccc(O)nc1 Amb27430289 [1,1,0,0,0,0|1,0,0]=3 3412 B12R1.20 CC(N)C(O)c1ccc(S)cc1 Amb27232897 [1,1,0,0,0,0|0,0,0]=2 3413 B12R1.20 CC(O)C(C)c1ccc(Br)cc1 Amb27664659 [1,1,0,0,0,0|2,0,0]=4 3414 B12R1.20 CC(O)C(C)c1ccc(Cl)cc1 Amb27770087 [1,1,0,0,0,0|2,0,0]=4 3415 B12R1.20 CC(O)C(C)c1ccc(F)cc1 Amb26368278 [1,1,0,0,0,0|2,0,0]=4 3416 B12R1.20 CC(O)C(C)c1ccc(N)cc1 Amb35622404 [1,1,0,0,0,0|2,0,0]=4 3417 B12R1.20 CC(O)C(C)c1ccc(O)cc1 Amb32950127 [1,1,0,0,0,0|2,0,0]=4 3418 B12R1.20 CC(O)C(F)c1ccc(F)cc1 Amb27594705 [1,1,0,0,0,0|2,0,0]=4 3419 B12R1.20 CC(O)C(N)c1ccc(Br)cc1 Amb17248848 [1,1,0,0,0,0|2,0,0]=4 3420 B12R1.20 CC(O)C(O)c1ccc(Br)cc1 Amb35605451 [1,1,0,0,0,0|1,0,0]=3 3421 B12R1.20 CC(O)C(O)c1ccc(O)cc1 Amb22329663 [1,1,0,0,0,0|1,0,0]=3 3422 B12R1.20 CC(O)C(O)c1ccc(S)cc1 Amb27598628 [1,1,0,0,0,0|1,0,0]=3 3423 B12R1.20 CC(O)[C@@H](N)c1ccc(Br)cc1 Amb27389646 [1,1,0,0,0,0|2,0,0]=4 3424 B12R1.20 CC(O)[C@H](N)c1ccc(Br)cc1 Amb25850041 [1,1,0,0,0,0|2,0,0]=4 3425 B12R1.20 CC(O)[C@H](N)c1ccc(I)cc1 Amb27961203 [1,1,0,0,0,0|2,0,0]=4 3426 B12R1.20 CC(c1ccc(Br)cc1)N(C)C Amb9173687 [1,1,0,0,0,0|2,0,0]=4 3427 B12R1.20 CC(c1ccc(F)cc1)[C@@H](C)N Amb33274557 [1,1,0,0,0,0|1,0,0]=3 3428 B12R1.20 CC(c1ccc(F)cc1)[C@@H](C)O Amb33445905 [1,1,0,0,0,0|2,0,0]=4 3429 B12R1.20 CC(c1ccc(F)cc1)[C@H](C)N Amb33274554 [1,1,0,0,0,0|1,0,0]=3 3430 B12R1.20 CC(c1ccc(F)cc1)[C@H](C)O Amb33445903 [1,1,0,0,0,0|2,0,0]=4 3431 B12R1.20 CC(c1ccc(I)cc1)N(C)C Amb27970524 [1,1,0,0,0,0|2,0,0]=4 3432 B12R1.20 CC(c1ccc(N)cc1)N(C)C Amb17090400 [1,1,0,0,0,0|2,0,0]=4 3433 B12R1.20 CN(C)C(N)c1ccc(Cl)cc1 Amb28144013 [1,1,0,0,0,0|2,0,0]=4 3434 B12R1.20 C[C@@H](N)C(=O)c1ccc(Br)cc1 Amb35737912 [1,1,0,0,0,0|0,0,2]=4 3435 B12R1.20 C[C@@H](N)C(=O)c1ccc(Cl)cc1 Amb35738375 [1,1,0,0,0,0|0,0,2]=4 3436 B12R1.20 C[C@@H](N)C(=O)c1ccc(F)cc1 Amb35618031 [1,1,0,0,0,0|0,0,2]=4 3437 B12R1.20 C[C@@H](N)C(O)c1ccc(Br)cc1 Amb35624308 [1,1,0,0,0,0|0,0,0]=2 3438 B12R1.20 C[C@@H](N)C(O)c1ccc(F)cc1 Amb35617944 [1,1,0,0,0,0|0,0,0]=2 3439 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(Cl)cc1 Amb25042032 [1,1,0,0,0,0|0,0,0]=2 3440 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(F)nc1 Amb28077206 [1,1,0,0,0,0|1,0,0]=3 3441 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(N)nc1 Amb27252548 [1,1,0,0,0,0|1,0,0]=3 3442 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(O)nc1 Amb28057959 [1,1,0,0,0,0|1,0,0]=3 3443 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(Cl)nc1 Amb27233978 [1,1,0,0,0,0|1,0,0]=3 3444 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(F)cc1 Amb27605913 [1,1,0,0,0,0|0,0,0]=2 3445 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(N)cn1 Amb28055998 [1,1,0,0,0,0|1,0,0]=3 3446 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(N)nc1 Amb27804044 [1,1,0,0,0,0|1,0,0]=3 3447 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(F)cc1 Amb27247738 [1,1,0,0,0,0|2,0,0]=4 3448 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(O)cc1 Amb27244891 [1,1,0,0,0,0|2,0,0]=4 3449 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(I)cc1 Amb27224057 [1,1,0,0,0,0|2,0,0]=4 3450 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(S)cc1 Amb27265882 [1,1,0,0,0,0|2,0,0]=4 3451 B12R1.20 C[C@@H](c1ccc(Br)cc1)N(C)C Amb26519518 [1,1,0,0,0,0|2,0,0]=4 3452 B12R1.20 C[C@@H](c1ccc(I)cc1)N(C)C Amb27397052 [1,1,0,0,0,0|2,0,0]=4 3453 B12R1.20 C[C@@H](c1ccc(N)cc1)N(C)C Amb27475992 [1,1,0,0,0,0|2,0,0]=4 3454 B12R1.20 C[C@H](N)C(=O)c1ccc(Br)cc1 Amb30024289 [1,1,0,0,0,0|0,0,2]=4 3455 B12R1.20 C[C@H](N)C(=O)c1ccc(Cl)cc1 Amb35588870 [1,1,0,0,0,0|0,0,2]=4 3456 B12R1.20 C[C@H](N)C(O)c1ccc(Br)cc1 Amb35618418 [1,1,0,0,0,0|0,0,0]=2 3457 B12R1.20 C[C@H](N)C(O)c1ccc(Cl)cc1 Amb35588753 [1,1,0,0,0,0|0,0,0]=2 3458 B12R1.20 C[C@H](N)C(O)c1ccc(F)cc1 Amb35588760 [1,1,0,0,0,0|0,0,0]=2 3459 B12R1.20 C[C@H](N)[C@@H](N)c1ccc(I)cc1 Amb28055923 [1,1,0,0,0,0|1,0,0]=3 3460 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(F)cc1 Amb27954631 [1,1,0,0,0,0|0,0,0]=2 3461 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(N)nc1 Amb27252274 [1,1,0,0,0,0|1,0,0]=3 3462 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(O)cc1 Amb27668929 [1,1,0,0,0,0|0,0,0]=2 3463 B12R1.20 C[C@H](N)[C@H](O)c1ccc(Cl)nc1 Amb27784418 [1,1,0,0,0,0|1,0,0]=3 3464 B12R1.20 C[C@H](N)[C@H](O)c1ccc(O)cc1 Amb27244894 [1,1,0,0,0,0|0,0,0]=2 3465 B12R1.20 C[C@H](O)[C@@H](F)c1ccc(Cl)cc1 Amb27980392 [1,1,0,0,0,0|2,0,0]=4 3466 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(Br)cc1 Amb27393626 [1,1,0,0,0,0|2,0,0]=4 3467 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(F)cc1 Amb27786322 [1,1,0,0,0,0|2,0,0]=4 3468 B12R1.20 C[C@H](O)[C@H](N)c1ccc(Cl)cc1 Amb27241334 [1,1,0,0,0,0|2,0,0]=4 3469 B12R1.20 C[C@H](O)[C@H](N)c1ccc(F)cc1 Amb27259152 [1,1,0,0,0,0|2,0,0]=4 3470 B12R1.20 C[C@H](O)[C@H](N)c1ccc(N)cc1 Amb28057162 [1,1,0,0,0,0|2,0,0]=4 3471 B12R1.20 Cc1ccc(C(=O)C(C)C)cc1 Amb4018667 [1,1,0,0,0,0|0,0,2]=4 3472 B12R1.20 Cc1ccc(C(=O)C(C)N)cc1 Amb24081001 [1,1,0,0,0,0|0,0,2]=4 3473 B12R1.20 Cc1ccc(C(=O)C(C)N)cc1 Amb5739545 [1,1,0,0,0,0|0,0,2]=4 3474 B12R1.20 Cc1ccc(C(C)C(C)Cl)cc1 Amb27431114 [1,1,0,0,0,0|2,0,0]=4 3475 B12R1.20 Cc1ccc(C(C)C(C)N)cc1 Amb18829123 [1,1,0,0,0,0|1,0,0]=3 3476 B12R1.20 Cc1ccc(C(C)C(C)O)cc1 Amb26370779 [1,1,0,0,0,0|2,0,0]=4 3477 B12R1.20 Cc1ccc(C(C)[C@@H](C)N)cc1 Amb33743261 [1,1,0,0,0,0|1,0,0]=3 3478 B12R1.20 Cc1ccc(C(C)[C@H](C)N)cc1 Amb33745941 [1,1,0,0,0,0|1,0,0]=3 3479 B12R1.20 Cc1ccc(C(Cl)C(C)C)cc1 Amb17139050 [1,1,0,0,0,0|1,0,0]=3 3480 B12R1.20 Cc1ccc(C(Cl)N(C)C)cc1 Amb28385756 [1,1,0,0,0,0|2,0,0]=4 3481 B12R1.20 Cc1ccc(C(N)C(C)C)cc1 Amb32662399 [1,1,0,0,0,0|1,0,0]=3 3482 B12R1.20 Cc1ccc(C(N)C(C)C)cc1 Amb6255534 [1,1,0,0,0,0|1,0,0]=3 3483 B12R1.20 Cc1ccc(C(N)C(C)C)cn1 Amb18828645 [1,1,0,0,0,0|2,0,0]=4 3484 B12R1.20 Cc1ccc(C(O)C(C)C)cc1 Amb8505814 [1,1,0,0,0,0|0,0,0]=2 3485 B12R1.20 Cc1ccc(C(O)C(C)C)nc1 Amb28244041 [1,1,0,0,0,0|1,0,0]=3 3486 B12R1.20 Cc1ccc(C(O)C(C)C)nn1 Amb28204318 [1,1,0,0,0,0|2,0,0]=4 3487 B12R1.20 Cc1ccc(C(O)C(C)N)cc1 Amb32652611 [1,1,0,0,0,0|0,0,0]=2 3488 B12R1.20 Cc1ccc(C(O)C(C)N)cc1 Amb33528320 [1,1,0,0,0,0|0,0,0]=2 3489 B12R1.20 Cc1ccc(C(O)C(F)F)cc1 Amb27974553 [1,1,0,0,0,0|2,0,0]=4 3490 B12R1.20 Cc1ccc(C(O)C(N)=O)cc1 Amb18800898 [1,1,0,0,0,0|1,0,1]=4 3491 B12R1.20 Cc1ccc(C(O)[C@@H](C)N)cc1 Amb35618094 [1,1,0,0,0,0|0,0,0]=2 3492 B12R1.20 Cc1ccc(C(O)[C@@H](C)N)cn1 Amb30024557 [1,1,0,0,0,0|1,0,0]=3 3493 B12R1.20 Cc1ccc(C(O)[C@H](C)N)cc1 Amb35738410 [1,1,0,0,0,0|0,0,0]=2 3494 B12R1.20 Cc1ccc(C(O)[C@H](C)N)cn1 Amb35737787 [1,1,0,0,0,0|1,0,0]=3 3495 B12R1.20 Cc1ccc(N(C)C(C)C)cc1 Amb27810097 [1,1,0,0,0,0|2,0,0]=4 3496 B12R1.20 Cc1ccc([C@@H](C)[C@@H](C)O)cc1 Amb27771026 [1,1,0,0,0,0|2,0,0]=4 3497 B12R1.20 Cc1ccc([C@@H](N)C(C)C)cc1 Amb22298586 [1,1,0,0,0,0|1,0,0]=3 3498 B12R1.20 Cc1ccc([C@@H](N)C(C)C)nc1 Amb28253590 [1,1,0,0,0,0|2,0,0]=4 3499 B12R1.20 Cc1ccc([C@@H](N)[C@@H](C)O)cc1 Amb28137794 [1,1,0,0,0,0|2,0,0]=4 3500 B12R1.20 Cc1ccc([C@@H](O)C(N)=O)cc1 Amb27394745 [1,1,0,0,0,0|1,0,1]=4 3501 B12R1.20 Cc1ccc([C@@H](O)[C@H](C)N)cc1 Amb28318996 [1,1,0,0,0,0|0,0,0]=2 3502 B12R1.20 Cc1ccc([C@@H](O)[C@H](C)N)cn1 Amb27637893 [1,1,0,0,0,0|1,0,0]=3 3503 B12R1.20 Cc1ccc([C@H](N)C(C)O)cc1 Amb28047370 [1,1,0,0,0,0|2,0,0]=4 3504 B12R1.20 Cc1ccc([C@H](N)[C@@H](C)O)cc1 Amb27476110 [1,1,0,0,0,0|2,0,0]=4 3505 B12R1.20 Cc1ccc([C@H](N)[C@H](C)O)cc1 Amb27451602 [1,1,0,0,0,0|2,0,0]=4 3506 B12R1.20 Cc1ccc([C@H](O)C(C)C)cc1 Amb27851067 [1,1,0,0,0,0|0,0,0]=2 3507 B12R1.20 Cc1ccc([C@H](O)C(C)C)cn1 Amb27651803 [1,1,0,0,0,0|1,0,0]=3 3508 B12R1.20 Cc1ccc([C@H](O)C(F)F)cc1 Amb27464639 [1,1,0,0,0,0|2,0,0]=4 3509 B12R1.20 Cc1ccc([C@H](O)[C@@H](C)N)cc1 Amb27983780 [1,1,0,0,0,0|0,0,0]=2 3510 B12R1.20 Cc1ccc([C@H](O)[C@H](C)N)nc1 Amb28195486 [1,1,0,0,0,0|1,0,0]=3 3511 B12R1.20 Cc1ncc(C(O)C(C)C)cn1 Amb28207412 [1,1,0,0,0,0|2,0,0]=4 3512 B12R1.20 Cc1ncc([C@H](O)C(C)C)cn1 Amb28455116 [1,1,0,0,0,0|2,0,0]=4 3513 B12R1.20 N=C(N)C(O)c1ccc(O)cc1 Amb27951917 [1,1,0,0,0,0|1,0,1]=4 3514 B12R1.20 NC(=O)C(O)c1ccc(Br)cc1 Amb24100617 [1,1,0,0,0,0|1,0,1]=4 3515 B12R1.20 NC(=O)C(O)c1ccc(Cl)cc1 Amb19075669 [1,1,0,0,0,0|1,0,1]=4 3516 B12R1.20 NC(=O)C(O)c1ccc(F)cc1 Amb18806073 [1,1,0,0,0,0|1,0,1]=4 3517 B12R1.20 NC(=O)C(O)c1ccc(O)cc1 Amb18805580 [1,1,0,0,0,0|1,0,1]=4 3518 B12R1.20 Nc1ccc(C(O)C(Cl)Cl)cc1 Amb27413592 [1,1,0,0,0,0|2,0,0]=4 3519 B12R1.20 Nc1ccc(C(O)C(F)F)cc1 Amb22387865 [1,1,0,0,0,0|2,0,0]=4 3520 B12R1.20 OC(c1ccc(Br)cc1)C(F)F Amb22387863 [1,1,0,0,0,0|2,0,0]=4 3521 B12R1.20 OC(c1ccc(Cl)cc1)C(F)F Amb28145917 [1,1,0,0,0,0|2,0,0]=4 3522 B12R1.20 OC(c1ccc(F)cc1)C(F)Cl Amb28365638 [1,1,0,0,0,0|2,0,0]=4 3523 B12R1.20 OC(c1ccc(F)cc1)C(F)F Amb27655539 [1,1,0,0,0,0|2,0,0]=4 3524 B12R1.20 O[C@@H](c1ccc(F)cc1)C(F)F Amb26328842 [1,1,0,0,0,0|2,0,0]=4 3525 B12R1.20 O[C@H](c1ccc(Br)cc1)C(F)F Amb25083349 [1,1,0,0,0,0|2,0,0]=4 3526 B12R1.20 O[C@H](c1ccc(F)cc1)C(F)F Amb24525137 [1,1,0,0,0,0|2,0,0]=4 3527 B12R1.20 Oc1ccc(C(O)C(F)F)cc1 Amb26979544 [1,1,0,0,0,0|2,0,0]=4 3528 B12R1.124 C=C(C)C(O)c1ccccc1C Amb28366526 [1,1,0,0,0,0|0,0,2]=4 3529 B12R1.124 C=C(C)C(O)c1ccccc1I Amb27840727 [1,1,0,0,0,0|0,0,2]=4 3530 B12R1.124 C=C(C)C(O)c1ccccc1N Amb28385547 [1,1,0,0,0,0|0,0,2]=4 3531 B12R1.124 CC(=O)C(O)c1ccccc1Br Amb26883809 [1,1,0,0,0,0|1,0,1]=4 3532 B12R1.124 CC(=O)C(O)c1ccccc1C Amb25712931 [1,1,0,0,0,0|1,0,1]=4 3533 B12R1.124 CC(=O)C(O)c1ccccc1Cl Amb25248975 [1,1,0,0,0,0|1,0,1]=4 3534 B12R1.124 CC(=O)C(O)c1ccccc1F Amb27177820 [1,1,0,0,0,0|1,0,1]=4 3535 B12R1.124 CC(=O)C(O)c1ccccc1O Amb8395178 [1,1,0,0,0,0|1,0,1]=4 3536 B12R1.124 CC(=O)[C@H](O)c1ccccc1Cl Amb27426617 [1,1,0,0,0,0|1,0,1]=4 3537 B12R1.124 CC(Br)C(C)c1ccccc1Cl Amb27756624 [1,1,0,0,0,0|2,0,0]=4 3538 B12R1.124 CC(Br)C(C)c1ccccc1F Amb27616668 [1,1,0,0,0,0|2,0,0]=4 3539 B12R1.124 CC(C)C(=O)c1ccccc1Br Amb17343722 [1,1,0,0,0,0|0,0,2]=4 3540 B12R1.124 CC(C)C(=O)c1ccccc1Cl Amb17233963 [1,1,0,0,0,0|0,0,2]=4 3541 B12R1.124 CC(C)C(=O)c1ccccc1F Amb17232578 [1,1,0,0,0,0|0,0,2]=4 3542 B12R1.124 CC(C)C(=O)c1ccccc1N Amb18645870 [1,1,0,0,0,0|0,0,2]=4 3543 B12R1.124 CC(C)C(=O)c1ccccc1O Amb17232471 [1,1,0,0,0,0|0,0,2]=4 3544 B12R1.124 CC(C)C(C)c1ccccc1N Amb27803739 [1,1,0,0,0,0|1,0,0]=3 3545 B12R1.124 CC(C)C(C)c1ccccc1O Amb27828944 [1,1,0,0,0,0|1,0,0]=3 3546 B12R1.124 CC(C)C(C)c1cnccc1N Amb28421729 [1,1,0,0,0,0|2,0,0]=4 3547 B12R1.124 CC(C)C(Cl)c1ccccc1Cl Amb27641915 [1,1,0,0,0,0|1,0,0]=3 3548 B12R1.124 CC(C)C(N)c1ccccc1Cl Amb17234043 [1,1,0,0,0,0|1,0,0]=3 3549 B12R1.124 CC(C)C(N)c1ccccc1F Amb17232641 [1,1,0,0,0,0|1,0,0]=3 3550 B12R1.124 CC(C)C(N)c1ccccc1F Amb30982463 [1,1,0,0,0,0|1,0,0]=3 3551 B12R1.124 CC(C)C(N)c1ccccc1N Amb25756091 [1,1,0,0,0,0|1,0,0]=3 3552 B12R1.124 CC(C)C(N)c1ccncc1O Amb28429842 [1,1,0,0,0,0|2,0,0]=4 3553 B12R1.124 CC(C)C(O)c1ccccc1Br Amb26498780 [1,1,0,0,0,0|0,0,0]=2 3554 B12R1.124 CC(C)C(O)c1ccccc1Cl Amb17234163 [1,1,0,0,0,0|0,0,0]=2 3555 B12R1.124 CC(C)C(O)c1ccccc1F Amb17232670 [1,1,0,0,0,0|0,0,0]=2 3556 B12R1.124 CC(C)C(O)c1ccccc1N Amb22059603 [1,1,0,0,0,0|0,0,0]=2 3557 B12R1.124 CC(C)C(O)c1cnccc1Cl Amb10975228 [1,1,0,0,0,0|1,0,0]=3 3558 B12R1.124 CC(C)C(O)c1ncccc1Cl Amb27867290 [1,1,0,0,0,0|1,0,0]=3 3559 B12R1.124 CC(C)C(O)c1ncccc1N Amb35587560 [1,1,0,0,0,0|1,0,0]=3 3560 B12R1.124 CC(C)N(C)c1ccccc1F Amb27595403 [1,1,0,0,0,0|2,0,0]=4 3561 B12R1.124 CC(C)N(C)c1ccccc1N Amb1141202 [1,1,0,0,0,0|2,0,0]=4 3562 B12R1.124 CC(C)N(C)c1ccccc1N Amb28555669 [1,1,0,0,0,0|2,0,0]=4 3563 B12R1.124 CC(C)N(C)c1ccccc1O Amb27227091 [1,1,0,0,0,0|2,0,0]=4 3564 B12R1.124 CC(C)[C@@H](N)c1ccccc1I Amb28398629 [1,1,0,0,0,0|1,0,0]=3 3565 B12R1.124 CC(C)[C@@H](N)c1ccccc1O Amb28040856 [1,1,0,0,0,0|1,0,0]=3 3566 B12R1.124 CC(C)[C@@H](N)c1ccccc1S Amb27175760 [1,1,0,0,0,0|1,0,0]=3 3567 B12R1.124 CC(C)[C@@H](N)c1cccnc1Br Amb27239652 [1,1,0,0,0,0|2,0,0]=4 3568 B12R1.124 CC(C)[C@@H](N)c1cccnc1S Amb27212785 [1,1,0,0,0,0|2,0,0]=4 3569 B12R1.124 CC(C)[C@@H](N)c1ccncc1F Amb27626031 [1,1,0,0,0,0|2,0,0]=4 3570 B12R1.124 CC(C)[C@@H](N)c1ccncc1N Amb28195291 [1,1,0,0,0,0|2,0,0]=4 3571 B12R1.124 CC(C)[C@@H](N)c1cnccc1Br Amb27633919 [1,1,0,0,0,0|2,0,0]=4 3572 B12R1.124 CC(C)[C@@H](N)c1cnccc1Cl Amb27461490 [1,1,0,0,0,0|2,0,0]=4 3573 B12R1.124 CC(C)[C@@H](N)c1cnccc1O Amb27250642 [1,1,0,0,0,0|2,0,0]=4 3574 B12R1.124 CC(C)[C@@H](N)c1ncccc1Br Amb27239727 [1,1,0,0,0,0|2,0,0]=4 3575 B12R1.124 CC(C)[C@@H](N)c1ncccc1N Amb27645294 [1,1,0,0,0,0|2,0,0]=4 3576 B12R1.124 CC(C)[C@H](N)c1ccccc1O Amb27596078 [1,1,0,0,0,0|1,0,0]=3 3577 B12R1.124 CC(C)[C@H](N)c1cccnc1Br Amb27225821 [1,1,0,0,0,0|2,0,0]=4 3578 B12R1.124 CC(C)[C@H](N)c1ccncc1F Amb28364268 [1,1,0,0,0,0|2,0,0]=4 3579 B12R1.124 CC(C)[C@H](N)c1ccncc1N Amb27949130 [1,1,0,0,0,0|2,0,0]=4 3580 B12R1.124 CC(C)[C@H](N)c1ccncc1O Amb27590291 [1,1,0,0,0,0|2,0,0]=4 3581 B12R1.124 CC(C)[C@H](N)c1cnccc1Cl Amb27413541 [1,1,0,0,0,0|2,0,0]=4 3582 B12R1.124 CC(C)[C@H](N)c1cnccc1N Amb27978623 [1,1,0,0,0,0|2,0,0]=4 3583 B12R1.124 CC(C)[C@H](N)c1ncccc1Cl Amb27175541 [1,1,0,0,0,0|2,0,0]=4 3584 B12R1.124 CC(C)[C@H](N)c1ncccc1N Amb27598006 [1,1,0,0,0,0|2,0,0]=4 3585 B12R1.124 CC(C)[C@H](N)c1ncccc1O Amb27440232 [1,1,0,0,0,0|2,0,0]=4 3586 B12R1.124 CC(C)[C@H](O)c1ccccc1Cl Amb27164457 [1,1,0,0,0,0|0,0,0]=2 3587 B12R1.124 CC(Cl)C(C)c1ccccc1Br Amb27594010 [1,1,0,0,0,0|2,0,0]=4 3588 B12R1.124 CC(Cl)C(C)c1ccccc1Cl Amb27594011 [1,1,0,0,0,0|2,0,0]=4 3589 B12R1.124 CC(N)C(=O)c1ccccc1Br Amb18160374 [1,1,0,0,0,0|0,0,2]=4 3590 B12R1.124 CC(N)C(=O)c1ccccc1Cl Amb18823031 [1,1,0,0,0,0|0,0,2]=4 3591 B12R1.124 CC(N)C(=O)c1ccccc1F Amb18827241 [1,1,0,0,0,0|0,0,2]=4 3592 B12R1.124 CC(N)C(=O)c1ccccc1O Amb27598048 [1,1,0,0,0,0|0,0,2]=4 3593 B12R1.124 CC(N)C(C)c1ccccc1Br Amb18161843 [1,1,0,0,0,0|1,0,0]=3 3594 B12R1.124 CC(N)C(C)c1ccccc1Cl Amb18191712 [1,1,0,0,0,0|1,0,0]=3 3595 B12R1.124 CC(N)C(C)c1ccccc1Cl Amb33329029 [1,1,0,0,0,0|1,0,0]=3 3596 B12R1.124 CC(N)C(C)c1ccccc1F Amb18199473 [1,1,0,0,0,0|1,0,0]=3 3597 B12R1.124 CC(N)C(F)c1ccccc1Cl Amb32416322 [1,1,0,0,0,0|1,0,0]=3 3598 B12R1.124 CC(N)C(F)c1ccccc1F Amb27481108 [1,1,0,0,0,0|1,0,0]=3 3599 B12R1.124 CC(N)C(N)c1ccccc1Cl Amb27393092 [1,1,0,0,0,0|1,0,0]=3 3600 B12R1.124 CC(N)C(N)c1ccccc1O Amb28195534 [1,1,0,0,0,0|1,0,0]=3 3601 B12R1.124 CC(N)C(N)c1cccnc1Br Amb27202553 [1,1,0,0,0,0|2,0,0]=4 3602 B12R1.124 CC(N)C(N)c1cccnc1Cl Amb27430423 [1,1,0,0,0,0|2,0,0]=4 3603 B12R1.124 CC(N)C(N)c1cccnc1N Amb28411216 [1,1,0,0,0,0|2,0,0]=4 3604 B12R1.124 CC(N)C(N)c1ccncc1Cl Amb27430291 [1,1,0,0,0,0|2,0,0]=4 3605 B12R1.124 CC(N)C(O)c1ccccc1F Amb19149220 [1,1,0,0,0,0|0,0,0]=2 3606 B12R1.124 CC(N)C(O)c1ccccc1F Amb6740260 [1,1,0,0,0,0|0,0,0]=2 3607 B12R1.124 CC(N)C(O)c1cccnc1Cl Amb28313595 [1,1,0,0,0,0|1,0,0]=3 3608 B12R1.124 CC(N)C(O)c1cccnc1O Amb27430373 [1,1,0,0,0,0|1,0,0]=3 3609 B12R1.124 CC(N)C(O)c1ccncc1F Amb27958802 [1,1,0,0,0,0|1,0,0]=3 3610 B12R1.124 CC(N)C(O)c1ccncc1O Amb27246506 [1,1,0,0,0,0|1,0,0]=3 3611 B12R1.124 CC(N)C(O)c1cnccc1Cl Amb27204808 [1,1,0,0,0,0|1,0,0]=3 3612 B12R1.124 CC(N)C(O)c1cnccc1N Amb35588613 [1,1,0,0,0,0|1,0,0]=3 3613 B12R1.124 CC(N)[C@H](O)c1ccccc1F Amb27587602 [1,1,0,0,0,0|0,0,0]=2 3614 B12R1.124 CC(O)C(C)c1ccccc1Cl Amb25787409 [1,1,0,0,0,0|2,0,0]=4 3615 B12R1.124 CC(O)C(C)c1ccccc1F Amb26370668 [1,1,0,0,0,0|2,0,0]=4 3616 B12R1.124 CC(O)C(C)c1ccccc1N Amb27622706 [1,1,0,0,0,0|2,0,0]=4 3617 B12R1.124 CC(O)C(C)c1ccccc1O Amb24357145 [1,1,0,0,0,0|2,0,0]=4 3618 B12R1.124 CC(O)C(N)c1ccccc1Br Amb27616654 [1,1,0,0,0,0|2,0,0]=4 3619 B12R1.124 CC(O)C(N)c1ccccc1F Amb17232699 [1,1,0,0,0,0|2,0,0]=4 3620 B12R1.124 CC(O)C(N)c1ccccc1S Amb28397891 [1,1,0,0,0,0|2,0,0]=4 3621 B12R1.124 CC(O)C(O)c1ccccc1Cl Amb27615351 [1,1,0,0,0,0|1,0,0]=3 3622 B12R1.124 CC(O)C(O)c1ccccc1F Amb27587585 [1,1,0,0,0,0|1,0,0]=3 3623 B12R1.124 CC(O)[C@@H](N)c1ccccc1Br Amb27851093 [1,1,0,0,0,0|2,0,0]=4 3624 B12R1.124 CC(O)[C@@H](N)c1ccccc1Cl Amb27426818 [1,1,0,0,0,0|2,0,0]=4 3625 B12R1.124 CC(O)[C@@H](N)c1ccccc1I Amb27879756 [1,1,0,0,0,0|2,0,0]=4 3626 B12R1.124 CC(O)[C@@H](N)c1ccccc1O Amb27641226 [1,1,0,0,0,0|2,0,0]=4 3627 B12R1.124 CC(O)[C@H](O)c1ccccc1Br Amb27762698 [1,1,0,0,0,0|1,0,0]=3 3628 B12R1.124 CC(c1ccccc1F)[C@@H](C)N Amb33731278 [1,1,0,0,0,0|1,0,0]=3 3629 B12R1.124 CC(c1ccccc1F)[C@H](C)N Amb33729324 [1,1,0,0,0,0|1,0,0]=3 3630 B12R1.124 CC(c1ccccc1N)N(C)C Amb27790570 [1,1,0,0,0,0|2,0,0]=4 3631 B12R1.124 C[C@@H](N)C(=O)c1ccccc1Cl Amb35738376 [1,1,0,0,0,0|0,0,2]=4 3632 B12R1.124 C[C@@H](N)C(=O)c1ccccc1F Amb35618029 [1,1,0,0,0,0|0,0,2]=4 3633 B12R1.124 C[C@@H](N)C(O)c1ccccc1Cl Amb35624081 [1,1,0,0,0,0|0,0,0]=2 3634 B12R1.124 C[C@@H](N)C(O)c1ccccc1F Amb35624082 [1,1,0,0,0,0|0,0,0]=2 3635 B12R1.124 C[C@@H](N)C(O)c1cccnc1N Amb35738156 [1,1,0,0,0,0|1,0,0]=3 3636 B12R1.124 C[C@@H](N)C(O)c1ccncc1F Amb35738291 [1,1,0,0,0,0|1,0,0]=3 3637 B12R1.124 C[C@@H](N)C(O)c1cnccc1N Amb35738155 [1,1,0,0,0,0|1,0,0]=3 3638 B12R1.124 C[C@@H](N)[C@@H](O)c1ccccc1Br Amb28457568 [1,1,0,0,0,0|0,0,0]=2 3639 B12R1.124 C[C@@H](N)[C@@H](O)c1cccnc1O Amb28384657 [1,1,0,0,0,0|1,0,0]=3 3640 B12R1.124 C[C@@H](N)[C@@H](O)c1ncccc1Cl Amb27848257 [1,1,0,0,0,0|1,0,0]=3 3641 B12R1.124 C[C@@H](N)[C@H](O)c1ccccc1Br Amb28143165 [1,1,0,0,0,0|0,0,0]=2 3642 B12R1.124 C[C@@H](N)[C@H](O)c1ccccc1Cl Amb27789863 [1,1,0,0,0,0|0,0,0]=2 3643 B12R1.124 C[C@@H](N)[C@H](O)c1cccnc1Cl Amb27635085 [1,1,0,0,0,0|1,0,0]=3 3644 B12R1.124 C[C@@H](N)[C@H](O)c1cccnc1O Amb27875523 [1,1,0,0,0,0|1,0,0]=3 3645 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1Cl Amb27172472 [1,1,0,0,0,0|2,0,0]=4 3646 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1S Amb27175583 [1,1,0,0,0,0|2,0,0]=4 3647 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1O Amb27616764 [1,1,0,0,0,0|2,0,0]=4 3648 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1S Amb28322814 [1,1,0,0,0,0|2,0,0]=4 3649 B12R1.124 C[C@@H](c1ccccc1O)N(C)C Amb25094366 [1,1,0,0,0,0|2,0,0]=4 3650 B12R1.124 C[C@@H](c1ccccc1S)N(C)C Amb35789016 [1,1,0,0,0,0|2,0,0]=4 3651 B12R1.124 C[C@@H](c1ccccc1[S-])N(C)C Amb35789785 [1,1,0,0,0,0|2,0,0]=4 3652 B12R1.124 C[C@H](N)C(=O)c1ccccc1Cl Amb35588871 [1,1,0,0,0,0|0,0,2]=4 3653 B12R1.124 C[C@H](N)C(=O)c1ccccc1F Amb30024515 [1,1,0,0,0,0|0,0,2]=4 3654 B12R1.124 C[C@H](N)C(O)c1ccccc1Cl Amb35737919 [1,1,0,0,0,0|0,0,0]=2 3655 B12R1.124 C[C@H](N)C(O)c1ccccc1F Amb35737920 [1,1,0,0,0,0|0,0,0]=2 3656 B12R1.124 C[C@H](N)C(O)c1cccnc1N Amb35738126 [1,1,0,0,0,0|1,0,0]=3 3657 B12R1.124 C[C@H](N)C(O)c1ccncc1F Amb35624442 [1,1,0,0,0,0|1,0,0]=3 3658 B12R1.124 C[C@H](N)C(O)c1cnccc1N Amb35738125 [1,1,0,0,0,0|1,0,0]=3 3659 B12R1.124 C[C@H](N)[C@@H](C)c1ccccc1Br Amb27604475 [1,1,0,0,0,0|1,0,0]=3 3660 B12R1.124 C[C@H](N)[C@@H](N)c1ccccc1F Amb27976136 [1,1,0,0,0,0|1,0,0]=3 3661 B12R1.124 C[C@H](N)[C@@H](N)c1ccccc1O Amb27848258 [1,1,0,0,0,0|1,0,0]=3 3662 B12R1.124 C[C@H](N)[C@@H](N)c1cccnc1Br Amb27804051 [1,1,0,0,0,0|2,0,0]=4 3663 B12R1.124 C[C@H](N)[C@@H](N)c1cccnc1Cl Amb27815445 [1,1,0,0,0,0|2,0,0]=4 3664 B12R1.124 C[C@H](N)[C@@H](N)c1cccnc1F Amb27985383 [1,1,0,0,0,0|2,0,0]=4 3665 B12R1.124 C[C@H](N)[C@@H](N)c1ccncc1Cl Amb27216489 [1,1,0,0,0,0|2,0,0]=4 3666 B12R1.124 C[C@H](N)[C@@H](O)c1ccccc1Br Amb28055995 [1,1,0,0,0,0|0,0,0]=2 3667 B12R1.124 C[C@H](N)[C@@H](O)c1ccccc1Cl Amb28055920 [1,1,0,0,0,0|0,0,0]=2 3668 B12R1.124 C[C@H](N)[C@@H](O)c1ccccc1N Amb27468097 [1,1,0,0,0,0|0,0,0]=2 3669 B12R1.124 C[C@H](N)[C@@H](O)c1cccnc1Cl Amb28055996 [1,1,0,0,0,0|1,0,0]=3 3670 B12R1.124 C[C@H](N)[C@@H](O)c1ncccc1O Amb27201410 [1,1,0,0,0,0|1,0,0]=3 3671 B12R1.124 C[C@H](N)[C@H](O)c1cnccc1Cl Amb27784419 [1,1,0,0,0,0|1,0,0]=3 3672 B12R1.124 C[C@H](N)[C@H](O)c1ncccc1Cl Amb27655740 [1,1,0,0,0,0|1,0,0]=3 3673 B12R1.124 C[C@H](N)[C@H](O)c1ncccc1N Amb27493452 [1,1,0,0,0,0|1,0,0]=3 3674 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1I Amb27616964 [1,1,0,0,0,0|2,0,0]=4 3675 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1N Amb27592430 [1,1,0,0,0,0|2,0,0]=4 3676 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1O Amb27759998 [1,1,0,0,0,0|2,0,0]=4 3677 B12R1.124 C[C@H](O)[C@@H](O)c1ccccc1F Amb28077880 [1,1,0,0,0,0|1,0,0]=3 3678 B12R1.124 C[C@H](c1ccccc1O)N(C)C Amb28250206 [1,1,0,0,0,0|2,0,0]=4 3679 B12R1.124 C[C@H](c1ccccc1S)N(C)C Amb26873337 [1,1,0,0,0,0|2,0,0]=4 3680 B12R1.124 C[C@H](c1ccccc1S)N(C)C Amb33741530 [1,1,0,0,0,0|2,0,0]=4 3681 B12R1.124 C[C@H](c1ccccc1[S-])N(C)C Amb35788778 [1,1,0,0,0,0|2,0,0]=4 3682 B12R1.124 Cc1ccccc1C(=O)C(C)C Amb17232414 [1,1,0,0,0,0|0,0,2]=4 3683 B12R1.124 Cc1ccccc1C(=O)C(C)N Amb18829245 [1,1,0,0,0,0|0,0,2]=4 3684 B12R1.124 Cc1ccccc1C(=O)[C@@H](C)N Amb35618019 [1,1,0,0,0,0|0,0,2]=4 3685 B12R1.124 Cc1ccccc1C(=O)[C@H](C)N Amb30024486 [1,1,0,0,0,0|0,0,2]=4 3686 B12R1.124 Cc1ccccc1C(C)C(C)N Amb24619318 [1,1,0,0,0,0|1,0,0]=3 3687 B12R1.124 Cc1ccccc1C(C)C(C)O Amb26927164 [1,1,0,0,0,0|2,0,0]=4 3688 B12R1.124 Cc1ccccc1C(C)[C@@H](C)N Amb33738430 [1,1,0,0,0,0|1,0,0]=3 3689 B12R1.124 Cc1ccccc1C(C)[C@H](C)N Amb33745246 [1,1,0,0,0,0|1,0,0]=3 3690 B12R1.124 Cc1ccccc1C(N)C(C)C Amb10778308 [1,1,0,0,0,0|1,0,0]=3 3691 B12R1.124 Cc1ccccc1C(N)C(C)F Amb28060998 [1,1,0,0,0,0|2,0,0]=4 3692 B12R1.124 Cc1ccccc1C(O)C(C)C Amb33535019 [1,1,0,0,0,0|0,0,0]=2 3693 B12R1.124 Cc1ccccc1C(O)C(C)O Amb27602103 [1,1,0,0,0,0|1,0,0]=3 3694 B12R1.124 Cc1ccccc1C(O)C(F)F Amb26587243 [1,1,0,0,0,0|2,0,0]=4 3695 B12R1.124 Cc1ccccc1C(O)[C@@H](C)N Amb35617938 [1,1,0,0,0,0|0,0,0]=2 3696 B12R1.124 Cc1ccccc1C(O)[C@H](C)N Amb35588754 [1,1,0,0,0,0|0,0,0]=2 3697 B12R1.124 Cc1ccccc1[C@@H](C)[C@H](C)O Amb27587560 [1,1,0,0,0,0|2,0,0]=4 3698 B12R1.124 Cc1ccccc1[C@@H](N)C(C)O Amb27416719 [1,1,0,0,0,0|2,0,0]=4 3699 B12R1.124 Cc1ccccc1[C@@H](O)C(=N)N Amb27243900 [1,1,0,0,0,0|1,0,1]=4 3700 B12R1.124 Cc1ccccc1[C@H](N)C(C)C Amb27435624 [1,1,0,0,0,0|1,0,0]=3 3701 B12R1.124 Cc1cccnc1C(N)C(C)C Amb18956588 [1,1,0,0,0,0|2,0,0]=4 3702 B12R1.124 Cc1cccnc1[C@@H](O)[C@H](C)N Amb27204867 [1,1,0,0,0,0|1,0,0]=3 3703 B12R1.124 Cc1ccncc1C(C)C(C)N Amb28324982 [1,1,0,0,0,0|2,0,0]=4 3704 B12R1.124 Cc1ccncc1C(O)C(C)C Amb28460971 [1,1,0,0,0,0|1,0,0]=3 3705 B12R1.124 Cc1ccncc1C(O)C(C)N Amb18827552 [1,1,0,0,0,0|1,0,0]=3 3706 B12R1.124 Cc1ccncc1C(O)C(C)O Amb27162020 [1,1,0,0,0,0|2,0,0]=4 3707 B12R1.124 Cc1ccncc1C(O)[C@@H](C)N Amb30024554 [1,1,0,0,0,0|1,0,0]=3 3708 B12R1.124 Cc1ccncc1C(O)[C@H](C)N Amb35737784 [1,1,0,0,0,0|1,0,0]=3 3709 B12R1.124 Cc1ccncc1[C@@H](O)[C@@H](C)N Amb27776967 [1,1,0,0,0,0|1,0,0]=3 3710 B12R1.124 Cc1cnccc1C(O)C(C)N Amb27648341 [1,1,0,0,0,0|1,0,0]=3 3711 B12R1.124 Cc1nccnc1C(O)C(C)C Amb35600808 [1,1,0,0,0,0|2,0,0]=4 3712 B12R1.124 Cc1nccnc1C(O)C(C)N Amb35600810 [1,1,0,0,0,0|2,0,0]=4 3713 B12R1.124 NC(=O)C(O)c1ccccc1Br Amb24123019 [1,1,0,0,0,0|1,0,1]=4 3714 B12R1.124 NC(=O)C(O)c1ccccc1Cl Amb19075671 [1,1,0,0,0,0|1,0,1]=4 3715 B12R1.124 NC(=O)C(O)c1ccccc1F Amb18806074 [1,1,0,0,0,0|1,0,1]=4 3716 B12R1.124 NC(=S)[C@H](O)c1ccccc1F Amb27224935 [1,1,0,0,0,0|1,0,1]=4 3717 B12R1.124 OC(c1ccccc1Br)C(F)F Amb25064949 [1,1,0,0,0,0|2,0,0]=4 3718 B12R1.124 OC(c1ccccc1Cl)C(F)F Amb26585095 [1,1,0,0,0,0|2,0,0]=4 3719 B12R1.124 OC(c1ccccc1F)C(F)F Amb24485539 [1,1,0,0,0,0|2,0,0]=4 3720 B12R1.124 Oc1ccccc1C(O)C(F)F Amb25112530 [1,1,0,0,0,0|2,0,0]=4 3721 B12R1.225 C=C(C)C(O)c1cccc(Br)c1 Amb27485117 [1,1,0,0,0,0|0,0,2]=4 3722 B12R1.225 C=C(C)C(O)c1cccc(Cl)c1 Amb27833255 [1,1,0,0,0,0|0,0,2]=4 3723 B12R1.225 C=C(c1cccc(O)c1)C(C)C Amb27267145 [1,1,0,0,0,0|1,0,1]=4 3724 B12R1.225 CC(=O)C(O)c1cccc(Br)c1 Amb28348599 [1,1,0,0,0,0|1,0,1]=4 3725 B12R1.225 CC(=O)C(O)c1cccc(C)c1 Amb25801127 [1,1,0,0,0,0|1,0,1]=4 3726 B12R1.225 CC(=O)C(O)c1cccc(Cl)c1 Amb17611032 [1,1,0,0,0,0|1,0,1]=4 3727 B12R1.225 CC(=O)C(O)c1cccc(F)c1 Amb24706962 [1,1,0,0,0,0|1,0,1]=4 3728 B12R1.225 CC(=O)C(O)c1cccc(O)c1 Amb17594122 [1,1,0,0,0,0|1,0,1]=4 3729 B12R1.225 CC(=O)[C@@H](O)c1cccc(F)c1 Amb27177649 [1,1,0,0,0,0|1,0,1]=4 3730 B12R1.225 CC(=O)[C@H](O)c1cccc(C)c1 Amb27615519 [1,1,0,0,0,0|1,0,1]=4 3731 B12R1.225 CC(Br)C(C)c1cccc(Br)c1 Amb28457042 [1,1,0,0,0,0|2,0,0]=4 3732 B12R1.225 CC(Br)C(C)c1cccc(F)c1 Amb28189687 [1,1,0,0,0,0|2,0,0]=4 3733 B12R1.225 CC(C)C(=O)c1cccc(Br)c1 Amb2700248 [1,1,0,0,0,0|0,0,2]=4 3734 B12R1.225 CC(C)C(=O)c1cccc(Cl)c1 Amb17233965 [1,1,0,0,0,0|0,0,2]=4 3735 B12R1.225 CC(C)C(=O)c1cccc(F)c1 Amb17232580 [1,1,0,0,0,0|0,0,2]=4 3736 B12R1.225 CC(C)C(=O)c1cccc(I)c1 Amb27408073 [1,1,0,0,0,0|0,0,2]=4 3737 B12R1.225 CC(C)C(=O)c1cccc(N)c1 Amb17138554 [1,1,0,0,0,0|0,0,2]=4 3738 B12R1.225 CC(C)C(=O)c1cccc(N)c1 Amb31156125 [1,1,0,0,0,0|0,0,2]=4 3739 B12R1.225 CC(C)C(Br)c1cncc(Br)c1 Amb23509148 [1,1,0,0,0,0|2,0,0]=4 3740 B12R1.225 CC(C)C(Cl)c1cccc(Br)c1 Amb29880792 [1,1,0,0,0,0|1,0,0]=3 3741 B12R1.225 CC(C)C(Cl)c1cccc(Cl)c1 Amb27450847 [1,1,0,0,0,0|1,0,0]=3 3742 B12R1.225 CC(C)C(Cl)c1cncc(I)c1 Amb27664268 [1,1,0,0,0,0|2,0,0]=4 3743 B12R1.225 CC(C)C(F)c1cccc(O)c1 Amb27946838 [1,1,0,0,0,0|1,0,0]=3 3744 B12R1.225 CC(C)C(N)c1cc(Cl)ccn1 Amb27625941 [1,1,0,0,0,0|2,0,0]=4 3745 B12R1.225 CC(C)C(N)c1cc(I)ccn1 Amb27251776 [1,1,0,0,0,0|2,0,0]=4 3746 B12R1.225 CC(C)C(N)c1cc(N)ccn1 Amb24589619 [1,1,0,0,0,0|2,0,0]=4 3747 B12R1.225 CC(C)C(N)c1cc(O)ccn1 Amb27758813 [1,1,0,0,0,0|2,0,0]=4 3748 B12R1.225 CC(C)C(N)c1cccc(Br)c1 Amb17248094 [1,1,0,0,0,0|1,0,0]=3 3749 B12R1.225 CC(C)C(N)c1cccc(Br)n1 Amb27832835 [1,1,0,0,0,0|2,0,0]=4 3750 B12R1.225 CC(C)C(N)c1cccc(Cl)c1 Amb17234044 [1,1,0,0,0,0|1,0,0]=3 3751 B12R1.225 CC(C)C(N)c1cccc(F)c1 Amb17232648 [1,1,0,0,0,0|1,0,0]=3 3752 B12R1.225 CC(C)C(N)c1cccc(N)n1 Amb25794121 [1,1,0,0,0,0|2,0,0]=4 3753 B12R1.225 CC(C)C(N)c1ccnc(F)c1 Amb27969170 [1,1,0,0,0,0|2,0,0]=4 3754 B12R1.225 CC(C)C(N)c1cncc(Br)c1 Amb23450057 [1,1,0,0,0,0|2,0,0]=4 3755 B12R1.225 CC(C)C(N)c1cncc(F)c1 Amb18954867 [1,1,0,0,0,0|2,0,0]=4 3756 B12R1.225 CC(C)C(O)c1cc(Cl)ccn1 Amb27770742 [1,1,0,0,0,0|1,0,0]=3 3757 B12R1.225 CC(C)C(O)c1cccc(Br)c1 Amb27448275 [1,1,0,0,0,0|0,0,0]=2 3758 B12R1.225 CC(C)C(O)c1cccc(Cl)c1 Amb17234165 [1,1,0,0,0,0|0,0,0]=2 3759 B12R1.225 CC(C)C(O)c1cccc(F)c1 Amb17232672 [1,1,0,0,0,0|0,0,0]=2 3760 B12R1.225 CC(C)C(O)c1cccc(N)c1 Amb27641835 [1,1,0,0,0,0|0,0,0]=2 3761 B12R1.225 CC(C)C(O)c1cccc(N)n1 Amb35743351 [1,1,0,0,0,0|1,0,0]=3 3762 B12R1.225 CC(C)C(O)c1cncc(F)c1 Amb18180200 [1,1,0,0,0,0|1,0,0]=3 3763 B12R1.225 CC(C)N(C)c1cccc(Br)c1 Amb28065636 [1,1,0,0,0,0|2,0,0]=4 3764 B12R1.225 CC(C)N(C)c1cccc(N)c1 Amb33533211 [1,1,0,0,0,0|2,0,0]=4 3765 B12R1.225 CC(C)S(=O)c1cccc(Br)c1 Amb27404633 [1,1,0,0,0,0|1,0,1]=4 3766 B12R1.225 CC(C)S(=O)c1cccc(O)c1 Amb27615454 [1,1,0,0,0,0|1,0,1]=4 3767 B12R1.225 CC(C)[C@@H](N)c1cc(N)ccn1 Amb25112728 [1,1,0,0,0,0|2,0,0]=4 3768 B12R1.225 CC(C)[C@@H](N)c1cccc(Br)c1 Amb10603202 [1,1,0,0,0,0|1,0,0]=3 3769 B12R1.225 CC(C)[C@@H](N)c1cccc(Cl)c1 Amb10603203 [1,1,0,0,0,0|1,0,0]=3 3770 B12R1.225 CC(C)[C@@H](N)c1cccc(N)n1 Amb25059883 [1,1,0,0,0,0|2,0,0]=4 3771 B12R1.225 CC(C)[C@@H](N)c1cncc(Br)c1 Amb27633175 [1,1,0,0,0,0|2,0,0]=4 3772 B12R1.225 CC(C)[C@@H](N)c1cncc(I)c1 Amb28368443 [1,1,0,0,0,0|2,0,0]=4 3773 B12R1.225 CC(C)[C@H](N)c1cc(N)ccn1 Amb25892072 [1,1,0,0,0,0|2,0,0]=4 3774 B12R1.225 CC(C)[C@H](N)c1cc(O)ccn1 Amb28244123 [1,1,0,0,0,0|2,0,0]=4 3775 B12R1.225 CC(C)[C@H](N)c1cccc(Br)c1 Amb10603244 [1,1,0,0,0,0|1,0,0]=3 3776 B12R1.225 CC(C)[C@H](N)c1cccc(N)n1 Amb26450241 [1,1,0,0,0,0|2,0,0]=4 3777 B12R1.225 CC(C)[C@H](N)c1cccc(O)n1 Amb27616913 [1,1,0,0,0,0|2,0,0]=4 3778 B12R1.225 CC(C)[C@H](N)c1cncc(F)c1 Amb27595540 [1,1,0,0,0,0|2,0,0]=4 3779 B12R1.225 CC(C)[C@H](N)c1cncc(N)c1 Amb27468724 [1,1,0,0,0,0|2,0,0]=4 3780 B12R1.225 CC(C)[C@H](O)c1cccc(F)c1 Amb28041989 [1,1,0,0,0,0|0,0,0]=2 3781 B12R1.225 CC(N)C(=O)c1cccc(Br)c1 Amb18160379 [1,1,0,0,0,0|0,0,2]=4 3782 B12R1.225 CC(N)C(=O)c1cccc(Cl)c1 Amb17610845 [1,1,0,0,0,0|0,0,2]=4 3783 B12R1.225 CC(N)C(=O)c1cccc(F)c1 Amb18827240 [1,1,0,0,0,0|0,0,2]=4 3784 B12R1.225 CC(N)C(=O)c1cccc(O)c1 Amb18828422 [1,1,0,0,0,0|0,0,2]=4 3785 B12R1.225 CC(N)C(=O)c1cccc(O)c1 Amb30584924 [1,1,0,0,0,0|0,0,2]=4 3786 B12R1.225 CC(N)C(C)c1cccc(Br)c1 Amb18161825 [1,1,0,0,0,0|1,0,0]=3 3787 B12R1.225 CC(N)C(C)c1cccc(F)c1 Amb18199472 [1,1,0,0,0,0|1,0,0]=3 3788 B12R1.225 CC(N)C(Cl)c1cccc(O)c1 Amb28137937 [1,1,0,0,0,0|1,0,0]=3 3789 B12R1.225 CC(N)C(F)c1cccc(F)c1 Amb27173057 [1,1,0,0,0,0|1,0,0]=3 3790 B12R1.225 CC(N)C(N)c1cccc(Br)c1 Amb27435846 [1,1,0,0,0,0|1,0,0]=3 3791 B12R1.225 CC(N)C(N)c1cccc(I)c1 Amb27810950 [1,1,0,0,0,0|1,0,0]=3 3792 B12R1.225 CC(N)C(O)c1cccc(Cl)c1 Amb6740228 [1,1,0,0,0,0|0,0,0]=2 3793 B12R1.225 CC(N)C(O)c1cccc(Cl)n1 Amb27640568 [1,1,0,0,0,0|1,0,0]=3 3794 B12R1.225 CC(N)C(O)c1cccc(F)c1 Amb20623984 [1,1,0,0,0,0|0,0,0]=2 3795 B12R1.225 CC(N)C(O)c1cccc(F)c1 Amb6740194 [1,1,0,0,0,0|0,0,0]=2 3796 B12R1.225 CC(N)C(O)c1cccc(N)c1 Amb27860244 [1,1,0,0,0,0|0,0,0]=2 3797 B12R1.225 CC(N)C(O)c1cccc(N)n1 Amb28067862 [1,1,0,0,0,0|1,0,0]=3 3798 B12R1.225 CC(N)C(O)c1cccc(O)c1 Amb6740246 [1,1,0,0,0,0|0,0,0]=2 3799 B12R1.225 CC(N)C(O)c1ccnc(Cl)c1 Amb27880600 [1,1,0,0,0,0|1,0,0]=3 3800 B12R1.225 CC(N)C(O)c1cncc(Cl)c1 Amb27430287 [1,1,0,0,0,0|1,0,0]=3 3801 B12R1.225 CC(N)C(O)c1cncc(F)c1 Amb27872773 [1,1,0,0,0,0|1,0,0]=3 3802 B12R1.225 CC(N)[C@@H](O)c1cccc(O)c1 Amb27659013 [1,1,0,0,0,0|0,0,0]=2 3803 B12R1.225 CC(O)C(C)c1cccc(Br)c1 Amb27589264 [1,1,0,0,0,0|2,0,0]=4 3804 B12R1.225 CC(O)C(C)c1cccc(Cl)c1 Amb24363903 [1,1,0,0,0,0|2,0,0]=4 3805 B12R1.225 CC(O)C(C)c1cccc(F)c1 Amb26029050 [1,1,0,0,0,0|2,0,0]=4 3806 B12R1.225 CC(O)C(C)c1cccc(O)c1 Amb25674463 [1,1,0,0,0,0|2,0,0]=4 3807 B12R1.225 CC(O)C(F)c1cccc(Cl)c1 Amb27650355 [1,1,0,0,0,0|2,0,0]=4 3808 B12R1.225 CC(O)C(N)c1cccc(Br)c1 Amb17248845 [1,1,0,0,0,0|2,0,0]=4 3809 B12R1.225 CC(O)C(N)c1cccc(O)c1 Amb27881708 [1,1,0,0,0,0|2,0,0]=4 3810 B12R1.225 CC(O)C(O)c1cccc(Br)c1 Amb30021898 [1,1,0,0,0,0|1,0,0]=3 3811 B12R1.225 CC(O)C(O)c1cccc(Cl)c1 Amb27603861 [1,1,0,0,0,0|1,0,0]=3 3812 B12R1.225 CC(O)[C@@H](N)c1cccc(F)c1 Amb27426651 [1,1,0,0,0,0|2,0,0]=4 3813 B12R1.225 CC(O)[C@@H](N)c1cccc(O)c1 Amb27867399 [1,1,0,0,0,0|2,0,0]=4 3814 B12R1.225 CC(c1cccc(Cl)c1)N(C)C Amb28062172 [1,1,0,0,0,0|2,0,0]=4 3815 B12R1.225 CC(c1cccc(F)c1)[C@@H](C)N Amb33744344 [1,1,0,0,0,0|1,0,0]=3 3816 B12R1.225 CC(c1cccc(F)c1)[C@H](C)N Amb33729335 [1,1,0,0,0,0|1,0,0]=3 3817 B12R1.225 CC(c1cccc(N)c1)N(C)C Amb17090316 [1,1,0,0,0,0|2,0,0]=4 3818 B12R1.225 CC(c1cccc(O)c1)N(C)C Amb32409368 [1,1,0,0,0,0|2,0,0]=4 3819 B12R1.225 CC(c1cccc(O)c1)N(C)C Amb8390926 [1,1,0,0,0,0|2,0,0]=4 3820 B12R1.225 C[C@@H](N)C(=O)c1cccc(Br)c1 Amb35737760 [1,1,0,0,0,0|0,0,2]=4 3821 B12R1.225 C[C@@H](N)C(=O)c1cccc(Cl)c1 Amb35738374 [1,1,0,0,0,0|0,0,2]=4 3822 B12R1.225 C[C@@H](N)C(=O)c1cccc(F)c1 Amb35618030 [1,1,0,0,0,0|0,0,2]=4 3823 B12R1.225 C[C@@H](N)C(O)c1cccc(Br)c1 Amb35624315 [1,1,0,0,0,0|0,0,0]=2 3824 B12R1.225 C[C@@H](N)C(O)c1cccc(Cl)c1 Amb35624302 [1,1,0,0,0,0|0,0,0]=2 3825 B12R1.225 C[C@@H](N)C(O)c1cccc(F)c1 Amb35624089 [1,1,0,0,0,0|0,0,0]=2 3826 B12R1.225 C[C@@H](N)C(O)c1cncc(F)c1 Amb30024563 [1,1,0,0,0,0|1,0,0]=3 3827 B12R1.225 C[C@@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27494050 [1,1,0,0,0,0|0,0,0]=2 3828 B12R1.225 C[C@@H](N)[C@@H](O)c1cccc(Cl)n1 Amb28132403 [1,1,0,0,0,0|1,0,0]=3 3829 B12R1.225 C[C@@H](N)[C@@H](O)c1cccc(N)n1 Amb27626993 [1,1,0,0,0,0|1,0,0]=3 3830 B12R1.225 C[C@@H](N)[C@@H](O)c1ccnc(Cl)c1 Amb27850429 [1,1,0,0,0,0|1,0,0]=3 3831 B12R1.225 C[C@@H](N)[C@@H](O)c1cncc(N)c1 Amb27235969 [1,1,0,0,0,0|1,0,0]=3 3832 B12R1.225 C[C@@H](N)[C@H](O)c1cccc(Cl)c1 Amb28196717 [1,1,0,0,0,0|0,0,0]=2 3833 B12R1.225 C[C@@H](N)[C@H](O)c1cccc(N)n1 Amb27630745 [1,1,0,0,0,0|1,0,0]=3 3834 B12R1.225 C[C@@H](N)[C@H](O)c1cccc(O)c1 Amb25837431 [1,1,0,0,0,0|0,0,0]=2 3835 B12R1.225 C[C@@H](N)[C@H](O)c1cncc(Cl)c1 Amb28055925 [1,1,0,0,0,0|1,0,0]=3 3836 B12R1.225 C[C@@H](N)[C@H](O)c1cncc(N)c1 Amb27437575 [1,1,0,0,0,0|1,0,0]=3 3837 B12R1.225 C[C@@H](N)[C@H](O)c1cncc(O)c1 Amb28384656 [1,1,0,0,0,0|1,0,0]=3 3838 B12R1.225 C[C@@H](O)[C@@H](N)c1cccc(Br)c1 Amb27209517 [1,1,0,0,0,0|2,0,0]=4 3839 B12R1.225 C[C@@H](O)[C@@H](N)c1cccc(F)c1 Amb27228850 [1,1,0,0,0,0|2,0,0]=4 3840 B12R1.225 C[C@@H](O)[C@H](N)c1cccc(I)c1 Amb27392130 [1,1,0,0,0,0|2,0,0]=4 3841 B12R1.225 C[C@@H](O)[C@H](N)c1cccc(O)c1 Amb27464889 [1,1,0,0,0,0|2,0,0]=4 3842 B12R1.225 C[C@@H](c1cccc(O)c1)N(C)C Amb8394839 [1,1,0,0,0,0|2,0,0]=4 3843 B12R1.225 C[C@H](N)C(=O)c1cccc(Br)c1 Amb30024472 [1,1,0,0,0,0|0,0,2]=4 3844 B12R1.225 C[C@H](N)C(=O)c1cccc(Cl)c1 Amb35588869 [1,1,0,0,0,0|0,0,2]=4 3845 B12R1.225 C[C@H](N)C(=O)c1cccc(F)c1 Amb30024516 [1,1,0,0,0,0|0,0,2]=4 3846 B12R1.225 C[C@H](N)C(O)c1cccc(Cl)c1 Amb35618414 [1,1,0,0,0,0|0,0,0]=2 3847 B12R1.225 C[C@H](N)C(O)c1cccc(F)c1 Amb35737929 [1,1,0,0,0,0|0,0,0]=2 3848 B12R1.225 C[C@H](N)C(O)c1cncc(F)c1 Amb35737795 [1,1,0,0,0,0|1,0,0]=3 3849 B12R1.225 C[C@H](N)[C@@H](N)c1cccc(I)c1 Amb28055918 [1,1,0,0,0,0|1,0,0]=3 3850 B12R1.225 C[C@H](N)[C@@H](N)c1cncc(Br)c1 Amb27444844 [1,1,0,0,0,0|2,0,0]=4 3851 B12R1.225 C[C@H](N)[C@@H](O)c1cccc(Br)c1 Amb28422926 [1,1,0,0,0,0|0,0,0]=2 3852 B12R1.225 C[C@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27779818 [1,1,0,0,0,0|0,0,0]=2 3853 B12R1.225 C[C@H](N)[C@@H](O)c1cccc(Cl)n1 Amb28077207 [1,1,0,0,0,0|1,0,0]=3 3854 B12R1.225 C[C@H](N)[C@@H](O)c1cncc(N)c1 Amb28077208 [1,1,0,0,0,0|1,0,0]=3 3855 B12R1.225 C[C@H](N)[C@H](O)c1cccc(Cl)n1 Amb28143181 [1,1,0,0,0,0|1,0,0]=3 3856 B12R1.225 C[C@H](N)[C@H](O)c1cccc(F)c1 Amb28055921 [1,1,0,0,0,0|0,0,0]=2 3857 B12R1.225 C[C@H](N)[C@H](O)c1cccc(O)c1 Amb21855942 [1,1,0,0,0,0|0,0,0]=2 3858 B12R1.225 C[C@H](O)[C@@H](N)c1cccc(I)c1 Amb28388855 [1,1,0,0,0,0|2,0,0]=4 3859 B12R1.225 C[C@H](O)[C@@H](N)c1cccc(N)c1 Amb27170668 [1,1,0,0,0,0|2,0,0]=4 3860 B12R1.225 C[C@H](O)[C@@H](N)c1cccc(O)c1 Amb27461293 [1,1,0,0,0,0|2,0,0]=4 3861 B12R1.225 C[C@H](O)[C@H](N)c1cccc(Br)c1 Amb28323051 [1,1,0,0,0,0|2,0,0]=4 3862 B12R1.225 C[C@H](O)[C@H](N)c1cccc(I)c1 Amb28312972 [1,1,0,0,0,0|2,0,0]=4 3863 B12R1.225 C[C@H](O)[C@H](N)c1cccc(S)c1 Amb27444944 [1,1,0,0,0,0|2,0,0]=4 3864 B12R1.225 C[C@H](c1cccc(O)c1)N(C)C Amb8629049 [1,1,0,0,0,0|2,0,0]=4 3865 B12R1.225 Cc1cc(C(O)C(C)N)ccn1 Amb27430295 [1,1,0,0,0,0|1,0,0]=3 3866 B12R1.225 Cc1cc([C@@H](N)C(C)C)ccn1 Amb28397901 [1,1,0,0,0,0|2,0,0]=4 3867 B12R1.225 Cc1cc([C@H](N)C(C)C)ccn1 Amb27874059 [1,1,0,0,0,0|2,0,0]=4 3868 B12R1.225 Cc1cc([C@H](O)[C@H](C)N)ccn1 Amb27804053 [1,1,0,0,0,0|1,0,0]=3 3869 B12R1.225 Cc1cccc(C(=O)C(C)C)c1 Amb17232416 [1,1,0,0,0,0|0,0,2]=4 3870 B12R1.225 Cc1cccc(C(=O)C(C)N)c1 Amb18829244 [1,1,0,0,0,0|0,0,2]=4 3871 B12R1.225 Cc1cccc(C(=O)[C@@H](C)N)c1 Amb35618018 [1,1,0,0,0,0|0,0,2]=4 3872 B12R1.225 Cc1cccc(C(=O)[C@H](C)N)c1 Amb30024481 [1,1,0,0,0,0|0,0,2]=4 3873 B12R1.225 Cc1cccc(C(C)C(C)O)c1 Amb26933485 [1,1,0,0,0,0|2,0,0]=4 3874 B12R1.225 Cc1cccc(C(N)C(C)C)c1 Amb17232441 [1,1,0,0,0,0|1,0,0]=3 3875 B12R1.225 Cc1cccc(C(N)C(C)C)c1 Amb32662444 [1,1,0,0,0,0|1,0,0]=3 3876 B12R1.225 Cc1cccc(C(N)C(C)C)n1 Amb18828649 [1,1,0,0,0,0|2,0,0]=4 3877 B12R1.225 Cc1cccc(C(N)C(C)C)n1 Amb35746815 [1,1,0,0,0,0|2,0,0]=4 3878 B12R1.225 Cc1cccc(C(N)C(C)N)n1 Amb28077231 [1,1,0,0,0,0|2,0,0]=4 3879 B12R1.225 Cc1cccc(C(O)C(C)C)c1 Amb17232500 [1,1,0,0,0,0|0,0,0]=2 3880 B12R1.225 Cc1cccc(C(O)C(C)N)n1 Amb27848276 [1,1,0,0,0,0|1,0,0]=3 3881 B12R1.225 Cc1cccc(C(O)C(F)F)c1 Amb25760781 [1,1,0,0,0,0|2,0,0]=4 3882 B12R1.225 Cc1cccc(C(O)C(N)=O)c1 Amb18800895 [1,1,0,0,0,0|1,0,1]=4 3883 B12R1.225 Cc1cccc(C(O)[C@@H](C)N)c1 Amb35617940 [1,1,0,0,0,0|0,0,0]=2 3884 B12R1.225 Cc1cccc(C(O)[C@H](C)N)c1 Amb35588756 [1,1,0,0,0,0|0,0,0]=2 3885 B12R1.225 Cc1cccc([C@@H](N)C(C)C)c1 Amb28043055 [1,1,0,0,0,0|1,0,0]=3 3886 B12R1.225 Cc1cccc([C@@H](N)C(C)O)c1 Amb27951576 [1,1,0,0,0,0|2,0,0]=4 3887 B12R1.225 Cc1cccc([C@@H](N)[C@@H](C)O)c1 Amb27483160 [1,1,0,0,0,0|2,0,0]=4 3888 B12R1.225 Cc1cccc([C@@H](N)[C@H](C)O)c1 Amb28282684 [1,1,0,0,0,0|2,0,0]=4 3889 B12R1.225 Cc1cccc([C@H](C)[C@@H](C)O)c1 Amb27775922 [1,1,0,0,0,0|2,0,0]=4 3890 B12R1.225 Cc1cccc([C@H](N)[C@H](C)N)n1 Amb27445488 [1,1,0,0,0,0|2,0,0]=4 3891 B12R1.225 Cc1cccc([C@H](O)[C@H](C)N)n1 Amb28055919 [1,1,0,0,0,0|1,0,0]=3 3892 B12R1.225 Cc1ccnc([C@@H](O)[C@@H](C)N)c1 Amb28422694 [1,1,0,0,0,0|1,0,0]=3 3893 B12R1.225 Cc1ccnc([C@H](N)C(C)C)c1 Amb28201922 [1,1,0,0,0,0|2,0,0]=4 3894 B12R1.225 Cc1cncc(C(C)C(C)N)c1 Amb27219384 [1,1,0,0,0,0|2,0,0]=4 3895 B12R1.225 Cc1cncc(C(Cl)C(C)C)c1 Amb28349071 [1,1,0,0,0,0|2,0,0]=4 3896 B12R1.225 Cc1cncc(C(O)[C@@H](C)N)c1 Amb30024398 [1,1,0,0,0,0|1,0,0]=3 3897 B12R1.225 Cc1cncc(C(O)[C@H](C)N)c1 Amb35617912 [1,1,0,0,0,0|1,0,0]=3 3898 B12R1.225 Cc1cncc([C@H](N)C(C)C)c1 Amb27217289 [1,1,0,0,0,0|2,0,0]=4 3899 B12R1.225 Cc1cncc([C@H](O)[C@H](C)N)c1 Amb27985387 [1,1,0,0,0,0|1,0,0]=3 3900 B12R1.225 Cc1nccc(C(O)C(C)N)n1 Amb27831036 [1,1,0,0,0,0|2,0,0]=4 3901 B12R1.225 N=C(N)C(O)c1cccc(O)c1 Amb27597999 [1,1,0,0,0,0|1,0,1]=4 3902 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [1,1,0,0,0,0|1,0,1]=4 3903 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [1,1,0,0,0,0|1,0,1]=4 3904 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [1,1,0,0,0,0|1,0,1]=4 3905 B12R1.225 NC(=O)[C@@H](O)c1cccc(Cl)c1 Amb27620331 [1,1,0,0,0,0|1,0,1]=4 3906 B12R1.225 Nc1cccc(C(O)C(F)F)c1 Amb22387864 [1,1,0,0,0,0|2,0,0]=4 3907 B12R1.225 OC(c1cccc(Br)c1)C(F)F Amb27459223 [1,1,0,0,0,0|2,0,0]=4 3908 B12R1.225 OC(c1cccc(Cl)c1)C(Cl)Cl Amb4035690 [1,1,0,0,0,0|2,0,0]=4 3909 B12R1.225 OC(c1cccc(Cl)c1)C(F)F Amb26879962 [1,1,0,0,0,0|2,0,0]=4 3910 B12R1.225 OC(c1cccc(F)c1)C(F)F Amb24484243 [1,1,0,0,0,0|2,0,0]=4 3911 B12R1.225 O[C@@H](c1cccc(Cl)c1)C(F)F Amb24492942 [1,1,0,0,0,0|2,0,0]=4 3912 B12R1.225 O[C@@H](c1cccc(F)c1)C(F)F Amb25126958 [1,1,0,0,0,0|2,0,0]=4 3913 B12R1.225 O[C@H](c1cccc(Cl)c1)C(F)F Amb28188378 [1,1,0,0,0,0|2,0,0]=4 3914 B12R1.225 Oc1cccc(C(O)C(F)F)c1 Amb27471601 [1,1,0,0,0,0|2,0,0]=4 3915 B12R1.253 C=C(C)C(C)(O)c1ccccc1 Amb27461845 [1,1,0,0,0,0|0,0,2]=4 3916 B12R1.253 CC(=O)C(C)(O)c1ccccc1 Amb4017345 [1,1,0,0,0,0|1,0,1]=4 3917 B12R1.253 CC(=O)[C@](C)(O)c1ccccc1 Amb28397134 [1,1,0,0,0,0|1,0,1]=4 3918 B12R1.253 CC(Br)C(F)(F)c1ccccc1 Amb33715125 [1,1,0,0,0,0|2,0,0]=4 3919 B12R1.253 CC(C)C(C)(N)c1ccccc1 Amb9676773 [1,1,0,0,0,0|1,0,0]=3 3920 B12R1.253 CC(C)C(C)(N)c1cccnc1 Amb18950471 [1,1,0,0,0,0|2,0,0]=4 3921 B12R1.253 CC(C)C(C)(N)c1ccncc1 Amb27752136 [1,1,0,0,0,0|2,0,0]=4 3922 B12R1.253 CC(C)C(C)(O)c1ccccc1 Amb9676768 [1,1,0,0,0,0|0,0,0]=2 3923 B12R1.253 CC(C)C(C)(O)c1cnccn1 Amb27636806 [1,1,0,0,0,0|2,0,0]=4 3924 B12R1.253 CC(C)C(F)(F)c1ccccc1 Amb19894547 [1,1,0,0,0,0|1,0,0]=3 3925 B12R1.253 CC(C)P(=O)(Cl)c1ccccc1 Amb8392600 [1,1,0,0,0,0|1,0,1]=4 3926 B12R1.253 CC(C)S(=O)(=O)c1ccccc1 Amb4013031 [1,1,0,0,0,0|1,0,1]=4 3927 B12R1.253 CC(C)[C@@](C)(N)c1ccccc1 Amb27425332 [1,1,0,0,0,0|1,0,0]=3 3928 B12R1.253 CC(N)C(C)(C)c1ccccc1 Amb8874338 [1,1,0,0,0,0|1,0,0]=3 3929 B12R1.253 CC(N)C(C)(N)c1ccccc1 Amb27800988 [1,1,0,0,0,0|1,0,0]=3 3930 B12R1.253 CC(N)C(C)(O)c1ccccc1 Amb22460632 [1,1,0,0,0,0|0,0,0]=2 3931 B12R1.253 CC(N)C(C)(O)c1ccccc1 Amb9776230 [1,1,0,0,0,0|0,0,0]=2 3932 B12R1.253 CC(N)C(C)(O)c1cncnc1 Amb28388486 [1,1,0,0,0,0|2,0,0]=4 3933 B12R1.253 CC(N)C(F)(F)c1ccccc1 Amb26371405 [1,1,0,0,0,0|1,0,0]=3 3934 B12R1.253 CC(N)C(F)(F)c1ccccc1 Amb32656105 [1,1,0,0,0,0|1,0,0]=3 3935 B12R1.253 CC(O)(C(=N)N)c1ccccc1 Amb28121082 [1,1,0,0,0,0|1,0,1]=4 3936 B12R1.253 CC(O)(C(=N)N)c1ccccc1 Amb28653074 [1,1,0,0,0,0|1,0,1]=4 3937 B12R1.253 CC(O)(C(N)=O)c1ccccc1 Amb4036096 [1,1,0,0,0,0|1,0,1]=4 3938 B12R1.253 CC(O)(c1ccccc1)C(Cl)Cl Amb27953736 [1,1,0,0,0,0|2,0,0]=4 3939 B12R1.253 CC(O)(c1ccccc1)C(F)F Amb19895456 [1,1,0,0,0,0|2,0,0]=4 3940 B12R1.253 CC(O)C(C)(C)c1ccccc1 Amb18177805 [1,1,0,0,0,0|2,0,0]=4 3941 B12R1.253 CC(O)C(C)(F)c1ccccc1 Amb27651592 [1,1,0,0,0,0|2,0,0]=4 3942 B12R1.253 CC(O)C(C)(O)c1ccncc1 Amb27605415 [1,1,0,0,0,0|2,0,0]=4 3943 B12R1.253 CC(O)C(F)(F)c1ccccc1 Amb27440886 [1,1,0,0,0,0|2,0,0]=4 3944 B12R1.253 C[C@@H](N)C(C)(C)c1ccccc1 Amb25751364 [1,1,0,0,0,0|1,0,0]=3 3945 B12R1.253 C[C@@H](N)C(F)(F)c1ccccc1 Amb33081968 [1,1,0,0,0,0|1,0,0]=3 3946 B12R1.253 C[C@@H](N)[C@@](C)(O)c1ccccc1 Amb25068831 [1,1,0,0,0,0|0,0,0]=2 3947 B12R1.253 C[C@@H](N)[C@@](C)(O)c1ccccc1 Amb33483922 [1,1,0,0,0,0|0,0,0]=2 3948 B12R1.253 C[C@@H](O)C(C)(C)c1ccccc1 Amb24459428 [1,1,0,0,0,0|2,0,0]=4 3949 B12R1.253 C[C@@H](O)C(F)(F)c1ccccc1 Amb33081989 [1,1,0,0,0,0|2,0,0]=4 3950 B12R1.253 C[C@@H](O)[C@@](C)(F)c1ccccc1 Amb28207206 [1,1,0,0,0,0|2,0,0]=4 3951 B12R1.253 C[C@H](N)C(C)(C)c1ccccc1 Amb26517619 [1,1,0,0,0,0|1,0,0]=3 3952 B12R1.253 C[C@H](N)C(C)(F)c1ccccc1 Amb27879624 [1,1,0,0,0,0|1,0,0]=3 3953 B12R1.253 C[C@H](N)C(F)(F)c1ccccc1 Amb33081971 [1,1,0,0,0,0|1,0,0]=3 3954 B12R1.253 C[C@H](N)[C@@](C)(F)c1ccccc1 Amb27865425 [1,1,0,0,0,0|1,0,0]=3 3955 B12R1.253 C[C@H](O)C(C)(C)c1ccccc1 Amb24461815 [1,1,0,0,0,0|2,0,0]=4 3956 B12R1.253 C[C@H](O)C(F)(F)c1ccccc1 Amb33081990 [1,1,0,0,0,0|2,0,0]=4 3957 B12R1.253 NC(=O)C(O)(O)c1ccccc1 Amb27490844 [1,1,0,0,0,0|1,0,1]=4 3958 B12R1.478 C#CC(c1ccccc1)C(C)C Amb33175641 [1,1,0,0,0,0|1,0,0]=3 3959 B12R1.478 C#CC(c1ccccc1)N(C)C Amb27944918 [1,1,0,0,0,0|2,0,0]=4 3960 B12R1.478 C=C(C)C(CO)c1ccccc1 Amb28244414 [1,1,0,0,0,0|0,0,2]=4 3961 B12R1.478 C=CC(c1ccccc1)C(C)C Amb33175609 [1,1,0,0,0,0|1,0,0]=3 3962 B12R1.478 C=CC(c1ccccc1)C(C)O Amb27178553 [1,1,0,0,0,0|2,0,0]=4 3963 B12R1.478 CC(C)C(C#N)c1ccccc1 Amb2721266 [1,1,0,0,0,0|1,0,0]=3 3964 B12R1.478 CC(C)C(C#N)c1cccnc1 Amb18645393 [1,1,0,0,0,0|2,0,0]=4 3965 B12R1.478 CC(C)C(C=O)c1ccccc1 Amb17138541 [1,1,0,0,0,0|0,0,1]=3 3966 B12R1.478 CC(C)C(C=O)c1cccnc1 Amb27669974 [1,1,0,0,0,0|1,0,1]=4 3967 B12R1.478 CC(C)C(CBr)c1ccccc1 Amb17247625 [1,1,0,0,0,0|1,0,0]=3 3968 B12R1.478 CC(C)C(CCl)c1ccccc1 Amb17233967 [1,1,0,0,0,0|1,0,0]=3 3969 B12R1.478 CC(C)C(CN)c1ccccc1 Amb7969584 [1,1,0,0,0,0|1,0,0]=3 3970 B12R1.478 CC(C)C(CN)c1ccccn1 Amb27871121 [1,1,0,0,0,0|2,0,0]=4 3971 B12R1.478 CC(C)C(CN)c1cccnc1 Amb18828697 [1,1,0,0,0,0|2,0,0]=4 3972 B12R1.478 CC(C)C(CN)c1ccncc1 Amb18828696 [1,1,0,0,0,0|2,0,0]=4 3973 B12R1.478 CC(C)C(CO)c1ccccc1 Amb4035405 [1,1,0,0,0,0|0,0,0]=2 3974 B12R1.478 CC(C)C(CO)c1ccccn1 Amb28138646 [1,1,0,0,0,0|1,0,0]=3 3975 B12R1.478 CC(C)C(CS)c1ccccc1 Amb32788900 [1,1,0,0,0,0|0,1,0]=3 3976 B12R1.478 CC(C)C(NN)c1ccccc1 Amb18792589 [1,1,0,0,0,0|1,0,0]=3 3977 B12R1.478 CC(C)C(NN)c1ccccn1 Amb27856588 [1,1,0,0,0,0|2,0,0]=4 3978 B12R1.478 CC(C)C(NN)c1cccnc1 Amb27474026 [1,1,0,0,0,0|2,0,0]=4 3979 B12R1.478 CC(C)C(NO)c1ccccc1 Amb10605007 [1,1,0,0,0,0|0,0,0]=2 3980 B12R1.478 CC(C)N(C=O)c1ccccc1 Amb28384348 [1,1,0,0,0,0|1,0,1]=4 3981 B12R1.478 CC(C)[C@@H](CO)c1ccccc1 Amb27977867 [1,1,0,0,0,0|0,0,0]=2 3982 B12R1.478 CC(C)[C@H](C#N)c1ccccc1 Amb27192718 [1,1,0,0,0,0|1,0,0]=3 3983 B12R1.478 CC(C)[C@H](CN)c1ccccc1 Amb27607076 [1,1,0,0,0,0|1,0,0]=3 3984 B12R1.478 CC(N)C(CN)c1ccccc1 Amb28458249 [1,1,0,0,0,0|1,0,0]=3 3985 B12R1.478 CC(N)\C(=C\Cl)c1ccccc1 Amb24670393 [1,1,0,0,0,0|1,0,1]=4 3986 B12R1.478 CC(O)C(C#N)c1ccccc1 Amb27426780 [1,1,0,0,0,0|2,0,0]=4 3987 B12R1.478 CC(O)C(CO)c1ccccc1 Amb27456543 [1,1,0,0,0,0|1,0,0]=3 3988 B12R1.478 CCC(c1ccccc1)C(C)Br Amb28344759 [1,1,0,0,0,0|2,0,0]=4 3989 B12R1.478 CCC(c1ccccc1)C(C)Cl Amb27650668 [1,1,0,0,0,0|2,0,0]=4 3990 B12R1.478 CCC(c1ccccc1)C(C)N Amb25667182 [1,1,0,0,0,0|1,0,0]=3 3991 B12R1.478 CCC(c1ccccc1)N(C)C Amb26647635 [1,1,0,0,0,0|2,0,0]=4 3992 B12R1.478 CCC(c1ccccc1)[C@@H](C)N Amb33731280 [1,1,0,0,0,0|1,0,0]=3 3993 B12R1.478 CCC(c1ccccc1)[C@H](C)N Amb33729230 [1,1,0,0,0,0|1,0,0]=3 3994 B12R1.478 CCN(c1ccccc1)C(C)C Amb22351908 [1,1,0,0,0,0|2,0,0]=4 3995 B12R1.478 CN(C)C(C#N)c1ccccc1 Amb1397749 [1,1,0,0,0,0|2,0,0]=4 3996 B12R1.478 CN(C)C(C#N)c1ccccc1 Amb17621589 [1,1,0,0,0,0|2,0,0]=4 3997 B12R1.478 CN(C)C(CCl)c1ccccc1 Amb17234042 [1,1,0,0,0,0|2,0,0]=4 3998 B12R1.478 CN(C)C(CN)c1ccccc1 Amb2589501 [1,1,0,0,0,0|2,0,0]=4 3999 B12R1.478 CN(C)C(CO)c1ccccc1 Amb17232542 [1,1,0,0,0,0|1,0,0]=3 4000 B12R1.478 CN(C)C(CO)c1cccnc1 Amb17232604 [1,1,0,0,0,0|2,0,0]=4 4001 B12R1.478 CN(C)[C@H](CN)c1ccccc1 Amb27248292 [1,1,0,0,0,0|2,0,0]=4 4002 B12R1.478 CNC(c1ccccc1)C(C)C Amb9247729 [1,1,0,0,0,0|1,0,0]=3 4003 B12R1.478 CNC(c1cccnc1)C(C)C Amb18968324 [1,1,0,0,0,0|2,0,0]=4 4004 B12R1.478 CN[C@@H](c1ccccc1)[C@@H](C)O Amb27643322 [1,1,0,0,0,0|2,0,0]=4 4005 B12R1.478 CN[C@@H](c1ccccc1)[C@H](C)N Amb27964135 [1,1,0,0,0,0|1,0,0]=3 4006 B12R1.478 COC(=C(C)C)c1ccccc1 Amb28369203 [1,1,0,0,0,0|0,0,2]=4 4007 B12R1.478 COC(C(C)=O)c1ccccc1 Amb33552276 [1,1,0,0,0,0|1,0,1]=4 4008 B12R1.478 COC(C(N)=S)c1ccccc1 Amb27765249 [1,1,0,0,0,0|1,0,1]=4 4009 B12R1.478 COC(c1ccccc1)[C@@H](C)N Amb27169809 [1,1,0,0,0,0|0,0,0]=2 4010 B12R1.478 COC(c1ccncc1)C(C)N Amb18980590 [1,1,0,0,0,0|1,0,0]=3 4011 B12R1.478 CO[C@@H](C(C)=O)c1ccccc1 Amb27749805 [1,1,0,0,0,0|1,0,1]=4 4012 B12R1.478 CO[C@@H](c1ccccc1)[C@@H](C)N Amb27482950 [1,1,0,0,0,0|0,0,0]=2 4013 B12R1.478 CO[C@@H](c1ccccc1)[C@@H](C)O Amb27770924 [1,1,0,0,0,0|1,0,0]=3 4014 B12R1.478 CO[C@H](c1ccccc1)[C@@H](C)Cl Amb27645483 [1,1,0,0,0,0|1,0,0]=3 4015 B12R1.478 CO[C@H](c1ccccc1)[C@@H](C)N Amb28074058 [1,1,0,0,0,0|0,0,0]=2 4016 B12R1.478 CS(=O)C(CO)c1ccccc1 Amb27220636 [1,1,0,0,0,0|2,0,0]=4 4017 B12R1.478 CSC(c1ccncc1)C(C)N Amb18980592 [1,1,0,0,0,0|1,1,0]=4 4018 B12R1.478 C[C@H](O)[C@@H](C#N)c1ccccc1 Amb27753064 [1,1,0,0,0,0|2,0,0]=4 4019 B12R1.478 C[C@H](O)[C@@H](CN)c1ccccc1 Amb27647589 [1,1,0,0,0,0|2,0,0]=4 4020 B12R1.478 NC(=O)C(CO)c1ccccc1 Amb22233190 [1,1,0,0,0,0|1,0,1]=4 4021 B12R1.478 NC(=O)[C@H](NO)c1ccccc1 Amb27400280 [1,1,0,0,0,0|1,0,1]=4 4022 B12R1.478 NC(O)C(C=O)c1ccccc1 Amb27233418 [1,1,0,0,0,0|1,0,1]=4 4023 B12R1.478 [C-]#[N+]C(c1ccccc1)C(C)C Amb33175598 [1,1,0,0,0,0|1,0,0]=3 4024 B12R1.564 C=C(c1ccccc1)C(C)(C)N Amb18645555 [1,1,0,0,0,0|1,0,1]=4 4025 B12R1.564 CC(C)(Br)C(=O)c1ccccc1 Amb8517058 [1,1,0,0,0,0|0,0,2]=4 4026 B12R1.564 CC(C)(C)C(=O)c1ccccc1 Amb2447464 [1,1,0,0,0,0|0,0,2]=4 4027 B12R1.564 CC(C)(C)C(Br)c1ccccc1 Amb25891332 [1,1,0,0,0,0|1,0,0]=3 4028 B12R1.564 CC(C)(C)C(N)c1ccccc1 Amb9717639 [1,1,0,0,0,0|1,0,0]=3 4029 B12R1.564 CC(C)(C)C(N)c1ccccn1 Amb18961432 [1,1,0,0,0,0|2,0,0]=4 4030 B12R1.564 CC(C)(C)C(O)c1ccccc1 Amb2609032 [1,1,0,0,0,0|0,0,0]=2 4031 B12R1.564 CC(C)(C)C(O)c1cccnc1 Amb18792673 [1,1,0,0,0,0|1,0,0]=3 4032 B12R1.564 CC(C)(C)C(O)c1cncnc1 Amb18801095 [1,1,0,0,0,0|2,0,0]=4 4033 B12R1.564 CC(C)(C)N(N)c1ccccc1 Amb18646167 [1,1,0,0,0,0|2,0,0]=4 4034 B12R1.564 CC(C)(C)P(Cl)c1ccccc1 Amb24312773 [1,1,0,0,0,0|2,0,0]=4 4035 B12R1.564 CC(C)(C)S(=O)c1ccccc1 Amb5717905 [1,1,0,0,0,0|1,0,1]=4 4036 B12R1.564 CC(C)(C)[C@@H](N)c1ccccc1 Amb23438853 [1,1,0,0,0,0|1,0,0]=3 4037 B12R1.564 CC(C)(C)[C@@H](N)c1ccccn1 Amb27165709 [1,1,0,0,0,0|2,0,0]=4 4038 B12R1.564 CC(C)(C)[C@@H](O)c1ccccc1 Amb27623938 [1,1,0,0,0,0|0,0,0]=2 4039 B12R1.564 CC(C)(C)[C@H](Cl)c1ccccc1 Amb28119848 [1,1,0,0,0,0|1,0,0]=3 4040 B12R1.564 CC(C)(C)[C@H](N)c1ccccc1 Amb27803717 [1,1,0,0,0,0|1,0,0]=3 4041 B12R1.564 CC(C)(C)[C@H](N)c1cccnc1 Amb28124632 [1,1,0,0,0,0|2,0,0]=4 4042 B12R1.564 CC(C)(C)[C@H](N)c1ccncc1 Amb27970194 [1,1,0,0,0,0|2,0,0]=4 4043 B12R1.564 CC(C)(C)[C@H](O)c1ccccc1 Amb27803654 [1,1,0,0,0,0|0,0,0]=2 4044 B12R1.564 CC(C)(C)[C@H](O)c1ccccn1 Amb27946903 [1,1,0,0,0,0|1,0,0]=3 4045 B12R1.564 CC(C)(C)[S@@+]([O-])c1ccccc1 Amb17844211 [1,1,0,0,0,0|1,0,1]=4 4046 B12R1.564 CC(C)(Cl)C(=O)c1ccccc1 Amb24635603 [1,1,0,0,0,0|0,0,2]=4 4047 B12R1.564 CC(C)(F)C(=O)c1ccccc1 Amb26873387 [1,1,0,0,0,0|0,0,2]=4 4048 B12R1.564 CC(C)(N)C(=O)c1ccccc1 Amb22886199 [1,1,0,0,0,0|0,0,2]=4 4049 B12R1.564 CC(C)(N)C(=O)c1ccccc1 Amb5739564 [1,1,0,0,0,0|0,0,2]=4 4050 B12R1.564 CC(C)(N)C(Cl)c1ccccc1 Amb17594730 [1,1,0,0,0,0|1,0,0]=3 4051 B12R1.564 CC(C)(N)C(F)c1ccccc1 Amb26847827 [1,1,0,0,0,0|1,0,0]=3 4052 B12R1.564 CC(C)(N)C(F)c1ccccc1 Amb32721296 [1,1,0,0,0,0|1,0,0]=3 4053 B12R1.564 CC(C)(N)C(N)c1ccccc1 Amb18646148 [1,1,0,0,0,0|1,0,0]=3 4054 B12R1.564 CC(C)(N)C(O)c1ccccc1 Amb17082094 [1,1,0,0,0,0|0,0,0]=2 4055 B12R1.564 CC(C)(N)C(O)c1ccccn1 Amb17082091 [1,1,0,0,0,0|1,0,0]=3 4056 B12R1.564 CC(C)(N)C(O)c1cccnc1 Amb17082092 [1,1,0,0,0,0|1,0,0]=3 4057 B12R1.564 CC(C)(N)C(O)c1ccncc1 Amb17082093 [1,1,0,0,0,0|1,0,0]=3 4058 B12R1.564 CC(C)(O)C(=O)c1ccccc1 Amb8389373 [1,1,0,0,0,0|0,0,2]=4 4059 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb18646373 [1,1,0,0,0,0|1,0,0]=3 4060 B12R1.564 CC(C)(O)C(N)c1ccccn1 Amb27404488 [1,1,0,0,0,0|2,0,0]=4 4061 B12R1.564 CC(C)(O)C(N)c1cccnc1 Amb18646605 [1,1,0,0,0,0|2,0,0]=4 4062 B12R1.564 CC(C)(O)C(N)c1ccncc1 Amb18827555 [1,1,0,0,0,0|2,0,0]=4 4063 B12R1.564 CC(C)(O)C(O)c1ccccc1 Amb17776964 [1,1,0,0,0,0|0,0,0]=2 4064 B12R1.564 CC(C)(O)C(O)c1cnccn1 Amb27414202 [1,1,0,0,0,0|2,0,0]=4 4065 B12R1.564 CC(C)(O)[C@@H](N)c1ccccc1 Amb23399663 [1,1,0,0,0,0|1,0,0]=3 4066 B12R1.564 CC(C)(O)[C@@H](N)c1ccccc1 Amb27175580 [1,1,0,0,0,0|1,0,0]=3 4067 B12R1.564 CC(C)(O)[C@H](N)c1ccccc1 Amb30874073 [1,1,0,0,0,0|1,0,0]=3 4068 B12R1.564 CC(C)(O)[C@H](O)c1ccccc1 Amb28127029 [1,1,0,0,0,0|0,0,0]=2 4069 B12R1.564 CC(F)(F)C(O)c1ccccc1 Amb27826794 [1,1,0,0,0,0|1,0,0]=3 4070 B12R1.564 CC(c1ccccc1)C(C)(C)C Amb24579473 [1,1,0,0,0,0|1,0,0]=3 4071 B12R1.564 CC(c1ccccc1)C(C)(C)N Amb17594058 [1,1,0,0,0,0|1,0,0]=3 4072 B12R1.564 CC(c1ccccc1)C(C)(C)N Amb22057442 [1,1,0,0,0,0|1,0,0]=3 4073 B12R1.564 CC(c1ccccc1)C(C)(C)O Amb4035991 [1,1,0,0,0,0|1,0,0]=3 4074 B12R1.564 CC(c1ccccc1)[N+](C)(C)C Amb22360591 [1,1,0,0,0,0|2,0,0]=4 4075 B12R1.564 CP(C)(=O)[C@@H](N)c1ccccc1 Amb35788622 [1,1,0,0,0,0|2,0,0]=4 4076 B12R1.564 CP(C)(=O)[C@@H](N)c1ccccc1 Amb35789075 [1,1,0,0,0,0|2,0,0]=4 4077 B12R1.564 CP(C)(=O)[C@H](N)c1ccccc1 Amb35789576 [1,1,0,0,0,0|2,0,0]=4 4078 B12R1.564 CP(C)(=O)[C@H](N)c1ccccc1 Amb35789619 [1,1,0,0,0,0|2,0,0]=4 4079 B12R1.564 C[Si](C)(C)C(Cl)c1ccccc1 Amb27758710 [1,1,0,0,0,0|1,1,0]=4 4080 B12R1.564 C[Si](C)(C)C(O)c1ccccc1 Amb27603455 [1,1,0,0,0,0|0,1,0]=3 4081 B12R1.564 C[Si](C)(C)[C@H](O)c1ccccc1 Amb27587463 [1,1,0,0,0,0|0,1,0]=3 4082 B12R1.564 OC(c1ccccc1)C(Cl)(Cl)Cl Amb2720989 [1,1,0,0,0,0|2,0,0]=4 4083 B12R1.564 OC(c1ccccc1)C(F)(Br)Br Amb32680121 [1,1,0,0,0,0|2,0,0]=4 4084 B12R1.564 OC(c1ccccc1)C(F)(F)Br Amb22008291 [1,1,0,0,0,0|2,0,0]=4 4085 B12R1.564 OC(c1ccccc1)C(F)(F)F Amb2419476 [1,1,0,0,0,0|2,0,0]=4 4086 B12R1.564 O[C@@H](c1ccccc1)C(F)(F)F Amb10838385 [1,1,0,0,0,0|2,0,0]=4 4087 B12R1.564 O[C@H](c1ccccc1)C(F)(F)F Amb10838391 [1,1,0,0,0,0|2,0,0]=4 4088 B12R1.32 CC#CC(C)Oc1ccccc1 Amb25964142 [1,1,0,0,0,0|2,0,0]=4 4089 B12R1.32 CC#CC(Cl)Cc1ccccc1 Amb27232835 [1,1,0,0,0,0|2,0,0]=4 4090 B12R1.32 CC#CC(O)Cc1ccccc1 Amb4034860 [1,1,0,0,0,0|2,0,0]=4 4091 B12R1.32 CC(CCN)Cc1ccccc1 Amb17232439 [1,1,0,0,0,0|1,0,0]=3 4092 B12R1.32 CC(CCN)Oc1ccccc1 Amb17232556 [1,1,0,0,0,0|2,0,0]=4 4093 B12R1.32 CC(CCO)Cc1ccccc1 Amb17232486 [1,1,0,0,0,0|1,0,0]=3 4094 B12R1.32 CC(CCO)Oc1ccccc1 Amb17232598 [1,1,0,0,0,0|2,0,0]=4 4095 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [1,1,0,0,0,0|2,0,0]=4 4096 B12R1.32 CC(CON)Cc1ccccc1 Amb32953166 [1,1,0,0,0,0|2,0,0]=4 4097 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [1,1,0,0,0,0|0,0,2]=4 4098 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [1,1,0,0,0,0|0,0,2]=4 4099 B12R1.32 CC(Cc1ccccc1)NC=O Amb8503525 [1,1,0,0,0,0|0,0,1]=3 4100 B12R1.32 CC(Cc1ccccn1)NC#N Amb35596321 [1,1,0,0,0,0|1,0,1]=4 4101 B12R1.32 CC(Cc1ccccn1)NC=O Amb29889266 [1,1,0,0,0,0|1,0,1]=4 4102 B12R1.32 CCCC(C)Nc1ccccc1 Amb6685188 [1,1,0,0,0,0|2,0,0]=4 4103 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [1,1,0,0,0,0|2,0,0]=4 4104 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [1,1,0,0,0,0|0,0,0]=2 4105 B12R1.32 CCNC(C)Cc1ccccn1 Amb1995151 [1,1,0,0,0,0|1,0,0]=3 4106 B12R1.32 CCNC(C)Cc1cnccn1 Amb1995172 [1,1,0,0,0,0|2,0,0]=4 4107 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [1,1,0,0,0,0|2,0,0]=4 4108 B12R1.32 CN(CCBr)Cc1ccccc1 Amb32882453 [1,1,0,0,0,0|2,0,0]=4 4109 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [1,1,0,0,0,0|2,0,0]=4 4110 B12R1.32 CN(CCCl)Cc1ccccc1 Amb3940690 [1,1,0,0,0,0|2,0,0]=4 4111 B12R1.32 CN(CCN)Cc1ccccc1 Amb5357836 [1,1,0,0,0,0|2,0,0]=4 4112 B12R1.32 CN(CCO)Cc1ccccc1 Amb3938987 [1,1,0,0,0,0|2,0,0]=4 4113 B12R1.32 CN(CCS)Cc1ccccc1 Amb13881720 [1,1,0,0,0,0|2,0,0]=4 4114 B12R1.32 CNCC(=O)Cc1ccccc1 Amb32954289 [1,1,0,0,0,0|1,0,1]=4 4115 B12R1.32 CNCC(=O)Cc1ccccc1 Amb8628392 [1,1,0,0,0,0|1,0,1]=4 4116 B12R1.32 CNCC(C)Cc1ccccc1 Amb19023878 [1,1,0,0,0,0|0,0,0]=2 4117 B12R1.32 CNCC(C)Nc1ccccc1 Amb27955315 [1,1,0,0,0,0|1,0,0]=3 4118 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [1,1,0,0,0,0|1,0,0]=3 4119 B12R1.32 CNCC(O)Cc1ccccc1 Amb17193901 [1,1,0,0,0,0|1,0,0]=3 4120 B12R1.32 CNCC(O)Cc1ccccc1 Amb32661172 [1,1,0,0,0,0|1,0,0]=3 4121 B12R1.32 CNCC(O)Cc1cccnc1 Amb17232605 [1,1,0,0,0,0|2,0,0]=4 4122 B12R1.32 CNC\C(C)=C\c1ccccc1 Amb17100030 [1,1,0,0,0,0|0,0,2]=4 4123 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [1,1,0,0,0,0|2,0,0]=4 4124 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [1,1,0,0,0,0|2,0,0]=4 4125 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb3940159 [1,1,0,0,0,0|2,0,0]=4 4126 B12R1.32 COC[C@@H](N)Cc1ccccc1 Amb4037107 [1,1,0,0,0,0|2,0,0]=4 4127 B12R1.32 COC[C@H](N)Cc1ccccc1 Amb33871543 [1,1,0,0,0,0|2,0,0]=4 4128 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [1,1,0,0,0,0|1,0,1]=4 4129 B12R1.32 CONC(C)Cc1ccccc1 Amb28984063 [1,1,0,0,0,0|0,0,0]=2 4130 B12R1.32 C[C@H](Cc1ccccc1)NC=S Amb27209575 [1,1,0,0,0,0|0,0,1]=3 4131 B12R1.32 C\C(=C\CO)Cc1ccccc1 Amb27852825 [1,1,0,0,0,0|1,0,1]=4 4132 B12R1.32 C\C=C\C(C)Nc1ccccc1 Amb28245278 [1,1,0,0,0,0|2,0,0]=4 4133 B12R1.32 C\C=C\C(O)Cc1ccccc1 Amb27641998 [1,1,0,0,0,0|2,0,0]=4 4134 B12R1.32 NC(CCO)Cc1ccccc1 Amb28872403 [1,1,0,0,0,0|2,0,0]=4 4135 B12R1.32 NC(CCO)Cc1ccccc1 Amb8392175 [1,1,0,0,0,0|2,0,0]=4 4136 B12R1.32 NCCC(F)Cc1ccccc1 Amb32954290 [1,1,0,0,0,0|2,0,0]=4 4137 B12R1.32 NCCC(N)Cc1ccccc1 Amb33039576 [1,1,0,0,0,0|2,0,0]=4 4138 B12R1.32 NCCC(O)Cc1ccccc1 Amb17232552 [1,1,0,0,0,0|2,0,0]=4 4139 B12R1.32 NCC[C@@H](O)Cc1ccccc1 Amb32953160 [1,1,0,0,0,0|2,0,0]=4 4140 B12R1.32 NCC[C@H](O)Cc1ccccc1 Amb32953161 [1,1,0,0,0,0|2,0,0]=4 4141 B12R1.32 O=C(Cc1ccccc1)NCO Amb2720941 [1,1,0,0,0,0|1,0,1]=4 4142 B12R1.32 OCNC(=S)Cc1ccccc1 Amb27438465 [1,1,0,0,0,0|1,0,1]=4 4143 B12R1.43 C=C(C)C(C)Nc1ccccc1 Amb28368457 [1,1,0,0,0,0|2,0,0]=4 4144 B12R1.43 C=C(C)C(N)Cc1ccccc1 Amb28056790 [1,1,0,0,0,0|2,0,0]=4 4145 B12R1.43 C=C(C)[C@@H](N)Cc1ccccc1 Amb28250037 [1,1,0,0,0,0|2,0,0]=4 4146 B12R1.43 CC(=O)C(Br)Cc1ccccc1 Amb17507835 [1,1,0,0,0,0|2,0,0]=4 4147 B12R1.43 CC(=O)C(C)Cc1ccccc1 Amb17232407 [1,1,0,0,0,0|1,0,0]=3 4148 B12R1.43 CC(=O)C(C)Cc1ccccn1 Amb27231621 [1,1,0,0,0,0|2,0,0]=4 4149 B12R1.43 CC(=O)C(C)Cc1cccnc1 Amb27960854 [1,1,0,0,0,0|2,0,0]=4 4150 B12R1.43 CC(=O)C(C)Nc1ccccc1 Amb28246424 [1,1,0,0,0,0|2,0,0]=4 4151 B12R1.43 CC(=O)C(C)Oc1ccccc1 Amb2439364 [1,1,0,0,0,0|2,0,0]=4 4152 B12R1.43 CC(=O)C(C)Sc1ccccc1 Amb9269983 [1,1,0,0,0,0|2,0,0]=4 4153 B12R1.43 CC(=O)C(Cl)Cc1ccccc1 Amb17204329 [1,1,0,0,0,0|2,0,0]=4 4154 B12R1.43 CC(=O)C(F)Cc1ccccc1 Amb27453671 [1,1,0,0,0,0|2,0,0]=4 4155 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb1099237 [1,1,0,0,0,0|2,0,0]=4 4156 B12R1.43 CC(=O)C(N)Cc1ccccc1 Amb2600540 [1,1,0,0,0,0|2,0,0]=4 4157 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [1,1,0,0,0,0|2,0,0]=4 4158 B12R1.43 CC(=O)N(C)Cc1ccccc1 Amb3886652 [1,1,0,0,0,0|2,0,0]=4 4159 B12R1.43 CC(=O)[C@@H](C)Cc1cccnc1 Amb27177781 [1,1,0,0,0,0|2,0,0]=4 4160 B12R1.43 CC(=O)[C@@H](N)Cc1ccccc1 Amb27874005 [1,1,0,0,0,0|2,0,0]=4 4161 B12R1.43 CC(=O)[C@H](N)Cc1ccccc1 Amb35588699 [1,1,0,0,0,0|2,0,0]=4 4162 B12R1.43 CC(C)C(C)Nc1ccccc1 Amb6685131 [1,1,0,0,0,0|2,0,0]=4 4163 B12R1.43 CC(C)C(N)Cc1ccccc1 Amb17138565 [1,1,0,0,0,0|2,0,0]=4 4164 B12R1.43 CC(C)C(O)Cc1ccccc1 Amb17138584 [1,1,0,0,0,0|2,0,0]=4 4165 B12R1.43 CC(C)[C@@H](N)Cc1ccccc1 Amb27858881 [1,1,0,0,0,0|2,0,0]=4 4166 B12R1.43 CC(C)[C@@H](O)Cc1ccccc1 Amb28244375 [1,1,0,0,0,0|2,0,0]=4 4167 B12R1.43 CC(C)[C@H](C)Nc1ccccc1 Amb27482555 [1,1,0,0,0,0|2,0,0]=4 4168 B12R1.43 CC(C)[C@H](N)Cc1ccccc1 Amb28127185 [1,1,0,0,0,0|2,0,0]=4 4169 B12R1.43 CC(Cc1ccccc1)C(=O)Cl Amb5744098 [1,1,0,0,0,0|2,0,0]=4 4170 B12R1.43 CC(Cc1ccccc1)C(=O)O Amb3939940 [1,1,0,0,0,0|2,0,0]=4 4171 B12R1.43 CC(Cc1ccccc1)C(N)=O Amb2701804 [1,1,0,0,0,0|2,0,0]=4 4172 B12R1.43 CC(Cc1ccccc1)[N+](=O)[O-] Amb17689219 [1,1,0,0,0,0|1,0,1]=4 4173 B12R1.43 CC(Cl)C(Cl)Cc1ccccc1 Amb27947452 [1,1,0,0,0,0|2,0,0]=4 4174 B12R1.43 CC(F)C(N)Cc1ccccc1 Amb27489717 [1,1,0,0,0,0|2,0,0]=4 4175 B12R1.43 CC(N)C(C)Cc1cccnc1 Amb27436524 [1,1,0,0,0,0|2,0,0]=4 4176 B12R1.43 CC(N)C(C)Cc1ccncc1 Amb18828714 [1,1,0,0,0,0|2,0,0]=4 4177 B12R1.43 CC(N)C(C)Nc1ccccc1 Amb18646160 [1,1,0,0,0,0|2,0,0]=4 4178 B12R1.43 CC(N)C(C)Oc1ccccc1 Amb18291409 [1,1,0,0,0,0|2,0,0]=4 4179 B12R1.43 CC(N)C(C)Sc1ccccc1 Amb18648553 [1,1,0,0,0,0|2,0,0]=4 4180 B12R1.43 CC(N)C(N)Cc1ccccc1 Amb28325649 [1,1,0,0,0,0|2,0,0]=4 4181 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [1,1,0,0,0,0|2,0,0]=4 4182 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb30584971 [1,1,0,0,0,0|2,0,0]=4 4183 B12R1.43 CC(O)C(C)Cc1ccccc1 Amb17232485 [1,1,0,0,0,0|1,0,0]=3 4184 B12R1.43 CC(O)C(C)Cc1ccccn1 Amb24341829 [1,1,0,0,0,0|2,0,0]=4 4185 B12R1.43 CC(O)C(C)Cc1cccnc1 Amb27630237 [1,1,0,0,0,0|2,0,0]=4 4186 B12R1.43 CC(O)C(C)Cc1ccncc1 Amb25710238 [1,1,0,0,0,0|2,0,0]=4 4187 B12R1.43 CC(O)C(C)Oc1ccccc1 Amb18801039 [1,1,0,0,0,0|2,0,0]=4 4188 B12R1.43 CC(O)C(C)Sc1ccccc1 Amb27165940 [1,1,0,0,0,0|2,0,0]=4 4189 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [1,1,0,0,0,0|2,0,0]=4 4190 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb32661717 [1,1,0,0,0,0|2,0,0]=4 4191 B12R1.43 CC(O)[C@@H](C)Cc1cccnc1 Amb28455142 [1,1,0,0,0,0|2,0,0]=4 4192 B12R1.43 CC(O)[C@H](C)Cc1ccccc1 Amb27761643 [1,1,0,0,0,0|1,0,0]=3 4193 B12R1.43 CC(Oc1ccccc1)[C@@H](C)N Amb27177950 [1,1,0,0,0,0|2,0,0]=4 4194 B12R1.43 CC(Oc1ccccc1)[C@@H](C)O Amb27238389 [1,1,0,0,0,0|2,0,0]=4 4195 B12R1.43 CC(Oc1ccccc1)[C@H](C)O Amb27876377 [1,1,0,0,0,0|2,0,0]=4 4196 B12R1.43 CN(C)C(=O)Cc1ccccc1 Amb1803686 [1,1,0,0,0,0|1,0,1]=4 4197 B12R1.43 CN(C)C(=S)Cc1ccccc1 Amb1078624 [1,1,0,0,0,0|1,0,1]=4 4198 B12R1.43 CN(O)C(=O)Cc1ccccc1 Amb27622562 [1,1,0,0,0,0|1,0,1]=4 4199 B12R1.43 C[C@@H](Cc1ccccc1)C(=O)O Amb10844540 [1,1,0,0,0,0|2,0,0]=4 4200 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [1,1,0,0,0,0|0,0,0]=2 4201 B12R1.43 C[C@@H](Cl)[C@@H](C)Sc1ccccc1 Amb27947490 [1,1,0,0,0,0|2,0,0]=4 4202 B12R1.43 C[C@@H](N)C(O)Cc1ccccc1 Amb35618099 [1,1,0,0,0,0|2,0,0]=4 4203 B12R1.43 C[C@@H](N)[C@@H](C)Nc1ccccc1 Amb27394625 [1,1,0,0,0,0|2,0,0]=4 4204 B12R1.43 C[C@@H](O)[C@H](O)Cc1ccccc1 Amb28401092 [1,1,0,0,0,0|2,0,0]=4 4205 B12R1.43 C[C@H](Cc1ccccc1)C(=O)O Amb10844541 [1,1,0,0,0,0|2,0,0]=4 4206 B12R1.43 C[C@H](Cc1ccccc1)C(N)=O Amb28319376 [1,1,0,0,0,0|2,0,0]=4 4207 B12R1.43 C[C@H](N)C(O)Cc1ccccc1 Amb35738417 [1,1,0,0,0,0|2,0,0]=4 4208 B12R1.43 C[C@H](Nc1ccccc1)[C@@H](C)O Amb27225799 [1,1,0,0,0,0|2,0,0]=4 4209 B12R1.43 C[C@H](O)[C@@H](C)Cc1ccccc1 Amb27207474 [1,1,0,0,0,0|1,0,0]=3 4210 B12R1.49 CC(C#N)Cc1ccc(Br)cc1 Amb24540446 [1,1,0,0,0,0|2,0,0]=4 4211 B12R1.49 CC(C#N)Cc1ccc(Cl)cc1 Amb28136200 [1,1,0,0,0,0|2,0,0]=4 4212 B12R1.49 CC(C#N)Cc1ccc(F)cc1 Amb25050633 [1,1,0,0,0,0|2,0,0]=4 4213 B12R1.49 CC(C#N)Cc1ccc(O)cc1 Amb4020113 [1,1,0,0,0,0|2,0,0]=4 4214 B12R1.49 CC(C=O)Cc1ccc(Br)cc1 Amb25060263 [1,1,0,0,0,0|2,0,0]=4 4215 B12R1.49 CC(C=O)Cc1ccc(Cl)cc1 Amb18648716 [1,1,0,0,0,0|2,0,0]=4 4216 B12R1.49 CC(C=O)Cc1ccc(F)cc1 Amb26011993 [1,1,0,0,0,0|2,0,0]=4 4217 B12R1.49 CC(C=O)Cc1ccc(I)cc1 Amb28187361 [1,1,0,0,0,0|2,0,0]=4 4218 B12R1.49 CC(C=O)Cc1ccc(N)cc1 Amb27398345 [1,1,0,0,0,0|2,0,0]=4 4219 B12R1.49 CC(CBr)Cc1ccc(Br)cc1 Amb25366059 [1,1,0,0,0,0|2,0,0]=4 4220 B12R1.49 CC(CBr)Cc1ccc(Cl)cc1 Amb25874244 [1,1,0,0,0,0|2,0,0]=4 4221 B12R1.49 CC(CBr)Cc1ccc(F)cc1 Amb25115291 [1,1,0,0,0,0|2,0,0]=4 4222 B12R1.49 CC(CBr)Cc1ccc(I)cc1 Amb26510549 [1,1,0,0,0,0|2,0,0]=4 4223 B12R1.49 CC(CBr)Cc1ccc(O)cc1 Amb25892811 [1,1,0,0,0,0|2,0,0]=4 4224 B12R1.49 CC(CCl)Cc1ccc(Br)cc1 Amb27956125 [1,1,0,0,0,0|2,0,0]=4 4225 B12R1.49 CC(CCl)Cc1ccc(Cl)cc1 Amb26841031 [1,1,0,0,0,0|2,0,0]=4 4226 B12R1.49 CC(CCl)Cc1ccc(F)cc1 Amb27669774 [1,1,0,0,0,0|2,0,0]=4 4227 B12R1.49 CC(CCl)Cc1ccc(I)cc1 Amb26040389 [1,1,0,0,0,0|2,0,0]=4 4228 B12R1.49 CC(CCl)Cc1ccc(O)cc1 Amb25892809 [1,1,0,0,0,0|2,0,0]=4 4229 B12R1.49 CC(CN)Cc1ccc(Cl)cc1 Amb5743848 [1,1,0,0,0,0|2,0,0]=4 4230 B12R1.49 CC(CN)Cc1ccc(F)cc1 Amb5743841 [1,1,0,0,0,0|2,0,0]=4 4231 B12R1.49 CC(CO)Cc1ccc(Br)cc1 Amb27794524 [1,1,0,0,0,0|2,0,0]=4 4232 B12R1.49 CC(CO)Cc1ccc(Cl)cc1 Amb26398800 [1,1,0,0,0,0|2,0,0]=4 4233 B12R1.49 CC(CO)Cc1ccc(F)cc1 Amb26963530 [1,1,0,0,0,0|2,0,0]=4 4234 B12R1.49 CC(Cc1ccc(Br)cc1)NN Amb27832297 [1,1,0,0,0,0|1,0,0]=3 4235 B12R1.49 CC(Cc1ccc(Cl)cc1)NO Amb27751580 [1,1,0,0,0,0|1,0,0]=3 4236 B12R1.49 CC(Cc1ccc(F)cc1)NO Amb28255996 [1,1,0,0,0,0|1,0,0]=3 4237 B12R1.49 CCC(C)Nc1ccc(Br)cc1 Amb6696561 [1,1,0,0,0,0|2,0,0]=4 4238 B12R1.49 CCC(C)Nc1ccc(C)cc1 Amb6700867 [1,1,0,0,0,0|2,0,0]=4 4239 B12R1.49 CCC(C)Nc1ccc(Cl)cc1 Amb6695985 [1,1,0,0,0,0|2,0,0]=4 4240 B12R1.49 CCC(C)Nc1ccc(F)cc1 Amb6696817 [1,1,0,0,0,0|2,0,0]=4 4241 B12R1.49 CCC(C)Nc1ccc(N)cc1 Amb7767483 [1,1,0,0,0,0|2,0,0]=4 4242 B12R1.49 CCC(C)Oc1ccc(Br)cc1 Amb6740546 [1,1,0,0,0,0|2,0,0]=4 4243 B12R1.49 CCC(C)Oc1ccc(Cl)cc1 Amb8629128 [1,1,0,0,0,0|2,0,0]=4 4244 B12R1.49 CCC(C)Oc1ccc(I)cc1 Amb27753794 [1,1,0,0,0,0|2,0,0]=4 4245 B12R1.49 CCC(C)Oc1ccc(N)cc1 Amb9702228 [1,1,0,0,0,0|2,0,0]=4 4246 B12R1.49 CCC(C)Oc1ccc(O)cc1 Amb8837279 [1,1,0,0,0,0|2,0,0]=4 4247 B12R1.49 CCC(Cl)Cc1ccc(C)cc1 Amb17477426 [1,1,0,0,0,0|2,0,0]=4 4248 B12R1.49 CCC(N)Cc1ccc(Br)cc1 Amb28555695 [1,1,0,0,0,0|2,0,0]=4 4249 B12R1.49 CCC(N)Cc1ccc(Br)cc1 Amb9428935 [1,1,0,0,0,0|2,0,0]=4 4250 B12R1.49 CCC(N)Cc1ccc(C)cc1 Amb9428909 [1,1,0,0,0,0|2,0,0]=4 4251 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [1,1,0,0,0,0|2,0,0]=4 4252 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb9428934 [1,1,0,0,0,0|2,0,0]=4 4253 B12R1.49 CCC(N)Cc1ccc(F)cc1 Amb28555694 [1,1,0,0,0,0|2,0,0]=4 4254 B12R1.49 CCC(N)Cc1ccc(F)cc1 Amb9428931 [1,1,0,0,0,0|2,0,0]=4 4255 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [1,1,0,0,0,0|2,0,0]=4 4256 B12R1.49 CCC(N)Cc1ccc(O)cc1 Amb33552371 [1,1,0,0,0,0|2,0,0]=4 4257 B12R1.49 CCC(N)Cc1ccc(O)cc1 Amb9428939 [1,1,0,0,0,0|2,0,0]=4 4258 B12R1.49 CCC(O)Cc1ccc(Br)cc1 Amb17477579 [1,1,0,0,0,0|2,0,0]=4 4259 B12R1.49 CCC(O)Cc1ccc(C)cc1 Amb17138583 [1,1,0,0,0,0|2,0,0]=4 4260 B12R1.49 CCC(O)Cc1ccc(Cl)cc1 Amb17139103 [1,1,0,0,0,0|2,0,0]=4 4261 B12R1.49 CCC(O)Cc1ccc(F)cc1 Amb17138637 [1,1,0,0,0,0|2,0,0]=4 4262 B12R1.49 CCC(O)Cc1ccc(N)cc1 Amb35588641 [1,1,0,0,0,0|2,0,0]=4 4263 B12R1.49 CCC(O)Cc1ccc(O)cc1 Amb28239277 [1,1,0,0,0,0|2,0,0]=4 4264 B12R1.49 CCN(C)Cc1ccc(C)cc1 Amb28316304 [1,1,0,0,0,0|2,0,0]=4 4265 B12R1.49 CCN(C)Cc1ccc(N)cc1 Amb20622466 [1,1,0,0,0,0|2,0,0]=4 4266 B12R1.49 CCN(C)Cc1ccc(N)cc1 Amb8890384 [1,1,0,0,0,0|2,0,0]=4 4267 B12R1.49 CCN(C)Cc1ccc(O)cc1 Amb27198412 [1,1,0,0,0,0|2,0,0]=4 4268 B12R1.49 CC[C@@H](C)Cc1ccc(O)cc1 Amb27806960 [1,1,0,0,0,0|1,0,0]=3 4269 B12R1.49 CC[C@@H](N)Cc1ccc(Br)cc1 Amb27830392 [1,1,0,0,0,0|2,0,0]=4 4270 B12R1.49 CC[C@H](C)Cc1ccc(N)cc1 Amb27411906 [1,1,0,0,0,0|1,0,0]=3 4271 B12R1.49 CC[C@H](C)Cc1ccc(O)cc1 Amb27267991 [1,1,0,0,0,0|1,0,0]=3 4272 B12R1.49 CC[C@H](N)Cc1ccc(Br)cc1 Amb27840450 [1,1,0,0,0,0|2,0,0]=4 4273 B12R1.49 CC[C@H](N)Cc1ccc(C)cc1 Amb28203344 [1,1,0,0,0,0|2,0,0]=4 4274 B12R1.49 CNC(=N)Cc1ccc(O)cc1 Amb28244254 [1,1,0,0,0,0|1,0,1]=4 4275 B12R1.49 CNC(=O)Cc1ccc(Br)cc1 Amb2631901 [1,1,0,0,0,0|1,0,1]=4 4276 B12R1.49 CNC(=O)Cc1ccc(C)cc1 Amb1795465 [1,1,0,0,0,0|1,0,1]=4 4277 B12R1.49 CNC(=O)Cc1ccc(Cl)cc1 Amb3886814 [1,1,0,0,0,0|1,0,1]=4 4278 B12R1.49 CNC(=O)Cc1ccc(N)cc1 Amb1117771 [1,1,0,0,0,0|1,0,1]=4 4279 B12R1.49 CNC(=O)Cc1ccc(N)cc1 Amb15740907 [1,1,0,0,0,0|1,0,1]=4 4280 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [1,1,0,0,0,0|1,0,1]=4 4281 B12R1.49 CNC(C)Cc1ccc(C)cc1 Amb5735453 [1,1,0,0,0,0|0,0,0]=2 4282 B12R1.49 CNC(C)Cc1ccc(C)cn1 Amb28069922 [1,1,0,0,0,0|1,0,0]=3 4283 B12R1.49 CNC(C)Cc1ccc(Cl)cc1 Amb5735461 [1,1,0,0,0,0|0,0,0]=2 4284 B12R1.49 CNC(C)Cc1ccc(F)cc1 Amb22055302 [1,1,0,0,0,0|0,0,0]=2 4285 B12R1.49 CNC(C)Cc1ccc(F)cc1 Amb33535054 [1,1,0,0,0,0|0,0,0]=2 4286 B12R1.49 CNC(C)Cc1ccc(I)cc1 Amb27270762 [1,1,0,0,0,0|0,0,0]=2 4287 B12R1.49 CNC(C)Cc1ccc(N)cc1 Amb18050449 [1,1,0,0,0,0|0,0,0]=2 4288 B12R1.49 CNC(C)Cc1ccc(O)cc1 Amb33513044 [1,1,0,0,0,0|0,0,0]=2 4289 B12R1.49 CN[C@@H](C)Cc1ccc(C)cc1 Amb28121130 [1,1,0,0,0,0|0,0,0]=2 4290 B12R1.49 CON(C)Cc1ccc(F)cc1 Amb28382005 [1,1,0,0,0,0|2,0,0]=4 4291 B12R1.49 C[C@@H](CN)Cc1ccc(F)cc1 Amb33738467 [1,1,0,0,0,0|2,0,0]=4 4292 B12R1.49 C[C@@H](CO)Cc1ccc(F)cc1 Amb27150747 [1,1,0,0,0,0|2,0,0]=4 4293 B12R1.49 C[C@H](CN)Cc1ccc(F)cc1 Amb33737554 [1,1,0,0,0,0|2,0,0]=4 4294 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [1,1,0,0,0,0|2,0,0]=4 4295 B12R1.49 Cc1ccc(CC(C)C#N)cc1 Amb27411548 [1,1,0,0,0,0|2,0,0]=4 4296 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [1,1,0,0,0,0|2,0,0]=4 4297 B12R1.49 Cc1ccc(CC(C)CBr)cc1 Amb25152481 [1,1,0,0,0,0|2,0,0]=4 4298 B12R1.49 Cc1ccc(CC(C)CCl)cc1 Amb24390124 [1,1,0,0,0,0|2,0,0]=4 4299 B12R1.49 Cc1ccc(CC(C)CN)cc1 Amb5743839 [1,1,0,0,0,0|2,0,0]=4 4300 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [1,1,0,0,0,0|2,0,0]=4 4301 B12R1.49 Cc1ccc(CC(C)NO)cc1 Amb27602730 [1,1,0,0,0,0|1,0,0]=3 4302 B12R1.49 Cc1ccc(C[C@@H](C)CN)cc1 Amb33732141 [1,1,0,0,0,0|2,0,0]=4 4303 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [1,1,0,0,0,0|2,0,0]=4 4304 B12R1.49 Cc1ccc(C[C@H](C)CN)cc1 Amb33737241 [1,1,0,0,0,0|2,0,0]=4 4305 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [1,1,0,0,0,0|2,0,0]=4 4306 B12R1.50 CC(C#N)Cc1cccc(Br)c1 Amb25159927 [1,1,0,0,0,0|2,0,0]=4 4307 B12R1.50 CC(C#N)Cc1cccc(Cl)c1 Amb25762801 [1,1,0,0,0,0|2,0,0]=4 4308 B12R1.50 CC(C#N)Cc1cccc(F)c1 Amb26037905 [1,1,0,0,0,0|2,0,0]=4 4309 B12R1.50 CC(C=O)Cc1cccc(Br)c1 Amb26348210 [1,1,0,0,0,0|2,0,0]=4 4310 B12R1.50 CC(C=O)Cc1cccc(F)c1 Amb25885683 [1,1,0,0,0,0|2,0,0]=4 4311 B12R1.50 CC(C=O)Cc1cccc(I)c1 Amb25850018 [1,1,0,0,0,0|2,0,0]=4 4312 B12R1.50 CC(C=O)Cc1cccc(N)c1 Amb25251154 [1,1,0,0,0,0|2,0,0]=4 4313 B12R1.50 CC(C=O)Cc1cccc(O)c1 Amb27601007 [1,1,0,0,0,0|2,0,0]=4 4314 B12R1.50 CC(CBr)Cc1cccc(Br)c1 Amb26855946 [1,1,0,0,0,0|2,0,0]=4 4315 B12R1.50 CC(CBr)Cc1cccc(Cl)c1 Amb25957906 [1,1,0,0,0,0|2,0,0]=4 4316 B12R1.50 CC(CBr)Cc1cccc(F)c1 Amb26363128 [1,1,0,0,0,0|2,0,0]=4 4317 B12R1.50 CC(CBr)Cc1cccc(O)c1 Amb24444691 [1,1,0,0,0,0|2,0,0]=4 4318 B12R1.50 CC(CCl)Cc1cccc(Br)c1 Amb24728303 [1,1,0,0,0,0|2,0,0]=4 4319 B12R1.50 CC(CCl)Cc1cccc(Cl)c1 Amb27455762 [1,1,0,0,0,0|2,0,0]=4 4320 B12R1.50 CC(CCl)Cc1cccc(F)c1 Amb26399593 [1,1,0,0,0,0|2,0,0]=4 4321 B12R1.50 CC(CCl)Cc1cccc(O)c1 Amb24537852 [1,1,0,0,0,0|2,0,0]=4 4322 B12R1.50 CC(CN)Cc1cccc(Br)c1 Amb18992227 [1,1,0,0,0,0|2,0,0]=4 4323 B12R1.50 CC(CN)Cc1cccc(Cl)c1 Amb5743847 [1,1,0,0,0,0|2,0,0]=4 4324 B12R1.50 CC(CO)Cc1cccc(F)c1 Amb25228330 [1,1,0,0,0,0|2,0,0]=4 4325 B12R1.50 CC(Cc1cccc(Cl)c1)NN Amb24434144 [1,1,0,0,0,0|1,0,0]=3 4326 B12R1.50 CC(Cc1ccnc(N)c1)NN Amb27960285 [1,1,0,0,0,0|2,0,0]=4 4327 B12R1.50 CC(Cc1cncc(Br)c1)NN Amb28348020 [1,1,0,0,0,0|2,0,0]=4 4328 B12R1.50 CCC(C)Nc1cccc(Br)c1 Amb6696680 [1,1,0,0,0,0|2,0,0]=4 4329 B12R1.50 CCC(C)Nc1cccc(C)c1 Amb6684523 [1,1,0,0,0,0|2,0,0]=4 4330 B12R1.50 CCC(C)Nc1cccc(Cl)c1 Amb6695735 [1,1,0,0,0,0|2,0,0]=4 4331 B12R1.50 CCC(C)Nc1cccc(F)c1 Amb6695894 [1,1,0,0,0,0|2,0,0]=4 4332 B12R1.50 CCC(C)Nc1cccc(I)c1 Amb7785286 [1,1,0,0,0,0|2,0,0]=4 4333 B12R1.50 CCC(C)Nc1cccc(N)c1 Amb8825433 [1,1,0,0,0,0|2,0,0]=4 4334 B12R1.50 CCC(C)Oc1cccc(Br)c1 Amb6740547 [1,1,0,0,0,0|2,0,0]=4 4335 B12R1.50 CCC(C)Oc1cccc(Cl)c1 Amb27757982 [1,1,0,0,0,0|2,0,0]=4 4336 B12R1.50 CCC(C)Oc1cccc(F)c1 Amb27879307 [1,1,0,0,0,0|2,0,0]=4 4337 B12R1.50 CCC(C)Oc1cccc(N)c1 Amb33552870 [1,1,0,0,0,0|2,0,0]=4 4338 B12R1.50 CCC(C)Oc1cccc(N)c1 Amb9778992 [1,1,0,0,0,0|2,0,0]=4 4339 B12R1.50 CCC(C)Oc1cccc(O)c1 Amb8837487 [1,1,0,0,0,0|2,0,0]=4 4340 B12R1.50 CCC(C)Sc1cccc(Cl)c1 Amb28382138 [1,1,0,0,0,0|2,0,0]=4 4341 B12R1.50 CCC(C)Sc1cccc(F)c1 Amb27651316 [1,1,0,0,0,0|2,0,0]=4 4342 B12R1.50 CCC(Cl)Cc1cccc(Br)c1 Amb17477597 [1,1,0,0,0,0|2,0,0]=4 4343 B12R1.50 CCC(Cl)Cc1cccc(F)c1 Amb19046367 [1,1,0,0,0,0|2,0,0]=4 4344 B12R1.50 CCC(N)Cc1cccc(C)c1 Amb9428906 [1,1,0,0,0,0|2,0,0]=4 4345 B12R1.50 CCC(N)Cc1cccc(Cl)c1 Amb9428876 [1,1,0,0,0,0|2,0,0]=4 4346 B12R1.50 CCC(N)Cc1cccc(F)c1 Amb9428915 [1,1,0,0,0,0|2,0,0]=4 4347 B12R1.50 CCC(N)Cc1cccc(N)c1 Amb27467745 [1,1,0,0,0,0|2,0,0]=4 4348 B12R1.50 CCC(O)Cc1cccc(Br)c1 Amb17477580 [1,1,0,0,0,0|2,0,0]=4 4349 B12R1.50 CCC(O)Cc1cccc(C)c1 Amb17138582 [1,1,0,0,0,0|2,0,0]=4 4350 B12R1.50 CCC(O)Cc1cccc(Cl)c1 Amb17139102 [1,1,0,0,0,0|2,0,0]=4 4351 B12R1.50 CCC(O)Cc1cccc(F)c1 Amb17138636 [1,1,0,0,0,0|2,0,0]=4 4352 B12R1.50 CCC(O)Cc1cccc(N)c1 Amb35620551 [1,1,0,0,0,0|2,0,0]=4 4353 B12R1.50 CCN(C)Cc1cccc(F)c1 Amb28291896 [1,1,0,0,0,0|2,0,0]=4 4354 B12R1.50 CCN(C)Cc1cccc(O)c1 Amb28367587 [1,1,0,0,0,0|2,0,0]=4 4355 B12R1.50 CC[C@@H](N)Cc1cccc(Cl)c1 Amb27950246 [1,1,0,0,0,0|2,0,0]=4 4356 B12R1.50 CC[C@H](C)Oc1cccc(O)c1 Amb24497029 [1,1,0,0,0,0|2,0,0]=4 4357 B12R1.50 CC[C@H](N)Cc1cccc(C)c1 Amb27178383 [1,1,0,0,0,0|2,0,0]=4 4358 B12R1.50 CC[C@H](N)Cc1cccc(F)c1 Amb27770954 [1,1,0,0,0,0|2,0,0]=4 4359 B12R1.50 CNC(=N)Cc1cccc(F)c1 Amb27615224 [1,1,0,0,0,0|1,0,1]=4 4360 B12R1.50 CNC(=O)Cc1cccc(N)c1 Amb8426826 [1,1,0,0,0,0|1,0,1]=4 4361 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [1,1,0,0,0,0|1,0,1]=4 4362 B12R1.50 CNC(C)Cc1cc(C)ccn1 Amb1995160 [1,1,0,0,0,0|1,0,0]=3 4363 B12R1.50 CNC(C)Cc1cccc(Br)c1 Amb27172850 [1,1,0,0,0,0|0,0,0]=2 4364 B12R1.50 CNC(C)Cc1cccc(C)c1 Amb33533194 [1,1,0,0,0,0|0,0,0]=2 4365 B12R1.50 CNC(C)Cc1cccc(C)c1 Amb5735452 [1,1,0,0,0,0|0,0,0]=2 4366 B12R1.50 CNC(C)Cc1cccc(C)n1 Amb1995163 [1,1,0,0,0,0|1,0,0]=3 4367 B12R1.50 CNC(C)Cc1cccc(F)c1 Amb18792939 [1,1,0,0,0,0|0,0,0]=2 4368 B12R1.50 CNC(C)Cc1cccc(N)c1 Amb27430457 [1,1,0,0,0,0|0,0,0]=2 4369 B12R1.50 CN[C@@H](C)Cc1cccc(O)c1 Amb25697180 [1,1,0,0,0,0|0,0,0]=2 4370 B12R1.50 CON(C)Cc1cccc(F)c1 Amb27178941 [1,1,0,0,0,0|2,0,0]=4 4371 B12R1.50 Cc1cccc(CC(C)C#N)c1 Amb27242720 [1,1,0,0,0,0|2,0,0]=4 4372 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [1,1,0,0,0,0|2,0,0]=4 4373 B12R1.50 Cc1cccc(CC(C)CBr)c1 Amb26022086 [1,1,0,0,0,0|2,0,0]=4 4374 B12R1.50 Cc1cccc(CC(C)CCl)c1 Amb26412261 [1,1,0,0,0,0|2,0,0]=4 4375 B12R1.50 Cc1cccc(CC(C)CN)c1 Amb5743838 [1,1,0,0,0,0|2,0,0]=4 4376 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [1,1,0,0,0,0|2,0,0]=4 4377 B12R1.50 Cc1cccc(C[C@@H](C)CN)c1 Amb33732120 [1,1,0,0,0,0|2,0,0]=4 4378 B12R1.50 Cc1cccc(C[C@@H](C)CO)c1 Amb33740504 [1,1,0,0,0,0|2,0,0]=4 4379 B12R1.50 Cc1cccc(C[C@H](C)CN)c1 Amb33746819 [1,1,0,0,0,0|2,0,0]=4 4380 B12R1.50 Cc1cccc(C[C@H](C)CO)c1 Amb33737856 [1,1,0,0,0,0|2,0,0]=4 4381 B12R1.118 C#CC(Cc1ccccn1)NC Amb28248857 [1,1,0,0,0,0|1,0,1]=4 4382 B12R1.118 CCC(C#N)Cc1ccccc1 Amb27243484 [1,1,0,0,0,0|1,0,1]=4 4383 B12R1.118 CCC(CBr)Cc1ccccc1 Amb32688650 [1,1,0,0,0,0|1,0,0]=3 4384 B12R1.118 CCC(CCl)Cc1ccccc1 Amb32688649 [1,1,0,0,0,0|1,0,0]=3 4385 B12R1.118 CCC(CF)Nc1ccccc1 Amb27664184 [1,1,0,0,0,0|2,0,0]=4 4386 B12R1.118 CCC(CN)Cc1ccccc1 Amb5743867 [1,1,0,0,0,0|1,0,0]=3 4387 B12R1.118 CCC(CN)Cc1ccccn1 Amb5743864 [1,1,0,0,0,0|2,0,0]=4 4388 B12R1.118 CCC(CN)Cc1cccnc1 Amb5743865 [1,1,0,0,0,0|2,0,0]=4 4389 B12R1.118 CCC(CN)Cc1ccncc1 Amb5743866 [1,1,0,0,0,0|2,0,0]=4 4390 B12R1.118 CCC(CN)Nc1ccccc1 Amb25982695 [1,1,0,0,0,0|2,0,0]=4 4391 B12R1.118 CCC(CN)Oc1ccccc1 Amb18311092 [1,1,0,0,0,0|2,0,0]=4 4392 B12R1.118 CCC(CO)Nc1ccccc1 Amb13952611 [1,1,0,0,0,0|2,0,0]=4 4393 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [1,1,0,0,0,0|0,0,0]=2 4394 B12R1.118 CCN(CC)Cc1ccccc1 Amb4018412 [1,1,0,0,0,0|2,0,0]=4 4395 B12R1.118 CCN(Cc1ccccc1)OC Amb27977584 [1,1,0,0,0,0|2,0,0]=4 4396 B12R1.118 CC[C@@H](CO)Nc1ccccc1 Amb27175792 [1,1,0,0,0,0|2,0,0]=4 4397 B12R1.118 CNC(C#N)Cc1ccccc1 Amb9205106 [1,1,0,0,0,0|0,0,1]=3 4398 B12R1.118 CNC(CN)Cc1ccccc1 Amb18800847 [1,1,0,0,0,0|0,0,0]=2 4399 B12R1.118 CNC(CO)Cc1ccccc1 Amb33536475 [1,1,0,0,0,0|0,0,0]=2 4400 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [1,1,0,0,0,0|0,0,0]=2 4401 B12R1.118 CN[C@H](CO)Cc1ccccc1 Amb33761130 [1,1,0,0,0,0|0,0,0]=2 4402 B12R1.118 COC(C#N)Cc1ccccc1 Amb25681947 [1,1,0,0,0,0|1,0,1]=4 4403 B12R1.118 COC(C=O)Cc1ccccc1 Amb18646090 [1,1,0,0,0,0|1,0,1]=4 4404 B12R1.118 COC(CBr)Cc1ccccc1 Amb32661729 [1,1,0,0,0,0|1,0,0]=3 4405 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [1,1,0,0,0,0|1,0,0]=3 4406 B12R1.118 COC(CO)Cc1ccccc1 Amb28963382 [1,1,0,0,0,0|1,0,0]=3 4407 B12R1.118 COC(Cc1ccccc1)OC Amb8513289 [1,1,0,0,0,0|1,0,0]=3 4408 B12R1.118 CSC(C#N)Cc1ccccc1 Amb17594511 [1,1,0,0,0,0|1,0,1]=4 4409 B12R1.118 C\C=C(\CO)Cc1ccccc1 Amb28242441 [1,1,0,0,0,0|1,0,1]=4 4410 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [1,1,0,0,0,0|2,0,0]=4 4411 B12R1.118 NCC(CO)Cc1ccccc1 Amb5744189 [1,1,0,0,0,0|2,0,0]=4 4412 B12R1.118 OCC(CO)Cc1ccccc1 Amb4018930 [1,1,0,0,0,0|2,0,0]=4 4413 B12R1.118 [C-]#[N+]C(CF)Cc1ccccc1 Amb27958640 [1,1,0,0,0,0|0,0,2]=4 4414 B12R1.194 C#CC(C)(C)Cc1ccccc1 Amb28044775 [1,1,0,0,0,0|1,0,1]=4 4415 B12R1.194 C#CC(C)(O)Cc1ccccc1 Amb1083082 [1,1,0,0,0,0|1,0,1]=4 4416 B12R1.194 C#C[C@](C)(N)Cc1ccccc1 Amb28319360 [1,1,0,0,0,0|1,0,1]=4 4417 B12R1.194 C=CC(C)(O)Cc1ccccc1 Amb27876057 [1,1,0,0,0,0|1,0,1]=4 4418 B12R1.194 CC(C)(C#N)Cc1ccccc1 Amb17333794 [1,1,0,0,0,0|2,0,0]=4 4419 B12R1.194 CC(C)(C=O)Cc1ccccc1 Amb4358578 [1,1,0,0,0,0|2,0,0]=4 4420 B12R1.194 CC(C)(CBr)Cc1ccccc1 Amb27748554 [1,1,0,0,0,0|2,0,0]=4 4421 B12R1.194 CC(C)(CCl)Cc1ccccc1 Amb26495593 [1,1,0,0,0,0|2,0,0]=4 4422 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb17333839 [1,1,0,0,0,0|2,0,0]=4 4423 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb19310600 [1,1,0,0,0,0|2,0,0]=4 4424 B12R1.194 CC(C)(CO)Cc1ccccc1 Amb4021846 [1,1,0,0,0,0|2,0,0]=4 4425 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [1,1,0,0,0,0|1,0,1]=4 4426 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [1,1,0,0,0,0|1,0,0]=3 4427 B12R1.194 CC(C)(Cc1ccccc1)ON Amb32953153 [1,1,0,0,0,0|2,0,0]=4 4428 B12R1.194 CC(F)(CN)Cc1ccccc1 Amb28120778 [1,1,0,0,0,0|2,0,0]=4 4429 B12R1.194 CC(N)(C#N)Cc1ccccc1 Amb17232330 [1,1,0,0,0,0|2,0,0]=4 4430 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [1,1,0,0,0,0|2,0,0]=4 4431 B12R1.194 CC(O)(C#N)Cc1ccccc1 Amb18177733 [1,1,0,0,0,0|2,0,0]=4 4432 B12R1.194 CC(O)(C=O)Cc1ccccc1 Amb27399998 [1,1,0,0,0,0|2,0,0]=4 4433 B12R1.194 CC(O)(CCl)Cc1ccccc1 Amb28118919 [1,1,0,0,0,0|2,0,0]=4 4434 B12R1.194 CC(O)(CN)Cc1ccccc1 Amb17082131 [1,1,0,0,0,0|2,0,0]=4 4435 B12R1.194 CC(O)(CO)Cc1ccccc1 Amb28138963 [1,1,0,0,0,0|2,0,0]=4 4436 B12R1.194 CC(S)(CN)Cc1ccccc1 Amb28141193 [1,1,0,0,0,0|2,0,0]=4 4437 B12R1.194 CCC(C)(C)Oc1ccccc1 Amb27967379 [1,1,0,0,0,0|2,0,0]=4 4438 B12R1.194 CCC(C)(N)Cc1ccccn1 Amb27397125 [1,1,0,0,0,0|2,0,0]=4 4439 B12R1.194 CCC(C)(N)Cc1cccnc1 Amb28430686 [1,1,0,0,0,0|2,0,0]=4 4440 B12R1.194 CCC(C)(O)Cc1ccccn1 Amb27830373 [1,1,0,0,0,0|2,0,0]=4 4441 B12R1.194 CCC(C)(O)Cc1cccnc1 Amb27851308 [1,1,0,0,0,0|2,0,0]=4 4442 B12R1.194 CC[N+](C)(C)Cc1ccccc1 Amb27156320 [1,1,0,0,0,0|2,0,0]=4 4443 B12R1.194 CNC(C)(C)Cc1ccccc1 Amb6336482 [1,1,0,0,0,0|0,0,0]=2 4444 B12R1.194 CNC(C)(C)Cc1ccccn1 Amb26883824 [1,1,0,0,0,0|1,0,0]=3 4445 B12R1.194 CNC(C)(C)Cc1cccnc1 Amb24544019 [1,1,0,0,0,0|1,0,0]=3 4446 B12R1.194 CNC(C)(C)Cc1ccncc1 Amb26961900 [1,1,0,0,0,0|1,0,0]=3 4447 B12R1.194 CNC(C)(C)Cc1ccncn1 Amb33267948 [1,1,0,0,0,0|2,0,0]=4 4448 B12R1.194 CNC(C)(C)Cc1cnccn1 Amb33429632 [1,1,0,0,0,0|2,0,0]=4 4449 B12R1.194 CNC(C)(C)Cc1cncnc1 Amb33224368 [1,1,0,0,0,0|2,0,0]=4 4450 B12R1.194 CNC(C)(C)Cc1ncccn1 Amb33269915 [1,1,0,0,0,0|2,0,0]=4 4451 B12R1.194 CNC(C)(O)Cc1ccccc1 Amb27204847 [1,1,0,0,0,0|0,0,0]=2 4452 B12R1.194 CNS(=O)(=O)Cc1ccccc1 Amb1125735 [1,1,0,0,0,0|2,0,0]=4 4453 B12R1.194 CO[Si](C)(C)Cc1ccccc1 Amb22167044 [1,1,0,0,0,0|1,1,0]=4 4454 B12R1.194 C[C@@](N)(CO)Cc1ccccc1 Amb26371721 [1,1,0,0,0,0|2,0,0]=4 4455 B12R1.194 C[C@@](O)(C=O)Cc1ccccc1 Amb27748618 [1,1,0,0,0,0|2,0,0]=4 4456 B12R1.194 C[C@](N)(CO)Cc1ccccc1 Amb28396546 [1,1,0,0,0,0|2,0,0]=4 4457 B12R1.371 CC(C#N)Cc1ccccc1Br Amb26955520 [1,1,0,0,0,0|2,0,0]=4 4458 B12R1.371 CC(C#N)Cc1ccccc1Cl Amb25717018 [1,1,0,0,0,0|2,0,0]=4 4459 B12R1.371 CC(C#N)Cc1ccccc1F Amb28255995 [1,1,0,0,0,0|2,0,0]=4 4460 B12R1.371 CC(C=O)Cc1ccccc1Br Amb25324057 [1,1,0,0,0,0|2,0,0]=4 4461 B12R1.371 CC(C=O)Cc1ccccc1Cl Amb26398801 [1,1,0,0,0,0|2,0,0]=4 4462 B12R1.371 CC(C=O)Cc1ccccc1F Amb24429443 [1,1,0,0,0,0|2,0,0]=4 4463 B12R1.371 CC(C=O)Cc1ccccc1I Amb24437612 [1,1,0,0,0,0|2,0,0]=4 4464 B12R1.371 CC(C=O)Cc1ccccc1N Amb27166705 [1,1,0,0,0,0|2,0,0]=4 4465 B12R1.371 CC(C=O)Cc1ccccc1O Amb25313067 [1,1,0,0,0,0|2,0,0]=4 4466 B12R1.371 CC(CBr)Cc1ccccc1Br Amb25040689 [1,1,0,0,0,0|2,0,0]=4 4467 B12R1.371 CC(CBr)Cc1ccccc1Cl Amb28043482 [1,1,0,0,0,0|2,0,0]=4 4468 B12R1.371 CC(CBr)Cc1ccccc1F Amb25741700 [1,1,0,0,0,0|2,0,0]=4 4469 B12R1.371 CC(CCl)Cc1ccccc1Br Amb26645125 [1,1,0,0,0,0|2,0,0]=4 4470 B12R1.371 CC(CCl)Cc1ccccc1Cl Amb25997478 [1,1,0,0,0,0|2,0,0]=4 4471 B12R1.371 CC(CCl)Cc1ccccc1F Amb25349982 [1,1,0,0,0,0|2,0,0]=4 4472 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [1,1,0,0,0,0|2,0,0]=4 4473 B12R1.371 CC(CN)Cc1ccccc1Cl Amb5743846 [1,1,0,0,0,0|2,0,0]=4 4474 B12R1.371 CC(CN)Cc1ccccc1F Amb5743840 [1,1,0,0,0,0|2,0,0]=4 4475 B12R1.371 CC(CO)Cc1ccccc1F Amb26508993 [1,1,0,0,0,0|2,0,0]=4 4476 B12R1.371 CC(CO)Cc1ccccc1O Amb28061434 [1,1,0,0,0,0|2,0,0]=4 4477 B12R1.371 CC(Cc1ccccc1Br)NN Amb27623259 [1,1,0,0,0,0|1,0,0]=3 4478 B12R1.371 CC(Cc1ccccc1F)NN Amb28421760 [1,1,0,0,0,0|1,0,0]=3 4479 B12R1.371 CC(Cc1ccccc1O)NO Amb28074598 [1,1,0,0,0,0|1,0,0]=3 4480 B12R1.371 CC(Cc1ncccc1Br)NN Amb27173450 [1,1,0,0,0,0|2,0,0]=4 4481 B12R1.371 CCC(C)Cc1ccccc1O Amb27177732 [1,1,0,0,0,0|1,0,0]=3 4482 B12R1.371 CCC(C)Cc1cnccc1N Amb27954500 [1,1,0,0,0,0|2,0,0]=4 4483 B12R1.371 CCC(C)Nc1ccccc1Br Amb6696460 [1,1,0,0,0,0|2,0,0]=4 4484 B12R1.371 CCC(C)Nc1ccccc1C Amb6701228 [1,1,0,0,0,0|2,0,0]=4 4485 B12R1.371 CCC(C)Nc1ccccc1Cl Amb6696915 [1,1,0,0,0,0|2,0,0]=4 4486 B12R1.371 CCC(C)Nc1ccccc1F Amb6697377 [1,1,0,0,0,0|2,0,0]=4 4487 B12R1.371 CCC(C)Nc1ccccc1I Amb7785642 [1,1,0,0,0,0|2,0,0]=4 4488 B12R1.371 CCC(C)Nc1ccccc1O Amb27760304 [1,1,0,0,0,0|2,0,0]=4 4489 B12R1.371 CCC(C)Oc1ccccc1C Amb28364230 [1,1,0,0,0,0|2,0,0]=4 4490 B12R1.371 CCC(C)Oc1ccccc1Cl Amb27175754 [1,1,0,0,0,0|2,0,0]=4 4491 B12R1.371 CCC(C)Oc1ccccc1N Amb9702145 [1,1,0,0,0,0|2,0,0]=4 4492 B12R1.371 CCC(C)Sc1ccccc1Br Amb27835038 [1,1,0,0,0,0|2,0,0]=4 4493 B12R1.371 CCC(Cl)Cc1ccccc1C Amb17477425 [1,1,0,0,0,0|2,0,0]=4 4494 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [1,1,0,0,0,0|2,0,0]=4 4495 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [1,1,0,0,0,0|2,0,0]=4 4496 B12R1.371 CCC(N)Cc1ccccc1Br Amb9428862 [1,1,0,0,0,0|2,0,0]=4 4497 B12R1.371 CCC(N)Cc1ccccc1C Amb9428910 [1,1,0,0,0,0|2,0,0]=4 4498 B12R1.371 CCC(N)Cc1ccccc1Cl Amb9428938 [1,1,0,0,0,0|2,0,0]=4 4499 B12R1.371 CCC(N)Cc1ccccc1F Amb9428867 [1,1,0,0,0,0|2,0,0]=4 4500 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [1,1,0,0,0,0|2,0,0]=4 4501 B12R1.371 CCC(O)Cc1ccccc1C Amb17138581 [1,1,0,0,0,0|2,0,0]=4 4502 B12R1.371 CCC(O)Cc1ccccc1Cl Amb17139101 [1,1,0,0,0,0|2,0,0]=4 4503 B12R1.371 CCC(O)Cc1ccccc1F Amb17138635 [1,1,0,0,0,0|2,0,0]=4 4504 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [1,1,0,0,0,0|2,0,0]=4 4505 B12R1.371 CCN(C)Cc1ccccc1Cl Amb28126470 [1,1,0,0,0,0|2,0,0]=4 4506 B12R1.371 CC[C@@H](C)Cc1ccccc1O Amb28243798 [1,1,0,0,0,0|1,0,0]=3 4507 B12R1.371 CC[C@@H](N)Cc1ccccc1Br Amb27459365 [1,1,0,0,0,0|2,0,0]=4 4508 B12R1.371 CC[C@@H](N)Cc1ccccc1Cl Amb27668323 [1,1,0,0,0,0|2,0,0]=4 4509 B12R1.371 CNC(=N)Cc1ccccc1Br Amb27954483 [1,1,0,0,0,0|1,0,1]=4 4510 B12R1.371 CNC(=N)Cc1ccccc1Cl Amb27165054 [1,1,0,0,0,0|1,0,1]=4 4511 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [1,1,0,0,0,0|1,0,1]=4 4512 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [1,1,0,0,0,0|1,0,1]=4 4513 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [1,1,0,0,0,0|1,0,1]=4 4514 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [1,1,0,0,0,0|1,0,1]=4 4515 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [1,1,0,0,0,0|1,0,1]=4 4516 B12R1.371 CNC(C)Cc1ccccc1C Amb24271197 [1,1,0,0,0,0|0,0,0]=2 4517 B12R1.371 CNC(C)Cc1ccccc1C Amb5735451 [1,1,0,0,0,0|0,0,0]=2 4518 B12R1.371 CNC(C)Cc1ccccc1I Amb27178924 [1,1,0,0,0,0|0,0,0]=2 4519 B12R1.371 CNC(C)Cc1ccccc1O Amb28456494 [1,1,0,0,0,0|0,0,0]=2 4520 B12R1.371 CNC(C)Cc1ncccc1Br Amb28190371 [1,1,0,0,0,0|1,0,0]=3 4521 B12R1.371 CNC(C)Cc1ncccc1C Amb1995153 [1,1,0,0,0,0|1,0,0]=3 4522 B12R1.371 COC(C)CN1C=CC=CC1=O Amb28072405 [1,1,0,0,0,0|2,0,0]=4 4523 B12R1.371 COC(C)Sc1ccccc1O Amb27486157 [1,1,0,0,0,0|2,0,0]=4 4524 B12R1.371 CON(C)Cc1ccccc1C Amb27178942 [1,1,0,0,0,0|2,0,0]=4 4525 B12R1.371 CON(C)Cc1ccccc1F Amb27665165 [1,1,0,0,0,0|2,0,0]=4 4526 B12R1.371 C[C@@H](CN)Cc1ccccc1F Amb33731703 [1,1,0,0,0,0|2,0,0]=4 4527 B12R1.371 C[C@@H](CO)Cc1ccccc1Cl Amb28207131 [1,1,0,0,0,0|2,0,0]=4 4528 B12R1.371 C[C@@H](CO)Cc1ccccc1F Amb26956773 [1,1,0,0,0,0|2,0,0]=4 4529 B12R1.371 C[C@H](CN)Cc1ccccc1F Amb33747137 [1,1,0,0,0,0|2,0,0]=4 4530 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [1,1,0,0,0,0|2,0,0]=4 4531 B12R1.371 C\C=C(\C)Cc1ccccc1O Amb24380771 [1,1,0,0,0,0|1,0,1]=4 4532 B12R1.371 Cc1ccccc1CC(C)C#N Amb27149910 [1,1,0,0,0,0|2,0,0]=4 4533 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [1,1,0,0,0,0|2,0,0]=4 4534 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [1,1,0,0,0,0|2,0,0]=4 4535 B12R1.371 Cc1ccccc1CC(C)CCl Amb28422132 [1,1,0,0,0,0|2,0,0]=4 4536 B12R1.371 Cc1ccccc1CC(C)CN Amb5743837 [1,1,0,0,0,0|2,0,0]=4 4537 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [1,1,0,0,0,0|2,0,0]=4 4538 B12R1.371 Cc1ccccc1C[C@@H](C)CN Amb33747733 [1,1,0,0,0,0|2,0,0]=4 4539 B12R1.371 Cc1ccccc1C[C@@H](C)CO Amb33746673 [1,1,0,0,0,0|2,0,0]=4 4540 B12R1.371 Cc1ccccc1C[C@H](C)CN Amb33738932 [1,1,0,0,0,0|2,0,0]=4 4541 B12R1.371 Cc1ccccc1C[C@H](C)CO Amb33738161 [1,1,0,0,0,0|2,0,0]=4 4542 B12R1.33 CCC(C)C(O)c1cc(Br)cs1 Amb27195514 [0,1,0,0,1,0|2,0,0]=4 4543 B12R1.33 CCC(C)C(O)c1ccc(Br)s1 Amb27196239 [0,1,0,0,1,0|2,0,0]=4 4544 B12R1.33 CCC(C)C(O)c1ccc(C)o1 Amb27231376 [0,1,0,0,1,0|2,0,0]=4 4545 B12R1.33 CCC(C)C(O)c1ccc(Cl)o1 Amb27204932 [0,1,0,0,1,0|2,0,0]=4 4546 B12R1.33 CCC(C)C(O)c1coc(C)c1 Amb27486984 [0,1,0,0,1,0|2,0,0]=4 4547 B12R1.33 CCC(C)C(O)c1csc(Br)c1 Amb27970642 [0,1,0,0,1,0|2,0,0]=4 4548 B12R1.33 CCC(C)C(O)c1csc(Cl)c1 Amb28201891 [0,1,0,0,1,0|2,0,0]=4 4549 B12R1.33 CNC(C)C(O)c1cc(C)ns1 Amb35621100 [0,1,0,0,1,0|2,0,0]=4 4550 B12R1.33 CNC(C)C(O)c1ccc(C)s1 Amb35621415 [0,1,0,0,1,0|1,0,0]=3 4551 B12R1.33 CNC(C)C(O)c1ccc(Cl)s1 Amb18567621 [0,1,0,0,1,0|1,0,0]=3 4552 B12R1.33 CNC(C)C(O)c1ccn(C)n1 Amb35621110 [0,1,0,0,1,0|2,0,0]=4 4553 B12R1.33 CNC(C)C(O)c1cn(C)cn1 Amb35741561 [0,1,0,0,1,0|2,0,0]=4 4554 B12R1.33 CNC(C)C(O)c1cnc(C)s1 Amb35621620 [0,1,0,0,1,0|2,0,0]=4 4555 B12R1.33 CNC(C)C(O)c1cnn(C)c1 Amb35741563 [0,1,0,0,1,0|2,0,0]=4 4556 B12R1.33 CNC(C)C(O)c1csc(C)c1 Amb35621105 [0,1,0,0,1,0|1,0,0]=3 4557 B12R1.33 CNC(C)C(O)c1csc(C)n1 Amb35621107 [0,1,0,0,1,0|2,0,0]=4 4558 B12R1.33 CN[C@@H](C)C(O)c1cc(C)ns1 Amb35664057 [0,1,0,0,1,0|2,0,0]=4 4559 B12R1.33 CN[C@@H](C)C(O)c1ccc(C)s1 Amb30038942 [0,1,0,0,1,0|1,0,0]=3 4560 B12R1.33 CN[C@@H](C)C(O)c1ccc(Cl)s1 Amb30038955 [0,1,0,0,1,0|1,0,0]=3 4561 B12R1.33 CN[C@@H](C)C(O)c1ccn(C)n1 Amb29891480 [0,1,0,0,1,0|2,0,0]=4 4562 B12R1.33 CN[C@@H](C)C(O)c1cn(C)cn1 Amb35664037 [0,1,0,0,1,0|2,0,0]=4 4563 B12R1.33 CN[C@@H](C)C(O)c1cnc(C)s1 Amb29889814 [0,1,0,0,1,0|2,0,0]=4 4564 B12R1.33 CN[C@@H](C)C(O)c1cnn(C)c1 Amb35664055 [0,1,0,0,1,0|2,0,0]=4 4565 B12R1.33 CN[C@@H](C)C(O)c1csc(C)c1 Amb29891474 [0,1,0,0,1,0|1,0,0]=3 4566 B12R1.33 CN[C@@H](C)C(O)c1csc(C)n1 Amb29891476 [0,1,0,0,1,0|2,0,0]=4 4567 B12R1.55 CC(NC=O)C(O)c1ccoc1 Amb27493107 [0,1,0,0,1,0|1,0,1]=4 4568 B12R1.55 C[C@H](NC=O)[C@H](O)c1cccs1 Amb27224044 [0,1,0,0,1,0|1,0,1]=4 4569 B12R1.55 C[C@H](NC=O)[C@H](O)c1ccsc1 Amb27616848 [0,1,0,0,1,0|1,0,1]=4 4570 B12R1.55 C\C=C\C(C)C(O)c1ccco1 Amb28048364 [0,1,0,0,1,0|2,0,0]=4 4571 B12R1.55 C\C=C\[C@H](C)[C@@H](O)c1ccco1 Amb28455204 [0,1,0,0,1,0|2,0,0]=4 4572 B12R1.74 CCC(CN)C(O)c1ccco1 Amb32693595 [0,1,0,0,1,0|2,0,0]=4 4573 B12R1.74 CCC(CN)C(O)c1cccs1 Amb32693625 [0,1,0,0,1,0|2,0,0]=4 4574 B12R1.74 CCC(CN)C(O)c1ccoc1 Amb32693596 [0,1,0,0,1,0|2,0,0]=4 4575 B12R1.74 CCC(CN)C(O)c1ccsc1 Amb32693626 [0,1,0,0,1,0|2,0,0]=4 4576 B12R1.74 CCC(NC)C(O)c1cccs1 Amb18606184 [0,1,0,0,1,0|1,0,0]=3 4577 B12R1.120 C=C(C)[C@@H](C)[C@@H](O)c1ccco1 Amb27835051 [0,1,0,0,1,0|2,0,0]=4 4578 B12R1.120 CC(=O)C(C)[C@H](O)c1ccco1 Amb27175880 [0,1,0,0,1,0|2,0,0]=4 4579 B12R1.120 CC(=O)[C@@H](C)[C@@H](O)c1cccs1 Amb27615338 [0,1,0,0,1,0|2,0,0]=4 4580 B12R1.120 CC(=O)[C@H](C)[C@@H](O)c1cccs1 Amb27443219 [0,1,0,0,1,0|2,0,0]=4 4581 B12R1.120 CC(C(O)c1ccco1)[C@H](C)O Amb27605399 [0,1,0,0,1,0|2,0,0]=4 4582 B12R1.120 CC(N)C(C)C(O)c1ccco1 Amb35584281 [0,1,0,0,1,0|2,0,0]=4 4583 B12R1.120 CC(N)C(C)C(O)c1cccs1 Amb35621774 [0,1,0,0,1,0|2,0,0]=4 4584 B12R1.120 CC(N)C(C)C(O)c1ccoc1 Amb35624837 [0,1,0,0,1,0|2,0,0]=4 4585 B12R1.120 CC(N)C(C)C(O)c1ccsc1 Amb35624835 [0,1,0,0,1,0|2,0,0]=4 4586 B12R1.200 CCC(C)(C)C(O)c1cccs1 Amb19068976 [0,1,0,0,1,0|2,0,0]=4 4587 B12R1.200 CCC(C)(C)C(O)c1ccsc1 Amb27210607 [0,1,0,0,1,0|2,0,0]=4 4588 B12R1.200 CCC(C)(N)C(O)c1ccco1 Amb35742278 [0,1,0,0,1,0|2,0,0]=4 4589 B12R1.200 CCC(C)(N)C(O)c1cccs1 Amb35587060 [0,1,0,0,1,0|2,0,0]=4 4590 B12R1.200 CCC(C)(N)C(O)c1ccoc1 Amb35742163 [0,1,0,0,1,0|2,0,0]=4 4591 B12R1.200 CCC(C)(N)C(O)c1ccsc1 Amb35742161 [0,1,0,0,1,0|2,0,0]=4 4592 B12R1.200 CCC(C)(O)C(O)c1ccco1 Amb27450327 [0,1,0,0,1,0|2,0,0]=4 4593 B12R1.200 CNC(C)(C)C(F)c1cccs1 Amb27777065 [0,1,0,0,1,0|2,0,0]=4 4594 B12R1.200 CNC(C)(C)C(O)c1ccns1 Amb27815651 [0,1,0,0,1,0|2,0,0]=4 4595 B12R1.200 CNC(C)(C)C(O)c1cncs1 Amb35616843 [0,1,0,0,1,0|2,0,0]=4 4596 B12R1.200 CNC(C)(C)C(O)c1cnsc1 Amb35720352 [0,1,0,0,1,0|2,0,0]=4 4597 B12R1.200 CSC(C)(C)C(O)c1ccco1 Amb27420873 [0,1,0,0,1,0|2,0,0]=4 4598 B12R1.200 CSC(C)(C)C(O)c1ccoc1 Amb27877671 [0,1,0,0,1,0|2,0,0]=4 4599 B12R1.468 CCC(C)C(O)c1ccoc1C Amb27955490 [0,1,0,0,1,0|2,0,0]=4 4600 B12R1.468 CCC(C)C(O)c1ccsc1Br Amb29890873 [0,1,0,0,1,0|2,0,0]=4 4601 B12R1.468 CCC(C)C(O)c1ccsc1C Amb28399027 [0,1,0,0,1,0|2,0,0]=4 4602 B12R1.468 CCC(C)C(O)c1ccsc1Cl Amb27985103 [0,1,0,0,1,0|2,0,0]=4 4603 B12R1.468 CCC(C)C(O)c1cscc1Br Amb27865163 [0,1,0,0,1,0|2,0,0]=4 4604 B12R1.468 CCC(C)C(O)c1cscc1C Amb27806848 [0,1,0,0,1,0|2,0,0]=4 4605 B12R1.468 CCC(C)C(O)c1sccc1Br Amb27810707 [0,1,0,0,1,0|2,0,0]=4 4606 B12R1.468 CCC(C)C(O)c1sccc1C Amb19057659 [0,1,0,0,1,0|2,0,0]=4 4607 B12R1.468 CCC(C)C(O)c1sccc1Cl Amb27847330 [0,1,0,0,1,0|2,0,0]=4 4608 B12R1.468 CNC(C)C(O)c1ccnn1C Amb35621114 [0,1,0,0,1,0|2,0,0]=4 4609 B12R1.468 CNC(C)C(O)c1ccsc1C Amb35621109 [0,1,0,0,1,0|1,0,0]=3 4610 B12R1.468 CNC(C)C(O)c1ccsc1Cl Amb35621412 [0,1,0,0,1,0|1,0,0]=3 4611 B12R1.468 CNC(C)C(O)c1cncn1C Amb35587845 [0,1,0,0,1,0|2,0,0]=4 4612 B12R1.468 CNC(C)C(O)c1cocc1C Amb35584022 [0,1,0,0,1,0|1,0,0]=3 4613 B12R1.468 CNC(C)C(O)c1cscc1Br Amb35741310 [0,1,0,0,1,0|1,0,0]=3 4614 B12R1.468 CNC(C)C(O)c1nccn1C Amb35621612 [0,1,0,0,1,0|2,0,0]=4 4615 B12R1.468 CNC(C)C(O)c1occc1Br Amb35621113 [0,1,0,0,1,0|1,0,0]=3 4616 B12R1.468 CNC(C)C(O)c1sccc1Br Amb35624557 [0,1,0,0,1,0|1,0,0]=3 4617 B12R1.468 CNC(C)C(O)c1sccc1C Amb35621414 [0,1,0,0,1,0|1,0,0]=3 4618 B12R1.468 CNC(C)C(O)c1sccc1Cl Amb29875933 [0,1,0,0,1,0|1,0,0]=3 4619 B12R1.468 CNC(C)C(O)c1scnc1C Amb35621111 [0,1,0,0,1,0|2,0,0]=4 4620 B12R1.468 CN[C@@H](C)C(O)c1ccnn1C Amb29891484 [0,1,0,0,1,0|2,0,0]=4 4621 B12R1.468 CN[C@@H](C)C(O)c1ccsc1C Amb29891478 [0,1,0,0,1,0|1,0,0]=3 4622 B12R1.468 CN[C@@H](C)C(O)c1ccsc1Cl Amb35662614 [0,1,0,0,1,0|1,0,0]=3 4623 B12R1.468 CN[C@@H](C)C(O)c1cncn1C Amb35743855 [0,1,0,0,1,0|2,0,0]=4 4624 B12R1.468 CN[C@@H](C)C(O)c1cocc1C Amb30039226 [0,1,0,0,1,0|1,0,0]=3 4625 B12R1.468 CN[C@@H](C)C(O)c1cscc1Br Amb35662592 [0,1,0,0,1,0|1,0,0]=3 4626 B12R1.468 CN[C@@H](C)C(O)c1nccn1C Amb29891486 [0,1,0,0,1,0|2,0,0]=4 4627 B12R1.468 CN[C@@H](C)C(O)c1occc1Br Amb29891483 [0,1,0,0,1,0|1,0,0]=3 4628 B12R1.468 CN[C@@H](C)C(O)c1sccc1Br Amb35659713 [0,1,0,0,1,0|1,0,0]=3 4629 B12R1.468 CN[C@@H](C)C(O)c1sccc1C Amb30038941 [0,1,0,0,1,0|1,0,0]=3 4630 B12R1.468 CN[C@@H](C)C(O)c1sccc1Cl Amb30039221 [0,1,0,0,1,0|1,0,0]=3 4631 B12R1.468 CN[C@@H](C)C(O)c1scnc1C Amb29891481 [0,1,0,0,1,0|2,0,0]=4 4632 B12R1.468 COC(C)C(O)c1occc1Br Amb27616846 [0,1,0,0,1,0|2,0,0]=4 4633 B12R1.468 COC(C)C(O)c1sccc1Br Amb27881415 [0,1,0,0,1,0|2,0,0]=4 4634 B12R1.468 COC(C)C(O)c1sccc1C Amb28074309 [0,1,0,0,1,0|2,0,0]=4 4635 B12R1.473 CCC(C)C(C)(O)c1ccco1 Amb27977765 [0,1,0,0,1,0|2,0,0]=4 4636 B12R1.473 COC(C)C(C)(O)c1ccsc1 Amb27433761 [0,1,0,0,1,0|2,0,0]=4 4637 B14R1.10 CCC(C)NC(C)c1ccc(Br)cc1 Amb6685817 [0,1,0,0,0,1|2,0,0]=4 4638 B14R1.10 CCC(C)NC(C)c1ccc(C)cc1 Amb6685819 [0,1,0,0,0,1|2,0,0]=4 4639 B14R1.10 CCC(C)NC(C)c1ccc(Cl)cc1 Amb6685824 [0,1,0,0,0,1|2,0,0]=4 4640 B14R1.10 CCC(C)NC(C)c1ccc(I)cc1 Amb9622445 [0,1,0,0,0,1|2,0,0]=4 4641 B14R1.10 CNC(=O)C[C@H](O)c1ccc(C)cc1 Amb27464442 [0,1,0,0,0,1|1,0,1]=4 4642 B14R1.10 CNC(=O)C[C@H](O)c1ccc(F)cc1 Amb27413642 [0,1,0,0,0,1|1,0,1]=4 4643 B14R1.11 CCC(C)NC(C)c1cccc(Br)c1 Amb6685818 [0,1,0,0,0,1|2,0,0]=4 4644 B14R1.11 CCC(C)NC(C)c1cccc(Cl)c1 Amb6685911 [0,1,0,0,0,1|2,0,0]=4 4645 B14R1.11 CCC(C)NC(C)c1cccc(F)c1 Amb6685919 [0,1,0,0,0,1|2,0,0]=4 4646 B14R1.11 CCN(C)CC(O)c1cccc(C)c1 Amb19079601 [0,1,0,0,0,1|2,0,0]=4 4647 B14R1.29 COCC(C)NC(C)c1ccccc1 Amb6689581 [0,1,0,0,0,1|2,0,0]=4 4648 B14R1.58 CCC(CC)CC(N)c1ccccc1 Amb19073698 [0,1,0,0,0,1|2,0,0]=4 4649 B14R1.58 CCC(CC)NC(C)c1ccccc1 Amb6684843 [0,1,0,0,0,1|2,0,0]=4 4650 B14R1.58 CCC(CC)[NH2+][C@@H](C)c1ccccc1 Amb22049557 [0,1,0,0,0,1|2,0,0]=4 4651 B14R1.58 CCC(CO)NC(C)c1ccccc1 Amb6735082 [0,1,0,0,0,1|2,0,0]=4 4652 B14R1.58 CCN(CC)CC(O)c1ccccc1 Amb4007807 [0,1,0,0,0,1|2,0,0]=4 4653 B14R1.58 C\N=C(\NC)NC(C)c1ccccc1 Amb27453696 [0,1,0,0,0,1|1,0,1]=4 4654 B14R1.58 C\N=C(\NC)N[C@H](C)c1ccccc1 Amb27974924 [0,1,0,0,0,1|1,0,1]=4 4655 B14R1.85 CCN(C)C(C)C(O)c1ccccc1 Amb19079599 [0,1,0,0,0,1|2,0,0]=4 4656 B14R1.85 C\C=C(\C)[C@@H](C)[C@@H](O)c1ccccc1 Amb27219507 [0,1,0,0,0,1|1,0,1]=4 4657 B14R1.85 C\C=C(\C)[C@H](C)[C@@H](O)c1ccccc1 Amb27853836 [0,1,0,0,0,1|1,0,1]=4 4658 B14R1.290 C#CC(C)(C)CC(O)c1ccccc1 Amb27486535 [0,1,0,0,0,1|1,0,1]=4 4659 B14R1.290 CNC(C)(C)CC(C)c1ccccc1 Amb33224077 [0,1,0,0,0,1|1,0,0]=3 4660 B14R1.415 CC(C)C(C)N[C@@H](C)c1ccccc1 Amb24309142 [0,1,0,0,0,1|2,0,0]=4 4661 B14R1.415 CC(NC(C)C(C)C)c1ccccc1 Amb6684856 [0,1,0,0,0,1|2,0,0]=4 4662 B14R1.587 CC(C#N)CC(O)c1ccccc1Cl Amb17339411 [0,1,0,0,0,1|2,0,0]=4 4663 B14R1.587 CCC(C)NC(C)c1ccccc1Br Amb6685846 [0,1,0,0,0,1|2,0,0]=4 4664 B14R1.587 CCC(C)NC(C)c1ccccc1C Amb6685878 [0,1,0,0,0,1|2,0,0]=4 4665 B14R1.587 CCC(C)NC(C)c1ccccc1Cl Amb6685825 [0,1,0,0,0,1|2,0,0]=4 4666 B14R1.587 CCC(C)NC(C)c1ccccc1F Amb6685841 [0,1,0,0,0,1|2,0,0]=4 4667 B14R1.587 CCC(C)NC(C)c1ccccc1O Amb6685830 [0,1,0,0,0,1|2,0,0]=4 4668 B14R1.741 CNC(C)CC(C)(C)c1ccccc1 Amb5740161 [0,1,0,0,0,1|1,0,0]=3 4669 B14R1.3297 CCC(C)NC(CC)c1ccccc1 Amb6685820 [0,1,0,0,0,1|2,0,0]=4 4670 B14R1.3297 CCC(C)NC(CO)c1ccccc1 Amb19051234 [0,1,0,0,0,1|1,0,0]=3 4671 B14R1.3297 CCC(C)OC(CBr)c1ccccc1 Amb33348518 [0,1,0,0,0,1|2,0,0]=4 4672 B14R1.3297 CCC(C)OC(CI)c1ccccc1 Amb33349135 [0,1,0,0,0,1|2,0,0]=4 4673 B14R1.3297 CNC(=N)NC(CO)c1ccccc1 Amb27232523 [0,1,0,0,0,1|1,0,1]=4 4674 B14R1.3297 CNC(=O)NC(CO)c1ccccc1 Amb27450957 [0,1,0,0,0,1|1,0,1]=4 4675 B14R1.3297 CNC(=O)N[C@@H](CO)c1ccccc1 Amb27598857 [0,1,0,0,0,1|1,0,1]=4 4676 B14R1.60 CCNC(=O)C(O)Cc1ccccc1 Amb32663008 [0,1,0,0,0,1|1,0,1]=4 4677 B14R1.60 CCNC(=O)[C@@H](O)Cc1ccccc1 Amb32663961 [0,1,0,0,0,1|1,0,1]=4 4678 B14R1.60 CNC[C@@H](C)N(O)Cc1ccccc1 Amb27454998 [0,1,0,0,0,1|1,0,0]=3 4679 B14R1.134 CCC(C)C(C)Nc1ccc(C)cc1 Amb6631866 [0,1,0,0,0,1|2,0,0]=4 4680 B14R1.134 CCC(C)C(C)Nc1ccc(F)cc1 Amb6611147 [0,1,0,0,0,1|2,0,0]=4 4681 B14R1.134 CCC(C)C(C)Nc1ccc(O)cc1 Amb9608528 [0,1,0,0,0,1|2,0,0]=4 4682 B14R1.134 CNC(C)C(=O)Nc1ccc(Br)cc1 Amb28061724 [0,1,0,0,0,1|0,0,2]=4 4683 B14R1.134 CNC(C)C(=O)Nc1ccc(C)cc1 Amb18993239 [0,1,0,0,0,1|0,0,2]=4 4684 B14R1.134 CNC(C)C(=O)Nc1ccc(Cl)cc1 Amb18993253 [0,1,0,0,0,1|0,0,2]=4 4685 B14R1.134 CNC(C)C(=O)Nc1ccc(O)cc1 Amb18993852 [0,1,0,0,0,1|0,0,2]=4 4686 B14R1.134 CNC(C)\C(C)=C\c1ccc(C)cc1 Amb27593554 [0,1,0,0,0,1|1,0,1]=4 4687 B14R1.134 CNC(C)\C(C)=C\c1ccc(O)cc1 Amb28046685 [0,1,0,0,0,1|1,0,1]=4 4688 B14R1.134 CN[C@@H](C)C(=O)Nc1ccc(C)cc1 Amb28141067 [0,1,0,0,0,1|0,0,2]=4 4689 B14R1.134 CN[C@@H](C)C(=O)Nc1ccc(Cl)cc1 Amb27863372 [0,1,0,0,0,1|0,0,2]=4 4690 B14R1.134 CN[C@@H](C)C(=O)Nc1ccc(I)cc1 Amb27658524 [0,1,0,0,0,1|0,0,2]=4 4691 B14R1.134 CN[C@@H](C)C(=O)Nc1ccc(O)cc1 Amb27985712 [0,1,0,0,0,1|0,0,2]=4 4692 B14R1.134 COC(C)C(C)Nc1ccc(Br)cc1 Amb27980245 [0,1,0,0,0,1|2,0,0]=4 4693 B14R1.134 COC(C)C(C)Nc1ccc(F)cc1 Amb27208039 [0,1,0,0,0,1|2,0,0]=4 4694 B14R1.135 CCC(C)C(C)Nc1cccc(Br)c1 Amb6625409 [0,1,0,0,0,1|2,0,0]=4 4695 B14R1.135 CCC(C)C(C)Nc1cccc(C)c1 Amb6647627 [0,1,0,0,0,1|2,0,0]=4 4696 B14R1.135 CCC(C)C(C)Nc1cccc(F)c1 Amb6651793 [0,1,0,0,0,1|2,0,0]=4 4697 B14R1.135 CNC(C)C(=O)Nc1cccc(Br)c1 Amb25856560 [0,1,0,0,0,1|0,0,2]=4 4698 B14R1.135 CNC(C)\C(C)=C\c1cccc(F)c1 Amb27453169 [0,1,0,0,0,1|1,0,1]=4 4699 B14R1.135 CN[C@@H](C)C(=O)Nc1cccc(Br)c1 Amb27754404 [0,1,0,0,0,1|0,0,2]=4 4700 B14R1.135 CN[C@@H](C)C(=O)Nc1cccc(F)c1 Amb28143356 [0,1,0,0,0,1|0,0,2]=4 4701 B14R1.296 CC(C)(C#N)C(O)Cc1ccccc1 Amb27586519 [0,1,0,0,0,1|2,0,0]=4 4702 B14R1.296 CNC(C)(C)\C(C)=C\c1ccccc1 Amb33381238 [0,1,0,0,0,1|1,0,1]=4 4703 B14R1.425 CC(C(=O)Nc1ccccc1)N(C)C Amb27827785 [0,1,0,0,0,1|0,0,2]=4 4704 B14R1.425 CC(C(=O)Nc1ccccc1)N(C)O Amb27390151 [0,1,0,0,0,1|0,0,2]=4 4705 B14R1.532 COC(OC)C(C)Sc1ccccc1 Amb32682540 [0,1,0,0,0,1|2,0,0]=4 4706 B14R1.1007 CCC(C)C(C)Nc1ccccc1C Amb6623835 [0,1,0,0,0,1|2,0,0]=4 4707 B14R1.1007 CCC(C)C(C)Nc1ccccc1F Amb6619227 [0,1,0,0,0,1|2,0,0]=4 4708 B14R1.1007 CNC(C)C(=O)Nc1ccccc1Br Amb25316527 [0,1,0,0,0,1|0,0,2]=4 4709 B14R1.1007 CNC(C)C(=O)Nc1ccccc1F Amb18993241 [0,1,0,0,0,1|0,0,2]=4 4710 B14R1.1007 CNC(C)C(=O)Nc1ccccc1I Amb27458902 [0,1,0,0,0,1|0,0,2]=4 4711 B14R1.1007 CN[C@@H](C)C(=O)Nc1ccccc1I Amb27165505 [0,1,0,0,0,1|0,0,2]=4 4712 B14R1.1031 CCC(C)C(C#N)Nc1ccccc1 Amb19047201 [0,1,0,0,0,1|2,0,0]=4 4713 B14R1.1107 CC(C#N)C(C)(O)Cc1ccccc1 Amb27869919 [0,1,0,0,0,1|2,0,0]=4 4714 B14R1.7 C=CC(C)C(O)c1ccc(C#N)cc1 Amb18649624 [0,2,0,0,0,0|1,0,1]=4 4715 B14R1.7 C=C[C@H](C)[C@@H](O)c1ccc(C#N)cc1 Amb27751882 [0,2,0,0,0,0|1,0,1]=4 4716 B14R1.7 CC(CO)C(O)c1ccc(C#N)cc1 Amb28138670 [0,2,0,0,0,0|2,0,0]=4 4717 B14R1.7 CCC(C)[C@@H](N)c1ccc(C#N)cc1 Amb28056144 [0,2,0,0,0,0|2,0,0]=4 4718 B14R1.7 CCC(N)C(O)c1ccc(C#N)cc1 Amb28122597 [0,2,0,0,0,0|2,0,0]=4 4719 B14R1.7 CCc1ccc(C(O)C(=O)NC)cc1 Amb27481161 [0,2,0,0,0,0|1,0,1]=4 4720 B14R1.7 CCc1ccc(C(O)C(C)C#N)cc1 Amb27234457 [0,2,0,0,0,0|2,0,0]=4 4721 B14R1.7 CNC(=O)C(O)c1ccc(OC)cc1 Amb17402007 [0,2,0,0,0,0|1,0,1]=4 4722 B14R1.7 CNC(=O)C(O)c1ccc(SC)cc1 Amb27183465 [0,2,0,0,0,0|1,0,1]=4 4723 B14R1.7 CNC(C)C(=O)c1ccc(OC)cc1 Amb16185412 [0,2,0,0,0,0|0,0,2]=4 4724 B14R1.7 CNC(C)C(=O)c1ccc(OC)cc1 Amb17601314 [0,2,0,0,0,0|0,0,2]=4 4725 B14R1.7 CNC(C)C(=O)c1ccc(SC)cc1 Amb18896148 [0,2,0,0,0,0|0,0,2]=4 4726 B14R1.7 COc1ccc(C(O)C(C)C#N)cc1 Amb27586648 [0,2,0,0,0,0|2,0,0]=4 4727 B14R1.35 CC(CC#N)C(O)c1ccc(Br)cc1 Amb17354631 [0,2,0,0,0,0|1,0,1]=4 4728 B14R1.35 CC(CCN)C(C)c1ccc(F)cc1 Amb33274570 [0,2,0,0,0,0|2,0,0]=4 4729 B14R1.35 CC(CCN)C(O)c1ccc(F)cc1 Amb18812299 [0,2,0,0,0,0|1,0,0]=3 4730 B14R1.35 CC(N=[N+]=[N-])C(O)c1ccc(F)cc1 Amb27491482 [0,2,0,0,0,0|1,0,1]=4 4731 B14R1.35 CCNC(=O)C(O)c1ccc(C)cc1 Amb17401751 [0,2,0,0,0,0|1,0,1]=4 4732 B14R1.35 CCNC(=O)C(O)c1ccc(Cl)cc1 Amb17404286 [0,2,0,0,0,0|1,0,1]=4 4733 B14R1.35 CCNC(=O)C(O)c1ccc(F)cc1 Amb17402178 [0,2,0,0,0,0|1,0,1]=4 4734 B14R1.35 CCNC(C)C(=O)c1ccc(Br)cc1 Amb17312901 [0,2,0,0,0,0|0,0,2]=4 4735 B14R1.35 CCNC(C)C(=O)c1ccc(C)cc1 Amb18368596 [0,2,0,0,0,0|0,0,2]=4 4736 B14R1.35 CCNC(C)C(=O)c1ccc(Cl)cc1 Amb17312922 [0,2,0,0,0,0|0,0,2]=4 4737 B14R1.35 CCNC(C)C(=O)c1ccc(F)cc1 Amb17312980 [0,2,0,0,0,0|0,0,2]=4 4738 B14R1.35 CCNC(C)C(=O)c1ccc(N)cc1 Amb18051396 [0,2,0,0,0,0|0,0,2]=4 4739 B14R1.35 CNCC(O)C(C)c1ccc(F)cc1 Amb33274568 [0,2,0,0,0,0|2,0,0]=4 4740 B14R1.35 Cc1ccc(C(O)C(C)N=[N+]=[N-])cc1 Amb25950996 [0,2,0,0,0,0|1,0,1]=4 4741 B14R1.88 CCC(C#N)C(O)c1ccc(C)cc1 Amb27635187 [0,2,0,0,0,0|1,0,1]=4 4742 B14R1.88 CCC(CC)C(N)c1ccc(Br)cc1 Amb6279188 [0,2,0,0,0,0|2,0,0]=4 4743 B14R1.88 CCC(CC)C(N)c1ccc(C)cc1 Amb6663564 [0,2,0,0,0,0|2,0,0]=4 4744 B14R1.88 CCC(CC)C(N)c1ccc(Cl)cc1 Amb6663499 [0,2,0,0,0,0|2,0,0]=4 4745 B14R1.88 CCC(CC)C(N)c1ccc(F)cc1 Amb6663480 [0,2,0,0,0,0|2,0,0]=4 4746 B14R1.88 CCC(NC)C(=O)c1ccc(Br)cc1 Amb18585777 [0,2,0,0,0,0|0,0,2]=4 4747 B14R1.88 CCC(NC)C(=O)c1ccc(C)cc1 Amb18564930 [0,2,0,0,0,0|0,0,2]=4 4748 B14R1.88 CCC(NC)C(=O)c1ccc(Cl)cc1 Amb18569398 [0,2,0,0,0,0|0,0,2]=4 4749 B14R1.88 CCC(NC)C(=O)c1ccc(F)cc1 Amb18565685 [0,2,0,0,0,0|0,0,2]=4 4750 B14R1.88 CCC(NC)C(=O)c1ccc(N)cc1 Amb18051476 [0,2,0,0,0,0|0,0,2]=4 4751 B14R1.88 CCC(NC)C(O)c1ccc(Br)cc1 Amb18604998 [0,2,0,0,0,0|0,0,0]=2 4752 B14R1.88 CCC(NC)C(O)c1ccc(Cl)cc1 Amb18605051 [0,2,0,0,0,0|0,0,0]=2 4753 B14R1.88 CCC(NC)C(O)c1ccc(F)cc1 Amb18605161 [0,2,0,0,0,0|0,0,0]=2 4754 B14R1.88 CC[C@@H](C#N)[C@H](O)c1ccc(C)cc1 Amb27456717 [0,2,0,0,0,0|1,0,1]=4 4755 B14R1.88 CC[C@H](C#N)[C@@H](O)c1ccc(C)cc1 Amb27805372 [0,2,0,0,0,0|1,0,1]=4 4756 B14R1.88 COC(OC)C(C)c1ccc(C)cc1 Amb24066881 [0,2,0,0,0,0|2,0,0]=4 4757 B14R1.132 CC(=O)C(C)C(O)c1ccc(C)cc1 Amb27198095 [0,2,0,0,0,0|1,0,0]=3 4758 B14R1.132 CC(=O)[C@@H](O)[C@H](O)c1ccc(F)cc1 Amb27835870 [0,2,0,0,0,0|2,0,0]=4 4759 B14R1.132 CC(=O)[C@H](C)[C@H](O)c1ccc(C)cc1 Amb27457655 [0,2,0,0,0,0|1,0,0]=3 4760 B14R1.132 CC(C(=O)O)C(O)c1ccc(F)cc1 Amb18990625 [0,2,0,0,0,0|2,0,0]=4 4761 B14R1.132 CC(C(=O)c1ccc(F)cc1)N(C)C Amb9661078 [0,2,0,0,0,0|0,0,2]=4 4762 B14R1.132 CC(C(=O)c1ccc(N)cc1)N(C)C Amb18549934 [0,2,0,0,0,0|0,0,2]=4 4763 B14R1.132 CC(C(=O)c1ccc(O)cc1)N(C)C Amb27612590 [0,2,0,0,0,0|0,0,2]=4 4764 B14R1.132 CC(C(O)c1ccc(Cl)cc1)[N+](=O)[O-] Amb27668466 [0,2,0,0,0,0|1,0,1]=4 4765 B14R1.132 CC(C(O)c1ccc(N)cc1)N(C)C Amb28342348 [0,2,0,0,0,0|0,0,0]=2 4766 B14R1.132 CC(C)C(C)C(Br)c1ccc(Br)cc1 Amb27754461 [0,2,0,0,0,0|2,0,0]=4 4767 B14R1.132 CC(C)C(C)C(Cl)c1ccc(F)cc1 Amb27955478 [0,2,0,0,0,0|2,0,0]=4 4768 B14R1.132 CC(C)C(C)C(N)c1ccc(I)cc1 Amb28314275 [0,2,0,0,0,0|2,0,0]=4 4769 B14R1.132 CC(C)C(C)C(O)c1ccc(Cl)nc1 Amb28386376 [0,2,0,0,0,0|2,0,0]=4 4770 B14R1.132 CC(C)C(C)C(O)c1ccc(F)cn1 Amb28140594 [0,2,0,0,0,0|2,0,0]=4 4771 B14R1.132 CC(C)C(C)C(O)c1ccc(I)cc1 Amb27666278 [0,2,0,0,0,0|1,0,0]=3 4772 B14R1.132 CC(C)C(C)C(O)c1ccc(N)cn1 Amb35625333 [0,2,0,0,0,0|2,0,0]=4 4773 B14R1.132 CC(C)C(N)C(O)c1ccc(Br)cc1 Amb17162860 [0,2,0,0,0,0|2,0,0]=4 4774 B14R1.132 CC(C)C(N)C(O)c1ccc(Cl)cc1 Amb17140814 [0,2,0,0,0,0|2,0,0]=4 4775 B14R1.132 CC(C)C(N)C(O)c1ccc(Cl)cc1 Amb28653277 [0,2,0,0,0,0|2,0,0]=4 4776 B14R1.132 CC(C)C(N)C(O)c1ccc(I)cc1 Amb27246021 [0,2,0,0,0,0|2,0,0]=4 4777 B14R1.132 CC(C)C(N)C(O)c1ccc(N)cc1 Amb28384630 [0,2,0,0,0,0|2,0,0]=4 4778 B14R1.132 CC(C)C(N)C(O)c1ccc(O)cc1 Amb27765362 [0,2,0,0,0,0|2,0,0]=4 4779 B14R1.132 CC(C)C(O)C(O)c1ccc(Br)cc1 Amb35605459 [0,2,0,0,0,0|2,0,0]=4 4780 B14R1.132 CC(C)C(O)C(O)c1ccc(Cl)cc1 Amb27189920 [0,2,0,0,0,0|2,0,0]=4 4781 B14R1.132 CC(C)[C@@H](N)C(O)c1ccc(Br)cc1 Amb35623724 [0,2,0,0,0,0|2,0,0]=4 4782 B14R1.132 CC(C)[C@@H](N)C(O)c1ccc(Cl)cc1 Amb35623668 [0,2,0,0,0,0|2,0,0]=4 4783 B14R1.132 CC(C)[C@@H](N)C(O)c1ccc(F)cc1 Amb35623856 [0,2,0,0,0,0|2,0,0]=4 4784 B14R1.132 CC(C)[C@@H](N)[C@@H](O)c1ccc(F)cc1 Amb27389095 [0,2,0,0,0,0|2,0,0]=4 4785 B14R1.132 CC(C)[C@@H](N)[C@@H](O)c1ccc(N)cc1 Amb28434718 [0,2,0,0,0,0|2,0,0]=4 4786 B14R1.132 CC(C)[C@@H](N)[C@H](O)c1ccc(F)cc1 Amb27788511 [0,2,0,0,0,0|2,0,0]=4 4787 B14R1.132 CC(C)[C@@H](N)[C@H](O)c1ccc(N)cc1 Amb27804092 [0,2,0,0,0,0|2,0,0]=4 4788 B14R1.132 CC(C)[C@@H](O)[C@H](O)c1ccc(F)cc1 Amb27589735 [0,2,0,0,0,0|2,0,0]=4 4789 B14R1.132 CC(C)[C@H](N)C(O)c1ccc(Br)cc1 Amb35588317 [0,2,0,0,0,0|2,0,0]=4 4790 B14R1.132 CC(C)[C@H](N)C(O)c1ccc(Cl)cc1 Amb35588417 [0,2,0,0,0,0|2,0,0]=4 4791 B14R1.132 CC(C)[C@H](N)C(O)c1ccc(F)cc1 Amb35588421 [0,2,0,0,0,0|2,0,0]=4 4792 B14R1.132 CC(C)[C@H](N)[C@@H](O)c1ccc(Cl)cc1 Amb28384699 [0,2,0,0,0,0|2,0,0]=4 4793 B14R1.132 CC(C)[C@H](N)[C@@H](O)c1ccc(F)cc1 Amb27439975 [0,2,0,0,0,0|2,0,0]=4 4794 B14R1.132 CC(C)[C@H](N)[C@@H](O)c1ccc(O)cc1 Amb27620449 [0,2,0,0,0,0|2,0,0]=4 4795 B14R1.132 CC(C)[C@H](N)[C@H](O)c1ccc(N)cc1 Amb28056075 [0,2,0,0,0,0|2,0,0]=4 4796 B14R1.132 CC(C)[C@H](N)[C@H](O)c1ccc(O)cc1 Amb27204642 [0,2,0,0,0,0|2,0,0]=4 4797 B14R1.132 CC(N)C(C)C(O)c1ccc(Br)cc1 Amb35624838 [0,2,0,0,0,0|1,0,0]=3 4798 B14R1.132 CC(N)C(C)C(O)c1ccc(Cl)cc1 Amb35624684 [0,2,0,0,0,0|1,0,0]=3 4799 B14R1.132 CC(N)C(C)C(O)c1ccc(F)cc1 Amb35621769 [0,2,0,0,0,0|1,0,0]=3 4800 B14R1.132 CN(C)C(=O)C(O)c1ccc(Br)cc1 Amb24535654 [0,2,0,0,0,0|1,0,1]=4 4801 B14R1.132 CN(C)C(=O)C(O)c1ccc(Cl)cc1 Amb17404287 [0,2,0,0,0,0|1,0,1]=4 4802 B14R1.132 CN(C)C(=O)C(O)c1ccc(F)cc1 Amb17402179 [0,2,0,0,0,0|1,0,1]=4 4803 B14R1.132 C[C@@H](C(=O)O)[C@@H](O)c1ccc(Cl)cc1 Amb27169488 [0,2,0,0,0,0|2,0,0]=4 4804 B14R1.132 Cc1ccc(C(Br)C(C)C(C)C)cc1 Amb27759617 [0,2,0,0,0,0|2,0,0]=4 4805 B14R1.132 Cc1ccc(C(N)C(C)S(C)=O)cc1 Amb27797071 [0,2,0,0,0,0|2,0,0]=4 4806 B14R1.132 Cc1ccc(C(O)C(=O)N(C)C)cc1 Amb17401752 [0,2,0,0,0,0|1,0,1]=4 4807 B14R1.132 Cc1ccc(C(O)C(C)C(=O)O)cc1 Amb3194333 [0,2,0,0,0,0|2,0,0]=4 4808 B14R1.132 Cc1ccc(C(O)C(C)C(C)C)cn1 Amb28063329 [0,2,0,0,0,0|2,0,0]=4 4809 B14R1.132 Cc1ccc(C(O)C(C)C(C)N)cc1 Amb35621667 [0,2,0,0,0,0|1,0,0]=3 4810 B14R1.132 Cc1ccc(C(O)C(C)C(C)N)cn1 Amb35624766 [0,2,0,0,0,0|2,0,0]=4 4811 B14R1.132 Cc1ccc(C(O)C(C)[N+](=O)[O-])cc1 Amb27610783 [0,2,0,0,0,0|1,0,1]=4 4812 B14R1.132 Cc1ccc(C(O)[C@@H](N)C(C)C)cc1 Amb35623964 [0,2,0,0,0,0|2,0,0]=4 4813 B14R1.132 Cc1ccc(C(O)[C@H](N)C(C)C)cc1 Amb35623661 [0,2,0,0,0,0|2,0,0]=4 4814 B14R1.305 CC(C)(C#N)C(O)c1ccc(Br)cc1 Amb27387175 [0,2,0,0,0,0|2,0,0]=4 4815 B14R1.305 CC(C)(C=O)[C@@H](O)c1ccc(F)cc1 Amb27446635 [0,2,0,0,0,0|2,0,0]=4 4816 B14R1.305 CC(C)(CN)C(O)c1ccc(Br)cc1 Amb28043627 [0,2,0,0,0,0|2,0,0]=4 4817 B14R1.305 CC(C)(CN)C(O)c1ccc(Cl)cc1 Amb18914854 [0,2,0,0,0,0|2,0,0]=4 4818 B14R1.305 CC(C)(CN)C(O)c1ccc(I)cc1 Amb27860664 [0,2,0,0,0,0|2,0,0]=4 4819 B14R1.305 CCC(C)(C)C(Br)c1ccc(Cl)cc1 Amb27227583 [0,2,0,0,0,0|2,0,0]=4 4820 B14R1.305 CCC(C)(C)C(N)c1ccc(C)cc1 Amb19073682 [0,2,0,0,0,0|2,0,0]=4 4821 B14R1.305 CCC(C)(N)C(O)c1ccc(Br)cc1 Amb35742164 [0,2,0,0,0,0|1,0,0]=3 4822 B14R1.305 CCC(C)(N)C(O)c1ccc(C)cc1 Amb35587024 [0,2,0,0,0,0|1,0,0]=3 4823 B14R1.305 CCC(C)(N)C(O)c1ccc(C)nc1 Amb35742115 [0,2,0,0,0,0|2,0,0]=4 4824 B14R1.305 CCC(C)(N)C(O)c1ccc(Cl)cc1 Amb35587089 [0,2,0,0,0,0|1,0,0]=3 4825 B14R1.305 CCC(C)(N)C(O)c1ccc(F)cc1 Amb35587094 [0,2,0,0,0,0|1,0,0]=3 4826 B14R1.305 CCC(C)(O)C(O)c1ccc(Br)cc1 Amb35605458 [0,2,0,0,0,0|1,0,0]=3 4827 B14R1.305 CCC(F)(F)C(O)c1ccc(Br)cc1 Amb35645018 [0,2,0,0,0,0|2,0,0]=4 4828 B14R1.305 CCC(F)(F)C(O)c1ccc(C)cc1 Amb35645010 [0,2,0,0,0,0|2,0,0]=4 4829 B14R1.305 CCC(F)(F)C(O)c1ccc(Cl)cc1 Amb35645015 [0,2,0,0,0,0|2,0,0]=4 4830 B14R1.305 CCC(F)(F)C(O)c1ccc(F)cc1 Amb35645011 [0,2,0,0,0,0|2,0,0]=4 4831 B14R1.305 CNC(C)(C)C(=O)c1ccc(Br)cc1 Amb35614548 [0,2,0,0,0,0|0,0,2]=4 4832 B14R1.305 CNC(C)(C)C(=O)c1ccc(Cl)cc1 Amb27588005 [0,2,0,0,0,0|0,0,2]=4 4833 B14R1.305 CNC(C)(C)C(C)c1ccc(F)cc1 Amb33273303 [0,2,0,0,0,0|1,0,0]=3 4834 B14R1.305 CNC(C)(C)C(F)c1ccc(Br)cc1 Amb35591795 [0,2,0,0,0,0|1,0,0]=3 4835 B14R1.305 CNC(C)(C)C(F)c1ccc(Cl)cc1 Amb27656913 [0,2,0,0,0,0|1,0,0]=3 4836 B14R1.305 CNC(C)(C)C(O)c1ccc(Br)cc1 Amb35614535 [0,2,0,0,0,0|0,0,0]=2 4837 B14R1.305 CNC(C)(C)C(O)c1ccc(C)cc1 Amb27836240 [0,2,0,0,0,0|0,0,0]=2 4838 B14R1.305 CNC(C)(C)C(O)c1ccc(C)nc1 Amb35678372 [0,2,0,0,0,0|1,0,0]=3 4839 B14R1.305 COC(C)(C)C(N)c1ccc(Br)cc1 Amb35591581 [0,2,0,0,0,0|2,0,0]=4 4840 B14R1.305 COC(C)(C)C(N)c1ccc(C)cc1 Amb27466670 [0,2,0,0,0,0|2,0,0]=4 4841 B14R1.305 COC(C)(C)C(O)c1ccc(Br)cc1 Amb35614296 [0,2,0,0,0,0|1,0,0]=3 4842 B14R1.305 CSC(C)(C)C(N)c1ccc(Br)cc1 Amb30021563 [0,2,0,0,0,0|2,0,0]=4 4843 B14R1.305 CSC(C)(C)C(O)c1ccc(Br)cc1 Amb35605461 [0,2,0,0,0,0|1,0,0]=3 4844 B14R1.305 CSC(C)(C)C(O)c1ccc(Cl)cc1 Amb28145514 [0,2,0,0,0,0|1,0,0]=3 4845 B14R1.305 Cc1ccc(C(O)C(C)(C)C#N)cc1 Amb27792575 [0,2,0,0,0,0|2,0,0]=4 4846 B14R1.305 Cc1ccc([C@@H](O)C(C)(C)CO)cc1 Amb27495448 [0,2,0,0,0,0|2,0,0]=4 4847 B14R1.710 CCC(C)C(C#N)c1ccc(C)cc1 Amb28322942 [0,2,0,0,0,0|2,0,0]=4 4848 B14R1.710 CCC(C)C(C#N)c1ccc(N)cc1 Amb27604843 [0,2,0,0,0,0|2,0,0]=4 4849 B14R1.1003 CC(C#N)C(O)c1ccc(Br)c(Br)c1 Amb27948848 [0,2,0,0,0,0|2,0,0]=4 4850 B14R1.1003 CC(C#N)C(O)c1ccc(Br)c(F)c1 Amb27971448 [0,2,0,0,0,0|2,0,0]=4 4851 B14R1.1003 CC(C#N)C(O)c1ccc(Cl)c(Br)c1 Amb28250596 [0,2,0,0,0,0|2,0,0]=4 4852 B14R1.1003 CC(CN)C(O)c1ccc(Br)c(F)c1 Amb27632522 [0,2,0,0,0,0|2,0,0]=4 4853 B14R1.1003 CC(CN)C(O)c1ccc(Cl)c(Cl)c1 Amb27163617 [0,2,0,0,0,0|2,0,0]=4 4854 B14R1.1003 CC(CN)C(O)c1ccc(Cl)c(F)c1 Amb27755105 [0,2,0,0,0,0|2,0,0]=4 4855 B14R1.1003 CCC(C)C(Br)c1ccc(C)c(C)c1 Amb27250063 [0,2,0,0,0,0|2,0,0]=4 4856 B14R1.1003 CCC(C)C(Br)c1ccc(Cl)c(Cl)c1 Amb28075716 [0,2,0,0,0,0|2,0,0]=4 4857 B14R1.1003 CCC(C)C(Br)c1ccc(F)c(C)c1 Amb28207571 [0,2,0,0,0,0|2,0,0]=4 4858 B14R1.1003 CCC(C)C(Cl)c1ccc(C)c(F)c1 Amb27591062 [0,2,0,0,0,0|2,0,0]=4 4859 B14R1.1003 CCC(C)C(Cl)c1ccc(F)c(Cl)c1 Amb35615650 [0,2,0,0,0,0|2,0,0]=4 4860 B14R1.1003 CCC(C)C(N)c1ccc(Br)c(Br)c1 Amb27852161 [0,2,0,0,0,0|2,0,0]=4 4861 B14R1.1003 CCC(C)C(N)c1ccc(Br)c(C)c1 Amb27390899 [0,2,0,0,0,0|2,0,0]=4 4862 B14R1.1003 CCC(C)C(N)c1ccc(C)c(Br)c1 Amb27172853 [0,2,0,0,0,0|2,0,0]=4 4863 B14R1.1003 CCC(C)C(N)c1ccc(C)c(F)c1 Amb27412097 [0,2,0,0,0,0|2,0,0]=4 4864 B14R1.1003 CCC(C)C(N)c1ccc(Cl)c(Cl)c1 Amb8995872 [0,2,0,0,0,0|2,0,0]=4 4865 B14R1.1003 CCC(C)C(N)c1ccc(Cl)c(F)c1 Amb28126173 [0,2,0,0,0,0|2,0,0]=4 4866 B14R1.1003 CCC(C)C(N)c1ccc(F)c(C)c1 Amb27170286 [0,2,0,0,0,0|2,0,0]=4 4867 B14R1.1003 CCC(C)C(N)c1ccc(F)c(F)c1 Amb6703635 [0,2,0,0,0,0|2,0,0]=4 4868 B14R1.1003 CCC(C)C(N)c1ccc(O)c(O)c1 Amb27195921 [0,2,0,0,0,0|2,0,0]=4 4869 B14R1.1003 CCC(C)C(O)c1ccc(Br)c(F)c1 Amb27980807 [0,2,0,0,0,0|1,0,0]=3 4870 B14R1.1003 CCC(C)C(O)c1ccc(C)c(F)c1 Amb27402386 [0,2,0,0,0,0|1,0,0]=3 4871 B14R1.1003 CCC(C)C(O)c1ccc(C)c(N)c1 Amb30024228 [0,2,0,0,0,0|1,0,0]=3 4872 B14R1.1003 CCC(C)C(O)c1ccc(Cl)c(Cl)c1 Amb28381763 [0,2,0,0,0,0|1,0,0]=3 4873 B14R1.1003 CCC(C)C(O)c1ccc(Cl)c(N)c1 Amb35620894 [0,2,0,0,0,0|1,0,0]=3 4874 B14R1.1003 CCC(C)C(O)c1ccc(F)c(Br)c1 Amb27403433 [0,2,0,0,0,0|1,0,0]=3 4875 B14R1.1003 CCC(C)C(O)c1ccc(F)c(C)c1 Amb27389736 [0,2,0,0,0,0|1,0,0]=3 4876 B14R1.1003 CCC(C)C(O)c1ccc(I)c(Cl)c1 Amb27267717 [0,2,0,0,0,0|1,0,0]=3 4877 B14R1.1003 CCC(C)C(O)c1ccc(N)c(Br)c1 Amb35740793 [0,2,0,0,0,0|1,0,0]=3 4878 B14R1.1003 CCC(C)C(O)c1ccc(N)c(C)c1 Amb35588583 [0,2,0,0,0,0|1,0,0]=3 4879 B14R1.1003 CCC(C)C(O)c1ccc(N)c(Cl)c1 Amb35583014 [0,2,0,0,0,0|1,0,0]=3 4880 B14R1.1003 CCC(C)C(O)c1ccc(N)c(F)c1 Amb35740627 [0,2,0,0,0,0|1,0,0]=3 4881 B14R1.1003 CCC(C)[C@@H](N)c1ccc(Br)c(F)c1 Amb27430515 [0,2,0,0,0,0|2,0,0]=4 4882 B14R1.1003 CCC(C)[C@@H](N)c1ccc(Cl)c(Br)c1 Amb27475410 [0,2,0,0,0,0|2,0,0]=4 4883 B14R1.1003 CCC(C)[C@@H](N)c1ccc(F)c(Br)c1 Amb27777318 [0,2,0,0,0,0|2,0,0]=4 4884 B14R1.1003 CCC(C)[C@@H](N)c1ccc(O)c(O)c1 Amb27631068 [0,2,0,0,0,0|2,0,0]=4 4885 B14R1.1003 CCC(C)[C@H](N)c1ccc(C)c(F)c1 Amb28346902 [0,2,0,0,0,0|2,0,0]=4 4886 B14R1.1003 CCC(C)[C@H](N)c1ccc(Cl)c(Br)c1 Amb27776101 [0,2,0,0,0,0|2,0,0]=4 4887 B14R1.1003 CCC(C)[C@H](N)c1ccc(F)c(Cl)c1 Amb28430177 [0,2,0,0,0,0|2,0,0]=4 4888 B14R1.1003 CCC(C)[C@H](N)c1ccc(O)c(Br)c1 Amb27620495 [0,2,0,0,0,0|2,0,0]=4 4889 B14R1.1003 CCC(C)[C@H](N)c1ccc(O)c(Cl)c1 Amb27627111 [0,2,0,0,0,0|2,0,0]=4 4890 B14R1.1003 CCC(C)[C@H](N)c1ccc(O)c(F)c1 Amb27804032 [0,2,0,0,0,0|2,0,0]=4 4891 B14R1.1003 CCC(N)C(O)c1ccc(Br)c(Br)c1 Amb27633758 [0,2,0,0,0,0|2,0,0]=4 4892 B14R1.1003 CCC(N)C(O)c1ccc(Br)c(Cl)c1 Amb28186844 [0,2,0,0,0,0|2,0,0]=4 4893 B14R1.1003 CCC(N)C(O)c1ccc(Br)c(F)c1 Amb27441673 [0,2,0,0,0,0|2,0,0]=4 4894 B14R1.1003 CCC(N)C(O)c1ccc(C)c(Br)c1 Amb27450559 [0,2,0,0,0,0|2,0,0]=4 4895 B14R1.1003 CCC(N)C(O)c1ccc(C)c(Cl)c1 Amb28255093 [0,2,0,0,0,0|2,0,0]=4 4896 B14R1.1003 CCC(N)C(O)c1ccc(Cl)c(Br)c1 Amb27601862 [0,2,0,0,0,0|2,0,0]=4 4897 B14R1.1003 CCC(N)C(O)c1ccc(F)c(C)c1 Amb17139659 [0,2,0,0,0,0|2,0,0]=4 4898 B14R1.1003 CCC(N)C(O)c1ccc(F)c(Cl)c1 Amb27395031 [0,2,0,0,0,0|2,0,0]=4 4899 B14R1.1003 CCC(N)C(O)c1ccc(F)c(N)c1 Amb28422799 [0,2,0,0,0,0|2,0,0]=4 4900 B14R1.1003 CCC(N)C(O)c1ccc(N)c(C)c1 Amb28132491 [0,2,0,0,0,0|2,0,0]=4 4901 B14R1.1003 CCC(N)C(O)c1ccc(N)c(N)c1 Amb27985367 [0,2,0,0,0,0|2,0,0]=4 4902 B14R1.1003 CCC(N)C(O)c1ccc(O)c(C)c1 Amb27444835 [0,2,0,0,0,0|2,0,0]=4 4903 B14R1.1003 CCC(N)C(O)c1ccc(O)c(F)c1 Amb27205037 [0,2,0,0,0,0|2,0,0]=4 4904 B14R1.1003 CCC(N)C(O)c1ccc(O)c(N)c1 Amb27445139 [0,2,0,0,0,0|2,0,0]=4 4905 B14R1.1003 CCC(O)C(O)c1ccc(F)c(C)c1 Amb27183643 [0,2,0,0,0,0|2,0,0]=4 4906 B14R1.1003 CCC(O)C(O)c1ccc(F)c(Cl)c1 Amb35632920 [0,2,0,0,0,0|2,0,0]=4 4907 B14R1.1003 CC[C@@H](N)C(O)c1ccc(C)c(C)c1 Amb35659448 [0,2,0,0,0,0|2,0,0]=4 4908 B14R1.1003 CC[C@@H](N)C(O)c1ccc(C)c(Cl)c1 Amb30038856 [0,2,0,0,0,0|2,0,0]=4 4909 B14R1.1003 CC[C@@H](N)C(O)c1ccc(C)c(F)c1 Amb35659446 [0,2,0,0,0,0|2,0,0]=4 4910 B14R1.1003 CC[C@@H](N)C(O)c1ccc(Cl)c(Cl)c1 Amb35659449 [0,2,0,0,0,0|2,0,0]=4 4911 B14R1.1003 CC[C@@H](N)C(O)c1ccc(F)c(C)c1 Amb35659324 [0,2,0,0,0,0|2,0,0]=4 4912 B14R1.1003 CC[C@@H](N)C(O)c1ccc(F)c(Cl)c1 Amb30038859 [0,2,0,0,0,0|2,0,0]=4 4913 B14R1.1003 CC[C@@H](N)C(O)c1ccc(F)c(F)c1 Amb35659412 [0,2,0,0,0,0|2,0,0]=4 4914 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(Cl)c(F)c1 Amb27985339 [0,2,0,0,0,0|2,0,0]=4 4915 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(F)c(C)c1 Amb28057804 [0,2,0,0,0,0|2,0,0]=4 4916 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(F)c(N)c1 Amb27201448 [0,2,0,0,0,0|2,0,0]=4 4917 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(N)c(Cl)c1 Amb27430510 [0,2,0,0,0,0|2,0,0]=4 4918 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(O)c(F)c1 Amb27201475 [0,2,0,0,0,0|2,0,0]=4 4919 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(C)c(C)c1 Amb27437357 [0,2,0,0,0,0|2,0,0]=4 4920 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(Cl)c(Cl)c1 Amb27430511 [0,2,0,0,0,0|2,0,0]=4 4921 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(Cl)c(F)c1 Amb27437382 [0,2,0,0,0,0|2,0,0]=4 4922 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(F)c(Cl)c1 Amb27430508 [0,2,0,0,0,0|2,0,0]=4 4923 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(N)c(C)c1 Amb28072104 [0,2,0,0,0,0|2,0,0]=4 4924 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(N)c(Cl)c1 Amb27872422 [0,2,0,0,0,0|2,0,0]=4 4925 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(N)c(N)c1 Amb28055984 [0,2,0,0,0,0|2,0,0]=4 4926 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(O)c(C)c1 Amb27445212 [0,2,0,0,0,0|2,0,0]=4 4927 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(O)c(Cl)c1 Amb27430328 [0,2,0,0,0,0|2,0,0]=4 4928 B14R1.1003 CC[C@H](N)C(O)c1ccc(C)c(C)c1 Amb35601348 [0,2,0,0,0,0|2,0,0]=4 4929 B14R1.1003 CC[C@H](N)C(O)c1ccc(C)c(Cl)c1 Amb35601354 [0,2,0,0,0,0|2,0,0]=4 4930 B14R1.1003 CC[C@H](N)C(O)c1ccc(C)c(F)c1 Amb35601346 [0,2,0,0,0,0|2,0,0]=4 4931 B14R1.1003 CC[C@H](N)C(O)c1ccc(Cl)c(Cl)c1 Amb35601349 [0,2,0,0,0,0|2,0,0]=4 4932 B14R1.1003 CC[C@H](N)C(O)c1ccc(F)c(C)c1 Amb35601436 [0,2,0,0,0,0|2,0,0]=4 4933 B14R1.1003 CC[C@H](N)C(O)c1ccc(F)c(Cl)c1 Amb35601507 [0,2,0,0,0,0|2,0,0]=4 4934 B14R1.1003 CC[C@H](N)C(O)c1ccc(F)c(F)c1 Amb35601512 [0,2,0,0,0,0|2,0,0]=4 4935 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(C)c(Cl)c1 Amb28422791 [0,2,0,0,0,0|2,0,0]=4 4936 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(Cl)c(Cl)c1 Amb27788469 [0,2,0,0,0,0|2,0,0]=4 4937 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(Cl)c(F)c1 Amb27640371 [0,2,0,0,0,0|2,0,0]=4 4938 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(F)c(C)c1 Amb27964171 [0,2,0,0,0,0|2,0,0]=4 4939 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(N)c(C)c1 Amb27204886 [0,2,0,0,0,0|2,0,0]=4 4940 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(N)c(F)c1 Amb28129311 [0,2,0,0,0,0|2,0,0]=4 4941 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(O)c(O)c1 Amb27650398 [0,2,0,0,0,0|2,0,0]=4 4942 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(C)c(C)c1 Amb27220919 [0,2,0,0,0,0|2,0,0]=4 4943 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(C)c(N)c1 Amb27848288 [0,2,0,0,0,0|2,0,0]=4 4944 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(C)c(O)c1 Amb27430318 [0,2,0,0,0,0|2,0,0]=4 4945 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(Cl)c(C)c1 Amb27430502 [0,2,0,0,0,0|2,0,0]=4 4946 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(F)c(Cl)c1 Amb27789954 [0,2,0,0,0,0|2,0,0]=4 4947 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(F)c(F)c1 Amb28346911 [0,2,0,0,0,0|2,0,0]=4 4948 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(N)c(Cl)c1 Amb27234024 [0,2,0,0,0,0|2,0,0]=4 4949 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(O)c(C)c1 Amb28131218 [0,2,0,0,0,0|2,0,0]=4 4950 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(O)c(Cl)c1 Amb27777361 [0,2,0,0,0,0|2,0,0]=4 4951 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(O)c(N)c1 Amb27864227 [0,2,0,0,0,0|2,0,0]=4 4952 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(O)c(O)c1 Amb27665464 [0,2,0,0,0,0|2,0,0]=4 4953 B14R1.1003 CNC(=O)C(O)c1ccc(C)c(C)c1 Amb17401754 [0,2,0,0,0,0|1,0,1]=4 4954 B14R1.1003 CNC(=O)C(O)c1ccc(Cl)c(Cl)c1 Amb27399529 [0,2,0,0,0,0|1,0,1]=4 4955 B14R1.1003 CNC(=O)C(O)c1ccc(F)c(C)c1 Amb17402180 [0,2,0,0,0,0|1,0,1]=4 4956 B14R1.1003 CNC(=O)C(O)c1ccc(F)c(Cl)c1 Amb26051164 [0,2,0,0,0,0|1,0,1]=4 4957 B14R1.1003 CNC(=O)C(O)c1ccc(F)c(F)c1 Amb24687028 [0,2,0,0,0,0|1,0,1]=4 4958 B14R1.1003 CNC(C)C(=O)c1ccc(C)c(C)c1 Amb17312723 [0,2,0,0,0,0|0,0,2]=4 4959 B14R1.1003 CNC(C)C(=O)c1ccc(C)c(C)c1 Amb18368594 [0,2,0,0,0,0|0,0,2]=4 4960 B14R1.1003 CNC(C)C(=O)c1ccc(Cl)c(C)c1 Amb17313190 [0,2,0,0,0,0|0,0,2]=4 4961 B14R1.1003 CNC(C)C(=O)c1ccc(F)c(C)c1 Amb18565688 [0,2,0,0,0,0|0,0,2]=4 4962 B14R1.1003 CNC(C)C(=O)c1ccc(F)c(Cl)c1 Amb18244255 [0,2,0,0,0,0|0,0,2]=4 4963 B14R1.1003 CNC(C)C(=O)c1ccc(F)c(F)c1 Amb18566084 [0,2,0,0,0,0|0,0,2]=4 4964 B14R1.1003 CNC(C)C(C)c1ccc(F)c(Br)c1 Amb27458134 [0,2,0,0,0,0|1,0,0]=3 4965 B14R1.1003 CNC(C)C(O)c1ccc(C)c(C)c1 Amb18565358 [0,2,0,0,0,0|0,0,0]=2 4966 B14R1.1003 CNC(C)C(O)c1ccc(C)c(Cl)c1 Amb35621418 [0,2,0,0,0,0|0,0,0]=2 4967 B14R1.1003 CNC(C)C(O)c1ccc(C)c(F)c1 Amb35621409 [0,2,0,0,0,0|0,0,0]=2 4968 B14R1.1003 CNC(C)C(O)c1ccc(Cl)c(C)c1 Amb18605441 [0,2,0,0,0,0|0,0,0]=2 4969 B14R1.1003 CNC(C)C(O)c1ccc(Cl)c(Cl)c1 Amb18095103 [0,2,0,0,0,0|0,0,0]=2 4970 B14R1.1003 CNC(C)C(O)c1ccc(F)c(C)c1 Amb18565964 [0,2,0,0,0,0|0,0,0]=2 4971 B14R1.1003 CNC(C)C(O)c1ccc(F)c(Cl)c1 Amb35741558 [0,2,0,0,0,0|0,0,0]=2 4972 B14R1.1003 CNC(C)C(O)c1ccc(F)c(F)c1 Amb18566309 [0,2,0,0,0,0|0,0,0]=2 4973 B14R1.1003 CNC(C)C(O)c1ccc(O)c(O)c1 Amb28063036 [0,2,0,0,0,0|0,0,0]=2 4974 B14R1.1003 CNC(C)C(O)c1cnc(C)c(C)c1 Amb29875700 [0,2,0,0,0,0|1,0,0]=3 4975 B14R1.1003 CN[C@@H](C)C(=O)c1ccc(C)c(C)c1 Amb29891469 [0,2,0,0,0,0|0,0,2]=4 4976 B14R1.1003 CN[C@@H](C)C(=O)c1ccc(C)c(Cl)c1 Amb35662193 [0,2,0,0,0,0|0,0,2]=4 4977 B14R1.1003 CN[C@@H](C)C(=O)c1ccc(C)c(F)c1 Amb29891585 [0,2,0,0,0,0|0,0,2]=4 4978 B14R1.1003 CN[C@@H](C)C(=O)c1ccc(Cl)c(Cl)c1 Amb35662201 [0,2,0,0,0,0|0,0,2]=4 4979 B14R1.1003 CN[C@@H](C)C(=O)c1ccc(F)c(C)c1 Amb29891582 [0,2,0,0,0,0|0,0,2]=4 4980 B14R1.1003 CN[C@@H](C)C(=O)c1ccc(F)c(Cl)c1 Amb35662333 [0,2,0,0,0,0|0,0,2]=4 4981 B14R1.1003 CN[C@@H](C)C(=O)c1ccc(F)c(F)c1 Amb29891592 [0,2,0,0,0,0|0,0,2]=4 4982 B14R1.1003 CN[C@@H](C)C(O)c1ccc(C)c(C)c1 Amb35662610 [0,2,0,0,0,0|0,0,0]=2 4983 B14R1.1003 CN[C@@H](C)C(O)c1ccc(C)c(Cl)c1 Amb30038945 [0,2,0,0,0,0|0,0,0]=2 4984 B14R1.1003 CN[C@@H](C)C(O)c1ccc(C)c(F)c1 Amb35662607 [0,2,0,0,0,0|0,0,0]=2 4985 B14R1.1003 CN[C@@H](C)C(O)c1ccc(Cl)c(Cl)c1 Amb35662611 [0,2,0,0,0,0|0,0,0]=2 4986 B14R1.1003 CN[C@@H](C)C(O)c1ccc(F)c(C)c1 Amb35663977 [0,2,0,0,0,0|0,0,0]=2 4987 B14R1.1003 CN[C@@H](C)C(O)c1ccc(F)c(Cl)c1 Amb30038948 [0,2,0,0,0,0|0,0,0]=2 4988 B14R1.1003 CN[C@@H](C)C(O)c1ccc(F)c(F)c1 Amb30038952 [0,2,0,0,0,0|0,0,0]=2 4989 B14R1.1003 CN[C@@H](C)C(O)c1cnc(C)c(C)c1 Amb29889823 [0,2,0,0,0,0|1,0,0]=3 4990 B14R1.1003 CN[C@H](C)[C@@H](O)c1ccc(O)c(O)c1 Amb27475644 [0,2,0,0,0,0|0,0,0]=2 4991 B14R1.1003 CN[C@H](C)[C@H](O)c1ccc(C)c(C)c1 Amb27440074 [0,2,0,0,0,0|0,0,0]=2 4992 B14R1.1003 COC(C)C(N)c1ccc(C)c(C)c1 Amb27873124 [0,2,0,0,0,0|2,0,0]=4 4993 B14R1.1003 COC(C)C(N)c1ccc(F)c(C)c1 Amb18812300 [0,2,0,0,0,0|2,0,0]=4 4994 B14R1.1003 COC(C)C(N)c1ccc(F)c(Cl)c1 Amb35613662 [0,2,0,0,0,0|2,0,0]=4 4995 B14R1.1003 COC(C)C(O)c1ccc(C)c(Cl)c1 Amb27264368 [0,2,0,0,0,0|1,0,0]=3 4996 B14R1.1003 COC(C)C(O)c1ccc(F)c(Cl)c1 Amb30027562 [0,2,0,0,0,0|1,0,0]=3 4997 B14R1.1003 COC(C)C(O)c1ccc(F)c(F)c1 Amb27624366 [0,2,0,0,0,0|1,0,0]=3 4998 B14R1.1003 Cc1cc(C(O)C(C)C#N)ccc1Br Amb27417854 [0,2,0,0,0,0|2,0,0]=4 4999 B14R1.1003 Cc1ccc(C(O)C(C)CN)cc1Br Amb27639990 [0,2,0,0,0,0|2,0,0]=4 5000 B14R1.1013 CC(C#N)C(C)(O)c1ccc(I)cc1 Amb27601038 [0,2,0,0,0,0|2,0,0]=4 5001 B14R1.1013 CC(CN)C(C)(O)c1ccc(F)cc1 Amb27264513 [0,2,0,0,0,0|2,0,0]=4 5002 B14R1.1013 CCC(C)C(C)(N)c1ccc(Br)cc1 Amb28364885 [0,2,0,0,0,0|2,0,0]=4 5003 B14R1.1013 CCC(C)C(C)(O)c1ccc(Br)cn1 Amb35676601 [0,2,0,0,0,0|2,0,0]=4 5004 B14R1.1013 CCC(C)C(C)(O)c1ccc(C)cc1 Amb19050748 [0,2,0,0,0,0|1,0,0]=3 5005 B14R1.1013 CCC(C)C(C)(O)c1ccc(C)nc1 Amb28074540 [0,2,0,0,0,0|2,0,0]=4 5006 B14R1.1013 CCC(C)C(C)(O)c1ccc(Cl)cn1 Amb35676501 [0,2,0,0,0,0|2,0,0]=4 5007 B14R1.1013 COC(C)C(C)(O)c1ccc(Br)cc1 Amb35614536 [0,2,0,0,0,0|1,0,0]=3 5008 B14R1.1013 COC(C)C(C)(O)c1ccc(F)cc1 Amb28367937 [0,2,0,0,0,0|1,0,0]=3 5009 B14R1.1013 Cc1ccc(C(C)(O)C(C)C#N)cc1 Amb27387179 [0,2,0,0,0,0|2,0,0]=4 5010 B14R1.1013 Cc1ccc(C(C)(O)C(C)CN)cc1 Amb27763436 [0,2,0,0,0,0|2,0,0]=4 5011 B14R1.2819 CC(C#N)C(O)c1ccc(Cl)cc1F Amb28079345 [0,2,0,0,0,0|2,0,0]=4 5012 B14R1.2819 CC(C#N)C(O)c1ccc(F)cc1Br Amb27433710 [0,2,0,0,0,0|2,0,0]=4 5013 B14R1.2819 CC(CN)C(O)c1ccc(Br)cc1Br Amb27975342 [0,2,0,0,0,0|2,0,0]=4 5014 B14R1.2819 CC(CN)C(O)c1ccc(Br)cc1F Amb27399876 [0,2,0,0,0,0|2,0,0]=4 5015 B14R1.2819 CC(CN)C(O)c1ccc(Cl)cc1Br Amb27667615 [0,2,0,0,0,0|2,0,0]=4 5016 B14R1.2819 CC(CN)C(O)c1ccc(Cl)cc1Cl Amb28078166 [0,2,0,0,0,0|2,0,0]=4 5017 B14R1.2819 CC(CN)C(O)c1ccc(F)cc1F Amb27231011 [0,2,0,0,0,0|2,0,0]=4 5018 B14R1.2819 CCC(C)C(Br)c1ccc(C)cc1C Amb27598904 [0,2,0,0,0,0|2,0,0]=4 5019 B14R1.2819 CCC(C)C(Cl)c1ccc(F)cc1F Amb27841915 [0,2,0,0,0,0|2,0,0]=4 5020 B14R1.2819 CCC(C)C(N)c1ccc(Br)cc1Br Amb27836201 [0,2,0,0,0,0|2,0,0]=4 5021 B14R1.2819 CCC(C)C(N)c1ccc(Br)cc1O Amb28326099 [0,2,0,0,0,0|2,0,0]=4 5022 B14R1.2819 CCC(C)C(N)c1ccc(C)cc1O Amb27626286 [0,2,0,0,0,0|2,0,0]=4 5023 B14R1.2819 CCC(C)C(N)c1ccc(Cl)cc1F Amb27425473 [0,2,0,0,0,0|2,0,0]=4 5024 B14R1.2819 CCC(C)C(N)c1ccc(O)cc1O Amb27852160 [0,2,0,0,0,0|2,0,0]=4 5025 B14R1.2819 CCC(C)C(O)c1ccc(Br)cc1F Amb27403877 [0,2,0,0,0,0|1,0,0]=3 5026 B14R1.2819 CCC(C)C(O)c1ccc(Br)cc1N Amb35624563 [0,2,0,0,0,0|1,0,0]=3 5027 B14R1.2819 CCC(C)C(O)c1ccc(C)cc1Cl Amb27599614 [0,2,0,0,0,0|1,0,0]=3 5028 B14R1.2819 CCC(C)C(O)c1ccc(C)nc1C Amb28453588 [0,2,0,0,0,0|2,0,0]=4 5029 B14R1.2819 CCC(C)C(O)c1ccc(Cl)cc1Br Amb27393406 [0,2,0,0,0,0|1,0,0]=3 5030 B14R1.2819 CCC(C)C(O)c1ccc(F)cc1Br Amb28063306 [0,2,0,0,0,0|1,0,0]=3 5031 B14R1.2819 CCC(C)C(O)c1ccc(F)cc1F Amb19047924 [0,2,0,0,0,0|1,0,0]=3 5032 B14R1.2819 CCC(C)C(O)c1ccc(N)cc1Br Amb27610628 [0,2,0,0,0,0|1,0,0]=3 5033 B14R1.2819 CCC(C)C(O)c1ncc(Br)cc1Br Amb27665576 [0,2,0,0,0,0|2,0,0]=4 5034 B14R1.2819 CCC(C)[C@@H](N)c1ccc(Br)cc1F Amb27788113 [0,2,0,0,0,0|2,0,0]=4 5035 B14R1.2819 CCC(C)[C@@H](N)c1ccc(C)cc1F Amb27804028 [0,2,0,0,0,0|2,0,0]=4 5036 B14R1.2819 CCC(C)[C@@H](N)c1ccc(C)cc1O Amb27620414 [0,2,0,0,0,0|2,0,0]=4 5037 B14R1.2819 CCC(C)[C@@H](N)c1ccc(F)cc1Cl Amb27430520 [0,2,0,0,0,0|2,0,0]=4 5038 B14R1.2819 CCC(C)[C@H](N)c1ccc(C)cc1F Amb27964111 [0,2,0,0,0,0|2,0,0]=4 5039 B14R1.2819 CCC(C)[C@H](N)c1ccc(F)cc1Br Amb27222834 [0,2,0,0,0,0|2,0,0]=4 5040 B14R1.2819 CCC(C)[C@H](N)c1ccc(O)cc1O Amb27883101 [0,2,0,0,0,0|2,0,0]=4 5041 B14R1.2819 CCC(N)C(O)c1ccc(Br)cc1Cl Amb27656816 [0,2,0,0,0,0|2,0,0]=4 5042 B14R1.2819 CCC(N)C(O)c1ccc(F)cc1Cl Amb27971506 [0,2,0,0,0,0|2,0,0]=4 5043 B14R1.2819 CC[C@@H](N)C(O)c1ccc(C)cc1C Amb35659408 [0,2,0,0,0,0|2,0,0]=4 5044 B14R1.2819 CC[C@@H](N)C(O)c1ccc(Cl)cc1Cl Amb35659413 [0,2,0,0,0,0|2,0,0]=4 5045 B14R1.2819 CC[C@@H](N)C(O)c1ccc(Cl)cc1F Amb30038853 [0,2,0,0,0,0|2,0,0]=4 5046 B14R1.2819 CC[C@@H](N)C(O)c1ccc(F)cc1C Amb35659323 [0,2,0,0,0,0|2,0,0]=4 5047 B14R1.2819 CC[C@@H](N)C(O)c1ccc(F)cc1F Amb35659335 [0,2,0,0,0,0|2,0,0]=4 5048 B14R1.2819 CC[C@@H](N)[C@@H](O)c1ccc(C)cc1C Amb27195888 [0,2,0,0,0,0|2,0,0]=4 5049 B14R1.2819 CC[C@@H](N)[C@@H](O)c1ccc(Cl)cc1C Amb28422790 [0,2,0,0,0,0|2,0,0]=4 5050 B14R1.2819 CC[C@@H](N)[C@@H](O)c1ccc(N)cc1F Amb27879052 [0,2,0,0,0,0|2,0,0]=4 5051 B14R1.2819 CC[C@@H](N)[C@@H](O)c1ccc(O)cc1O Amb28411320 [0,2,0,0,0,0|2,0,0]=4 5052 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(C)cc1N Amb27816622 [0,2,0,0,0,0|2,0,0]=4 5053 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(Cl)cc1Cl Amb28384619 [0,2,0,0,0,0|2,0,0]=4 5054 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(F)cc1N Amb27430403 [0,2,0,0,0,0|2,0,0]=4 5055 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(N)cc1C Amb27467891 [0,2,0,0,0,0|2,0,0]=4 5056 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(O)cc1F Amb27864198 [0,2,0,0,0,0|2,0,0]=4 5057 B14R1.2819 CC[C@H](N)C(O)c1ccc(C)cc1C Amb35601508 [0,2,0,0,0,0|2,0,0]=4 5058 B14R1.2819 CC[C@H](N)C(O)c1ccc(Cl)cc1Cl Amb35601513 [0,2,0,0,0,0|2,0,0]=4 5059 B14R1.2819 CC[C@H](N)C(O)c1ccc(Cl)cc1F Amb35601353 [0,2,0,0,0,0|2,0,0]=4 5060 B14R1.2819 CC[C@H](N)C(O)c1ccc(F)cc1C Amb35601435 [0,2,0,0,0,0|2,0,0]=4 5061 B14R1.2819 CC[C@H](N)C(O)c1ccc(F)cc1F Amb35601446 [0,2,0,0,0,0|2,0,0]=4 5062 B14R1.2819 CC[C@H](N)[C@@H](O)c1ccc(Cl)cc1Cl Amb27440512 [0,2,0,0,0,0|2,0,0]=4 5063 B14R1.2819 CC[C@H](N)[C@@H](O)c1ccc(F)cc1Cl Amb28326152 [0,2,0,0,0,0|2,0,0]=4 5064 B14R1.2819 CC[C@H](N)[C@@H](O)c1ccc(N)cc1Cl Amb27445181 [0,2,0,0,0,0|2,0,0]=4 5065 B14R1.2819 CC[C@H](N)[C@@H](O)c1ccc(O)cc1F Amb28248101 [0,2,0,0,0,0|2,0,0]=4 5066 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(C)cc1C Amb27881856 [0,2,0,0,0,0|2,0,0]=4 5067 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(C)cc1F Amb27627937 [0,2,0,0,0,0|2,0,0]=4 5068 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(Cl)cc1F Amb27816625 [0,2,0,0,0,0|2,0,0]=4 5069 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(N)cc1Cl Amb27875582 [0,2,0,0,0,0|2,0,0]=4 5070 B14R1.2819 CNC(=O)C(O)c1ccc(C)cc1C Amb17401753 [0,2,0,0,0,0|1,0,1]=4 5071 B14R1.2819 CNC(=O)C(O)c1ccc(Cl)cc1Cl Amb25848451 [0,2,0,0,0,0|1,0,1]=4 5072 B14R1.2819 CNC(=O)C(O)c1ccc(F)cc1F Amb24718391 [0,2,0,0,0,0|1,0,1]=4 5073 B14R1.2819 CNC(C)C(=O)c1ccc(C)cc1C Amb17313102 [0,2,0,0,0,0|0,0,2]=4 5074 B14R1.2819 CNC(C)C(=O)c1ccc(Cl)cc1Cl Amb17313051 [0,2,0,0,0,0|0,0,2]=4 5075 B14R1.2819 CNC(C)C(=O)c1ccc(F)cc1C Amb27831726 [0,2,0,0,0,0|0,0,2]=4 5076 B14R1.2819 CNC(C)C(=O)c1ccc(F)cc1F Amb18566087 [0,2,0,0,0,0|0,0,2]=4 5077 B14R1.2819 CNC(C)C(C)c1ccc(Br)cc1Cl Amb27857027 [0,2,0,0,0,0|1,0,0]=3 5078 B14R1.2819 CNC(C)C(O)c1ccc(C)cc1C Amb18565374 [0,2,0,0,0,0|0,0,0]=2 5079 B14R1.2819 CNC(C)C(O)c1ccc(Cl)cc1Cl Amb18605229 [0,2,0,0,0,0|0,0,0]=2 5080 B14R1.2819 CNC(C)C(O)c1ccc(Cl)cc1F Amb35621413 [0,2,0,0,0,0|0,0,0]=2 5081 B14R1.2819 CNC(C)C(O)c1ccc(F)cc1C Amb35741306 [0,2,0,0,0,0|0,0,0]=2 5082 B14R1.2819 CNC(C)C(O)c1ccc(F)cc1F Amb18566316 [0,2,0,0,0,0|0,0,0]=2 5083 B14R1.2819 CN[C@@H](C)C(=O)c1ccc(C)cc1C Amb29891468 [0,2,0,0,0,0|0,0,2]=4 5084 B14R1.2819 CN[C@@H](C)C(=O)c1ccc(Cl)cc1Cl Amb35662202 [0,2,0,0,0,0|0,0,2]=4 5085 B14R1.2819 CN[C@@H](C)C(=O)c1ccc(Cl)cc1F Amb35662196 [0,2,0,0,0,0|0,0,2]=4 5086 B14R1.2819 CN[C@@H](C)C(=O)c1ccc(F)cc1C Amb29891583 [0,2,0,0,0,0|0,0,2]=4 5087 B14R1.2819 CN[C@@H](C)C(=O)c1ccc(F)cc1F Amb29891594 [0,2,0,0,0,0|0,0,2]=4 5088 B14R1.2819 CN[C@@H](C)C(O)c1ccc(C)cc1C Amb30038949 [0,2,0,0,0,0|0,0,0]=2 5089 B14R1.2819 CN[C@@H](C)C(O)c1ccc(Cl)cc1Cl Amb30038953 [0,2,0,0,0,0|0,0,0]=2 5090 B14R1.2819 CN[C@@H](C)C(O)c1ccc(Cl)cc1F Amb35662615 [0,2,0,0,0,0|0,0,0]=2 5091 B14R1.2819 CN[C@@H](C)C(O)c1ccc(F)cc1C Amb35663969 [0,2,0,0,0,0|0,0,0]=2 5092 B14R1.2819 CN[C@@H](C)C(O)c1ccc(F)cc1F Amb35662603 [0,2,0,0,0,0|0,0,0]=2 5093 B14R1.2819 COC(C)C(N)c1ccc(C)cc1C Amb18815818 [0,2,0,0,0,0|2,0,0]=4 5094 B14R1.2819 COC(C)C(N)c1ccc(Cl)cc1F Amb27182398 [0,2,0,0,0,0|2,0,0]=4 5095 B14R1.2819 COC(C)C(N)c1ccc(F)cc1C Amb27231521 [0,2,0,0,0,0|2,0,0]=4 5096 B14R1.2819 Cc1cc(Cl)ccc1C(O)C(C)C#N Amb27861593 [0,2,0,0,0,0|2,0,0]=4 5097 B14R1.2819 Cc1cc(F)ccc1C(O)C(C)C#N Amb28184687 [0,2,0,0,0,0|2,0,0]=4 5098 B14R1.2819 Cc1ccc(C(O)C(C)C#N)c(Cl)c1 Amb35611189 [0,2,0,0,0,0|2,0,0]=4 5099 B14R1.2819 Cc1ccc(C(O)C(C)CN)c(Br)c1 Amb27480366 [0,2,0,0,0,0|2,0,0]=4 5100 B14R1.2819 Cc1ccc(C(O)C(C)CN)c(C)c1 Amb18815813 [0,2,0,0,0,0|2,0,0]=4 5101 B14R1.2819 Cc1ccc(C(O)C(C)CN)c(F)c1 Amb27790540 [0,2,0,0,0,0|2,0,0]=4 5102 B14R1.18 CC(C#N)C(O)c1cccc(Cl)c1Cl Amb27755889 [0,2,0,0,0,0|2,0,0]=4 5103 B14R1.18 CC(C#N)C(O)c1cccc(F)c1Br Amb27191610 [0,2,0,0,0,0|2,0,0]=4 5104 B14R1.18 CC(C#N)C(O)c1cccc(F)c1F Amb27387240 [0,2,0,0,0,0|2,0,0]=4 5105 B14R1.18 CC(CN)C(O)c1cccc(Cl)c1F Amb28056728 [0,2,0,0,0,0|2,0,0]=4 5106 B14R1.18 CC(CN)C(O)c1cccc(F)c1F Amb28281100 [0,2,0,0,0,0|2,0,0]=4 5107 B14R1.18 CCC(C)C(Cl)c1cccc(Br)c1F Amb27761840 [0,2,0,0,0,0|2,0,0]=4 5108 B14R1.18 CCC(C)C(Cl)c1cccc(C)c1C Amb27656936 [0,2,0,0,0,0|2,0,0]=4 5109 B14R1.18 CCC(C)C(Cl)c1cccc(F)c1F Amb28056696 [0,2,0,0,0,0|2,0,0]=4 5110 B14R1.18 CCC(C)C(N)c1cccc(Br)c1C Amb28313831 [0,2,0,0,0,0|2,0,0]=4 5111 B14R1.18 CCC(C)C(N)c1cccc(Br)c1Cl Amb27817629 [0,2,0,0,0,0|2,0,0]=4 5112 B14R1.18 CCC(C)C(N)c1cccc(C)c1I Amb27816111 [0,2,0,0,0,0|2,0,0]=4 5113 B14R1.18 CCC(C)C(N)c1cccc(F)c1Br Amb27948435 [0,2,0,0,0,0|2,0,0]=4 5114 B14R1.18 CCC(C)C(N)c1cccc(F)c1O Amb27776942 [0,2,0,0,0,0|2,0,0]=4 5115 B14R1.18 CCC(C)C(O)c1cccc(C)c1C Amb27225640 [0,2,0,0,0,0|1,0,0]=3 5116 B14R1.18 CCC(C)C(O)c1cccc(C)c1Cl Amb27989269 [0,2,0,0,0,0|1,0,0]=3 5117 B14R1.18 CCC(C)C(O)c1cccc(C)c1F Amb27431488 [0,2,0,0,0,0|1,0,0]=3 5118 B14R1.18 CCC(C)C(O)c1cccc(C)c1I Amb27189693 [0,2,0,0,0,0|1,0,0]=3 5119 B14R1.18 CCC(C)C(O)c1cccc(Cl)c1F Amb28048638 [0,2,0,0,0,0|1,0,0]=3 5120 B14R1.18 CCC(C)C(O)c1cccc(F)c1Br Amb28125266 [0,2,0,0,0,0|1,0,0]=3 5121 B14R1.18 CCC(C)C(O)c1cccc(F)c1C Amb27785225 [0,2,0,0,0,0|1,0,0]=3 5122 B14R1.18 CCC(C)C(O)c1cccc(F)c1N Amb35582037 [0,2,0,0,0,0|1,0,0]=3 5123 B14R1.18 CCC(C)C(O)c1cccc(N)c1C Amb35622517 [0,2,0,0,0,0|1,0,0]=3 5124 B14R1.18 CCC(C)C(O)c1cccc(N)c1F Amb35741100 [0,2,0,0,0,0|1,0,0]=3 5125 B14R1.18 CCC(C)[C@H](N)c1cccc(Br)c1O Amb27430412 [0,2,0,0,0,0|2,0,0]=4 5126 B14R1.18 CCC(N)C(O)c1cccc(C)c1C Amb18980368 [0,2,0,0,0,0|2,0,0]=4 5127 B14R1.18 CCC(O)C(O)c1cccc(Br)c1F Amb27648514 [0,2,0,0,0,0|2,0,0]=4 5128 B14R1.18 CC[C@@H](N)C(O)c1cccc(Br)c1F Amb35601424 [0,2,0,0,0,0|2,0,0]=4 5129 B14R1.18 CC[C@@H](N)C(O)c1cccc(C)c1C Amb35659317 [0,2,0,0,0,0|2,0,0]=4 5130 B14R1.18 CC[C@@H](N)C(O)c1cccc(Cl)c1Cl Amb35659319 [0,2,0,0,0,0|2,0,0]=4 5131 B14R1.18 CC[C@@H](N)C(O)c1cccc(F)c1F Amb35659447 [0,2,0,0,0,0|2,0,0]=4 5132 B14R1.18 CC[C@@H](N)[C@@H](O)c1cccc(Cl)c1C Amb28142410 [0,2,0,0,0,0|2,0,0]=4 5133 B14R1.18 CC[C@@H](N)[C@@H](O)c1cccc(F)c1C Amb28055972 [0,2,0,0,0,0|2,0,0]=4 5134 B14R1.18 CC[C@@H](N)[C@@H](O)c1cccc(F)c1F Amb27204897 [0,2,0,0,0,0|2,0,0]=4 5135 B14R1.18 CC[C@@H](N)[C@@H](O)c1cccc(F)c1O Amb27205190 [0,2,0,0,0,0|2,0,0]=4 5136 B14R1.18 CC[C@@H](N)[C@@H](O)c1cccc(N)c1C Amb28132436 [0,2,0,0,0,0|2,0,0]=4 5137 B14R1.18 CC[C@@H](N)[C@H](O)c1cccc(C)c1C Amb28076154 [0,2,0,0,0,0|2,0,0]=4 5138 B14R1.18 CC[C@@H](N)[C@H](O)c1cccc(C)c1Cl Amb27205189 [0,2,0,0,0,0|2,0,0]=4 5139 B14R1.18 CC[C@@H](N)[C@H](O)c1cccc(Cl)c1Cl Amb27201446 [0,2,0,0,0,0|2,0,0]=4 5140 B14R1.18 CC[C@@H](N)[C@H](O)c1cccc(F)c1F Amb27196265 [0,2,0,0,0,0|2,0,0]=4 5141 B14R1.18 CC[C@@H](N)[C@H](O)c1cccc(N)c1O Amb27792273 [0,2,0,0,0,0|2,0,0]=4 5142 B14R1.18 CC[C@H](N)C(O)c1cccc(Br)c1F Amb35598761 [0,2,0,0,0,0|2,0,0]=4 5143 B14R1.18 CC[C@H](N)C(O)c1cccc(C)c1C Amb35601409 [0,2,0,0,0,0|2,0,0]=4 5144 B14R1.18 CC[C@H](N)C(O)c1cccc(Cl)c1Cl Amb35601431 [0,2,0,0,0,0|2,0,0]=4 5145 B14R1.18 CC[C@H](N)C(O)c1cccc(F)c1F Amb35601347 [0,2,0,0,0,0|2,0,0]=4 5146 B14R1.18 CC[C@H](N)[C@@H](O)c1cccc(Cl)c1Cl Amb28075246 [0,2,0,0,0,0|2,0,0]=4 5147 B14R1.18 CC[C@H](N)[C@@H](O)c1cccc(F)c1F Amb27430496 [0,2,0,0,0,0|2,0,0]=4 5148 B14R1.18 CC[C@H](N)[C@@H](O)c1cccc(F)c1O Amb27430505 [0,2,0,0,0,0|2,0,0]=4 5149 B14R1.18 CC[C@H](N)[C@@H](O)c1cccc(N)c1C Amb27880562 [0,2,0,0,0,0|2,0,0]=4 5150 B14R1.18 CC[C@H](N)[C@H](O)c1cccc(C)c1C Amb27620460 [0,2,0,0,0,0|2,0,0]=4 5151 B14R1.18 CC[C@H](N)[C@H](O)c1cccc(Cl)c1C Amb27430498 [0,2,0,0,0,0|2,0,0]=4 5152 B14R1.18 CC[C@H](N)[C@H](O)c1cccc(F)c1N Amb28434759 [0,2,0,0,0,0|2,0,0]=4 5153 B14R1.18 CC[C@H](N)[C@H](O)c1cccc(F)c1O Amb27430501 [0,2,0,0,0,0|2,0,0]=4 5154 B14R1.18 CC[C@H](N)[C@H](O)c1cccc(N)c1O Amb27447315 [0,2,0,0,0,0|2,0,0]=4 5155 B14R1.18 CNC(C)C(=O)c1cccc(Br)c1F Amb27809101 [0,2,0,0,0,0|0,0,2]=4 5156 B14R1.18 CNC(C)C(C)c1cccc(Cl)c1Cl Amb28239409 [0,2,0,0,0,0|1,0,0]=3 5157 B14R1.18 CNC(C)C(O)c1cccc(Br)c1F Amb29875932 [0,2,0,0,0,0|0,0,0]=2 5158 B14R1.18 CNC(C)C(O)c1cccc(C)c1C Amb35741300 [0,2,0,0,0,0|0,0,0]=2 5159 B14R1.18 CNC(C)C(O)c1cccc(Cl)c1Cl Amb35741302 [0,2,0,0,0,0|0,0,0]=2 5160 B14R1.18 CNC(C)C(O)c1cccc(F)c1F Amb35621410 [0,2,0,0,0,0|0,0,0]=2 5161 B14R1.18 CN[C@@H](C)C(=O)c1cccc(Br)c1F Amb35662203 [0,2,0,0,0,0|0,0,2]=4 5162 B14R1.18 CN[C@@H](C)C(=O)c1cccc(C)c1C Amb29891472 [0,2,0,0,0,0|0,0,2]=4 5163 B14R1.18 CN[C@@H](C)C(=O)c1cccc(Cl)c1Cl Amb35662199 [0,2,0,0,0,0|0,0,2]=4 5164 B14R1.18 CN[C@@H](C)C(=O)c1cccc(F)c1F Amb29891590 [0,2,0,0,0,0|0,0,2]=4 5165 B14R1.18 CN[C@@H](C)C(O)c1cccc(Br)c1F Amb30039220 [0,2,0,0,0,0|0,0,0]=2 5166 B14R1.18 CN[C@@H](C)C(O)c1cccc(C)c1C Amb35663972 [0,2,0,0,0,0|0,0,0]=2 5167 B14R1.18 CN[C@@H](C)C(O)c1cccc(Cl)c1Cl Amb35663974 [0,2,0,0,0,0|0,0,0]=2 5168 B14R1.18 CN[C@@H](C)C(O)c1cccc(F)c1F Amb35662609 [0,2,0,0,0,0|0,0,0]=2 5169 B14R1.18 COC(C)C(N)c1cccc(Br)c1F Amb28410025 [0,2,0,0,0,0|2,0,0]=4 5170 B14R1.18 COC(C)C(N)c1cccc(Cl)c1Cl Amb28078347 [0,2,0,0,0,0|2,0,0]=4 5171 B14R1.18 COC(C)C(N)c1cccc(F)c1F Amb27411721 [0,2,0,0,0,0|2,0,0]=4 5172 B14R1.18 COC(C)C(O)c1cccc(C)c1C Amb27264598 [0,2,0,0,0,0|1,0,0]=3 5173 B14R1.18 Cc1c(Br)cccc1C(O)C(C)CN Amb27669708 [0,2,0,0,0,0|2,0,0]=4 5174 B14R1.18 Cc1cccc(C(O)C(C)C#N)c1F Amb28194808 [0,2,0,0,0,0|2,0,0]=4 5175 B14R1.36 CC(CC#N)C(O)c1cccc(O)c1 Amb17336304 [0,2,0,0,0,0|1,0,1]=4 5176 B14R1.36 Cc1cccc(C(O)C(C)CC#N)c1 Amb17336108 [0,2,0,0,0,0|1,0,1]=4 5177 B14R1.79 CCC(C)C(N)c1cccc(C#N)c1 Amb27631067 [0,2,0,0,0,0|2,0,0]=4 5178 B14R1.79 CCC(C)[C@@H](N)c1cccc(C#N)c1 Amb27430334 [0,2,0,0,0,0|2,0,0]=4 5179 B14R1.79 CCC(C)[C@H](N)c1cccc(C#N)c1 Amb28204346 [0,2,0,0,0,0|2,0,0]=4 5180 B14R1.79 CNC(=O)C(O)c1cccc(OC)c1 Amb27812262 [0,2,0,0,0,0|1,0,1]=4 5181 B14R1.79 CNC(C)C(=O)c1cccc(OC)c1 Amb18565248 [0,2,0,0,0,0|0,0,2]=4 5182 B14R1.79 C\C=C(/C)C(O)c1cccc(OC)c1 Amb27753012 [0,2,0,0,0,0|1,0,1]=4 5183 B14R1.89 CCC(C#N)C(O)c1cccc(Br)c1 Amb27480664 [0,2,0,0,0,0|1,0,1]=4 5184 B14R1.89 CCC(C#N)C(O)c1cccc(Cl)c1 Amb27871865 [0,2,0,0,0,0|1,0,1]=4 5185 B14R1.89 CCC(C#N)C(O)c1cccc(F)c1 Amb27387375 [0,2,0,0,0,0|1,0,1]=4 5186 B14R1.150 CC(=O)C(C)C(O)c1cccc(C)c1 Amb27164419 [0,2,0,0,0,0|1,0,0]=3 5187 B14R1.150 CC(=O)C(C)C(O)c1cccc(F)c1 Amb27829907 [0,2,0,0,0,0|1,0,0]=3 5188 B14R1.150 CC(=O)[C@@H](C)[C@@H](O)c1cccc(F)c1 Amb27980379 [0,2,0,0,0,0|1,0,0]=3 5189 B14R1.150 CC(=O)[C@H](C)[C@@H](O)c1cccc(F)c1 Amb27605444 [0,2,0,0,0,0|1,0,0]=3 5190 B14R1.150 CC(C(=O)c1cccc(Cl)c1)N(C)C Amb9661081 [0,2,0,0,0,0|0,0,2]=4 5191 B14R1.150 CC(C(O)c1cccc(Cl)c1)[N+](=O)[O-] Amb27982134 [0,2,0,0,0,0|1,0,1]=4 5192 B14R1.150 CC(C)C(C)C(N)c1cccc(I)c1 Amb27882166 [0,2,0,0,0,0|2,0,0]=4 5193 B14R1.150 CC(C)C(C)C(O)c1cccc(Br)c1 Amb27407302 [0,2,0,0,0,0|1,0,0]=3 5194 B14R1.150 CC(C)C(C)C(O)c1cccc(I)c1 Amb27455403 [0,2,0,0,0,0|1,0,0]=3 5195 B14R1.150 CC(C)C(C)C(O)c1cccc(N)c1 Amb28313434 [0,2,0,0,0,0|1,0,0]=3 5196 B14R1.150 CC(C)C(C)C(O)c1cccc(N)n1 Amb35622410 [0,2,0,0,0,0|2,0,0]=4 5197 B14R1.150 CC(C)C(C)C(O)c1ccnc(Cl)c1 Amb27233812 [0,2,0,0,0,0|2,0,0]=4 5198 B14R1.150 CC(C)C(C)C(O)c1cncc(Br)c1 Amb27758155 [0,2,0,0,0,0|2,0,0]=4 5199 B14R1.150 CC(C)C(C)C(O)c1cncc(Cl)c1 Amb27760692 [0,2,0,0,0,0|2,0,0]=4 5200 B14R1.150 CC(C)C(N)C(O)c1cccc(Br)c1 Amb18586799 [0,2,0,0,0,0|2,0,0]=4 5201 B14R1.150 CC(C)C(N)C(O)c1cccc(F)c1 Amb18565956 [0,2,0,0,0,0|2,0,0]=4 5202 B14R1.150 CC(C)C(O)C(O)c1cccc(Br)c1 Amb35591364 [0,2,0,0,0,0|2,0,0]=4 5203 B14R1.150 CC(C)C(O)C(O)c1cccc(Cl)c1 Amb28347998 [0,2,0,0,0,0|2,0,0]=4 5204 B14R1.150 CC(C)C(O)C(O)c1cccc(F)c1 Amb27171128 [0,2,0,0,0,0|2,0,0]=4 5205 B14R1.150 CC(C)[C@@H](N)C(O)c1cccc(Br)c1 Amb35623721 [0,2,0,0,0,0|2,0,0]=4 5206 B14R1.150 CC(C)[C@@H](N)C(O)c1cccc(Cl)c1 Amb35623720 [0,2,0,0,0,0|2,0,0]=4 5207 B14R1.150 CC(C)[C@@H](N)C(O)c1cccc(F)c1 Amb30024002 [0,2,0,0,0,0|2,0,0]=4 5208 B14R1.150 CC(C)[C@@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27489146 [0,2,0,0,0,0|2,0,0]=4 5209 B14R1.150 CC(C)[C@@H](N)[C@@H](O)c1cccc(F)c1 Amb27792270 [0,2,0,0,0,0|2,0,0]=4 5210 B14R1.150 CC(C)[C@@H](N)[C@@H](O)c1cccc(O)c1 Amb28055971 [0,2,0,0,0,0|2,0,0]=4 5211 B14R1.150 CC(C)[C@@H](N)[C@H](O)c1cccc(Br)c1 Amb27445208 [0,2,0,0,0,0|2,0,0]=4 5212 B14R1.150 CC(C)[C@@H](N)[C@H](O)c1cccc(Cl)c1 Amb27430507 [0,2,0,0,0,0|2,0,0]=4 5213 B14R1.150 CC(C)[C@@H](N)[C@H](O)c1cccc(O)c1 Amb27430324 [0,2,0,0,0,0|2,0,0]=4 5214 B14R1.150 CC(C)[C@H](N)C(O)c1cccc(Br)c1 Amb35737507 [0,2,0,0,0,0|2,0,0]=4 5215 B14R1.150 CC(C)[C@H](N)C(O)c1cccc(Cl)c1 Amb35588311 [0,2,0,0,0,0|2,0,0]=4 5216 B14R1.150 CC(C)[C@H](N)C(O)c1cccc(F)c1 Amb35737513 [0,2,0,0,0,0|2,0,0]=4 5217 B14R1.150 CC(C)[C@H](N)[C@@H](O)c1cccc(Cl)c1 Amb27491827 [0,2,0,0,0,0|2,0,0]=4 5218 B14R1.150 CC(C)[C@H](N)[C@@H](O)c1cccc(N)c1 Amb27205177 [0,2,0,0,0,0|2,0,0]=4 5219 B14R1.150 CC(N)C(C)C(O)c1cccc(Br)c1 Amb35624842 [0,2,0,0,0,0|1,0,0]=3 5220 B14R1.150 CC(N)C(C)C(O)c1cccc(Cl)c1 Amb35624834 [0,2,0,0,0,0|1,0,0]=3 5221 B14R1.150 CC(N)C(C)C(O)c1cccc(F)c1 Amb35624524 [0,2,0,0,0,0|1,0,0]=3 5222 B14R1.150 CC(N)C(C)C(O)c1cncc(F)c1 Amb35584282 [0,2,0,0,0,0|2,0,0]=4 5223 B14R1.150 CN(C)C(=O)C(O)c1cccc(Br)c1 Amb25029176 [0,2,0,0,0,0|1,0,1]=4 5224 B14R1.150 CN(C)C(=O)C(O)c1cccc(F)c1 Amb25320310 [0,2,0,0,0,0|1,0,1]=4 5225 B14R1.150 Cc1cccc(C(O)C(=O)N(C)C)c1 Amb28185061 [0,2,0,0,0,0|1,0,1]=4 5226 B14R1.150 Cc1cccc(C(O)C(C)C(C)N)c1 Amb35624686 [0,2,0,0,0,0|1,0,0]=3 5227 B14R1.150 Cc1cccc(C(O)C(N)C(C)C)c1 Amb18565327 [0,2,0,0,0,0|2,0,0]=4 5228 B14R1.150 Cc1cccc(C(O)C(O)C(C)C)c1 Amb27600638 [0,2,0,0,0,0|2,0,0]=4 5229 B14R1.150 Cc1cccc(C(O)[C@@H](N)C(C)C)c1 Amb35588419 [0,2,0,0,0,0|2,0,0]=4 5230 B14R1.150 Cc1cccc(C(O)[C@H](N)C(C)C)c1 Amb35623853 [0,2,0,0,0,0|2,0,0]=4 5231 B14R1.150 Cc1cncc(C(O)C(C)C(C)N)c1 Amb35584288 [0,2,0,0,0,0|2,0,0]=4 5232 B14R1.306 CC(C)(C#N)C(O)c1cccc(Cl)c1 Amb27864721 [0,2,0,0,0,0|2,0,0]=4 5233 B14R1.306 CC(C)(CN)C(O)c1cccc(Br)c1 Amb27387108 [0,2,0,0,0,0|2,0,0]=4 5234 B14R1.306 CC(C)(CN)C(O)c1cccc(I)c1 Amb28123014 [0,2,0,0,0,0|2,0,0]=4 5235 B14R1.306 CC(C)(CO)C(O)c1cccc(Cl)c1 Amb27650256 [0,2,0,0,0,0|2,0,0]=4 5236 B14R1.306 CC(C)(CO)C(O)c1cccc(O)c1 Amb27405164 [0,2,0,0,0,0|2,0,0]=4 5237 B14R1.306 CC(C)(CO)[C@@H](O)c1cccc(Cl)c1 Amb28124907 [0,2,0,0,0,0|2,0,0]=4 5238 B14R1.306 CC(C)(CO)[C@@H](O)c1cccc(F)c1 Amb28205170 [0,2,0,0,0,0|2,0,0]=4 5239 B14R1.306 CC(C)(CO)[C@H](O)c1cccc(Cl)c1 Amb27812082 [0,2,0,0,0,0|2,0,0]=4 5240 B14R1.306 CCC(C)(C)C(N)c1cccc(Br)c1 Amb35653267 [0,2,0,0,0,0|2,0,0]=4 5241 B14R1.306 CCC(C)(C)C(N)c1cccc(N)c1 Amb32697383 [0,2,0,0,0,0|2,0,0]=4 5242 B14R1.306 CCC(C)(C)C(O)c1cccc(Br)c1 Amb30028077 [0,2,0,0,0,0|1,0,0]=3 5243 B14R1.306 CCC(C)(C)C(O)c1cncc(F)c1 Amb28191201 [0,2,0,0,0,0|2,0,0]=4 5244 B14R1.306 CCC(C)(N)C(O)c1cccc(Br)c1 Amb35742167 [0,2,0,0,0,0|1,0,0]=3 5245 B14R1.306 CCC(C)(N)C(O)c1cccc(C)c1 Amb35587091 [0,2,0,0,0,0|1,0,0]=3 5246 B14R1.306 CCC(C)(N)C(O)c1cccc(Cl)c1 Amb35742160 [0,2,0,0,0,0|1,0,0]=3 5247 B14R1.306 CCC(C)(N)C(O)c1cccc(F)c1 Amb35742173 [0,2,0,0,0,0|1,0,0]=3 5248 B14R1.306 CCC(C)(N)C(O)c1cncc(C)c1 Amb35742285 [0,2,0,0,0,0|2,0,0]=4 5249 B14R1.306 CCC(C)(N)C(O)c1cncc(F)c1 Amb35742279 [0,2,0,0,0,0|2,0,0]=4 5250 B14R1.306 CCC(C)(O)C(O)c1cccc(Br)c1 Amb30021914 [0,2,0,0,0,0|1,0,0]=3 5251 B14R1.306 CCC(C)(O)C(O)c1cccc(Cl)c1 Amb27865398 [0,2,0,0,0,0|1,0,0]=3 5252 B14R1.306 CCC(C)(O)C(O)c1cncc(F)c1 Amb27183679 [0,2,0,0,0,0|2,0,0]=4 5253 B14R1.306 CCC(F)(F)C(O)c1cccc(Br)c1 Amb35609818 [0,2,0,0,0,0|2,0,0]=4 5254 B14R1.306 CCC(F)(F)C(O)c1cccc(C)c1 Amb35645210 [0,2,0,0,0,0|2,0,0]=4 5255 B14R1.306 CCC(F)(F)C(O)c1cccc(Cl)c1 Amb35645150 [0,2,0,0,0,0|2,0,0]=4 5256 B14R1.306 CCC(F)(F)C(O)c1cccc(F)c1 Amb35645178 [0,2,0,0,0,0|2,0,0]=4 5257 B14R1.306 CNC(C)(C)C(=O)c1cccc(Br)c1 Amb30021574 [0,2,0,0,0,0|0,0,2]=4 5258 B14R1.306 CNC(C)(C)C(F)c1cccc(Br)c1 Amb35641879 [0,2,0,0,0,0|1,0,0]=3 5259 B14R1.306 CNC(C)(C)C(F)c1cccc(Cl)c1 Amb27589177 [0,2,0,0,0,0|1,0,0]=3 5260 B14R1.306 CNC(C)(C)C(F)c1cncc(F)c1 Amb28059419 [0,2,0,0,0,0|2,0,0]=4 5261 B14R1.306 CNC(C)(C)C(O)c1cccc(Br)c1 Amb35591779 [0,2,0,0,0,0|0,0,0]=2 5262 B14R1.306 COC(C)(C)C(N)c1cccc(Br)c1 Amb35591414 [0,2,0,0,0,0|2,0,0]=4 5263 B14R1.306 COC(C)(C)C(N)c1cccc(C)c1 Amb27871190 [0,2,0,0,0,0|2,0,0]=4 5264 B14R1.306 COC(C)(C)C(N)c1cccc(Cl)c1 Amb27807212 [0,2,0,0,0,0|2,0,0]=4 5265 B14R1.306 COC(C)(C)C(O)c1cccc(Br)c1 Amb30028079 [0,2,0,0,0,0|1,0,0]=3 5266 B14R1.306 COC(C)(C)C(O)c1cccc(Cl)c1 Amb27874990 [0,2,0,0,0,0|1,0,0]=3 5267 B14R1.306 COC(C)(C)C(O)c1cncc(C)c1 Amb27587855 [0,2,0,0,0,0|2,0,0]=4 5268 B14R1.306 CSC(C)(C)C(N)c1cccc(Br)c1 Amb35591416 [0,2,0,0,0,0|2,0,0]=4 5269 B14R1.306 CSC(C)(C)C(N)c1cccc(F)c1 Amb27196575 [0,2,0,0,0,0|2,0,0]=4 5270 B14R1.306 CSC(C)(C)C(O)c1cccc(Br)c1 Amb35614540 [0,2,0,0,0,0|1,0,0]=3 5271 B14R1.306 CSC(C)(C)C(O)c1cccc(F)c1 Amb27403812 [0,2,0,0,0,0|1,0,0]=3 5272 B14R1.306 CSC(C)(C)C(O)c1cncc(F)c1 Amb27643007 [0,2,0,0,0,0|2,0,0]=4 5273 B14R1.306 Cc1cccc(C(O)C(C)(C)CN)c1 Amb18910514 [0,2,0,0,0,0|2,0,0]=4 5274 B14R1.711 CCC(C)C(C#N)c1cccc(Br)c1 Amb27810615 [0,2,0,0,0,0|2,0,0]=4 5275 B14R1.711 CCC(C)C(C#N)c1cccc(C)c1 Amb28186671 [0,2,0,0,0,0|2,0,0]=4 5276 B14R1.711 CCC(C)C(C#N)c1cccc(N)c1 Amb27183863 [0,2,0,0,0,0|2,0,0]=4 5277 B14R1.988 CC(C#N)C(O)c1cc(Cl)ccc1Cl Amb27755592 [0,2,0,0,0,0|2,0,0]=4 5278 B14R1.988 CC(CN)C(O)c1cc(Br)ccc1Br Amb28183521 [0,2,0,0,0,0|2,0,0]=4 5279 B14R1.988 CC(CN)C(O)c1cc(Br)ccc1F Amb28045305 [0,2,0,0,0,0|2,0,0]=4 5280 B14R1.988 CC(CN)C(O)c1cc(Cl)ccc1Br Amb27586647 [0,2,0,0,0,0|2,0,0]=4 5281 B14R1.988 CC(CN)C(O)c1cc(Cl)ccc1Cl Amb27830283 [0,2,0,0,0,0|2,0,0]=4 5282 B14R1.988 CC(CN)C(O)c1cc(F)ccc1Br Amb27644182 [0,2,0,0,0,0|2,0,0]=4 5283 B14R1.988 CCC(C)C(Br)c1cc(Cl)ccc1Cl Amb27859724 [0,2,0,0,0,0|2,0,0]=4 5284 B14R1.988 CCC(C)C(Cl)c1cc(C)ccc1Cl Amb28386283 [0,2,0,0,0,0|2,0,0]=4 5285 B14R1.988 CCC(C)C(Cl)c1cc(C)ccc1F Amb27395179 [0,2,0,0,0,0|2,0,0]=4 5286 B14R1.988 CCC(C)C(Cl)c1cc(F)ccc1F Amb28345129 [0,2,0,0,0,0|2,0,0]=4 5287 B14R1.988 CCC(C)C(N)c1cc(Br)ccc1F Amb27225601 [0,2,0,0,0,0|2,0,0]=4 5288 B14R1.988 CCC(C)C(N)c1cc(C)ccc1Cl Amb27830891 [0,2,0,0,0,0|2,0,0]=4 5289 B14R1.988 CCC(C)C(N)c1cc(C)ccc1F Amb27857663 [0,2,0,0,0,0|2,0,0]=4 5290 B14R1.988 CCC(C)C(N)c1cc(Cl)ccc1C Amb27950855 [0,2,0,0,0,0|2,0,0]=4 5291 B14R1.988 CCC(C)C(N)c1cc(Cl)ccc1Cl Amb8996016 [0,2,0,0,0,0|2,0,0]=4 5292 B14R1.988 CCC(C)C(N)c1cc(Cl)ccc1F Amb27952756 [0,2,0,0,0,0|2,0,0]=4 5293 B14R1.988 CCC(C)C(N)c1cc(F)ccc1O Amb28058516 [0,2,0,0,0,0|2,0,0]=4 5294 B14R1.988 CCC(C)C(N)c1cc(I)ccc1Br Amb27591790 [0,2,0,0,0,0|2,0,0]=4 5295 B14R1.988 CCC(C)C(O)c1cc(Br)ccc1F Amb27778389 [0,2,0,0,0,0|1,0,0]=3 5296 B14R1.988 CCC(C)C(O)c1cc(Br)ccc1N Amb27418311 [0,2,0,0,0,0|1,0,0]=3 5297 B14R1.988 CCC(C)C(O)c1cc(C)ccc1Cl Amb27875248 [0,2,0,0,0,0|1,0,0]=3 5298 B14R1.988 CCC(C)C(O)c1cc(C)ccc1N Amb29874956 [0,2,0,0,0,0|1,0,0]=3 5299 B14R1.988 CCC(C)C(O)c1cc(C)cnc1N Amb27956985 [0,2,0,0,0,0|2,0,0]=4 5300 B14R1.988 CCC(C)C(O)c1cc(Cl)ccc1C Amb27661512 [0,2,0,0,0,0|1,0,0]=3 5301 B14R1.988 CCC(C)C(O)c1cc(Cl)ccc1N Amb29875765 [0,2,0,0,0,0|1,0,0]=3 5302 B14R1.988 CCC(C)C(O)c1cc(N)ccc1Br Amb35740845 [0,2,0,0,0,0|1,0,0]=3 5303 B14R1.988 CCC(C)C(O)c1cc(N)ccc1F Amb35622401 [0,2,0,0,0,0|1,0,0]=3 5304 B14R1.988 CCC(C)[C@@H](N)c1cc(Br)ccc1O Amb27790017 [0,2,0,0,0,0|2,0,0]=4 5305 B14R1.988 CCC(C)[C@@H](N)c1cc(C)ccc1C Amb27430333 [0,2,0,0,0,0|2,0,0]=4 5306 B14R1.988 CCC(C)[C@@H](N)c1cc(C)ccc1F Amb27491830 [0,2,0,0,0,0|2,0,0]=4 5307 B14R1.988 CCC(C)[C@@H](N)c1cc(F)ccc1Br Amb27969533 [0,2,0,0,0,0|2,0,0]=4 5308 B14R1.988 CCC(C)[C@@H](N)c1cc(F)ccc1Cl Amb28367344 [0,2,0,0,0,0|2,0,0]=4 5309 B14R1.988 CCC(C)[C@@H](N)c1cc(O)ccc1O Amb27777369 [0,2,0,0,0,0|2,0,0]=4 5310 B14R1.988 CCC(C)[C@H](N)c1cc(C)ccc1C Amb28056141 [0,2,0,0,0,0|2,0,0]=4 5311 B14R1.988 CCC(C)[C@H](N)c1cc(Cl)ccc1Cl Amb28056145 [0,2,0,0,0,0|2,0,0]=4 5312 B14R1.988 CCC(C)[C@H](N)c1cc(Cl)ccc1N Amb27969452 [0,2,0,0,0,0|2,0,0]=4 5313 B14R1.988 CCC(C)[C@H](N)c1cc(F)ccc1Cl Amb28457578 [0,2,0,0,0,0|2,0,0]=4 5314 B14R1.988 CCC(C)[C@H](N)c1cc(F)ccc1F Amb28247997 [0,2,0,0,0,0|2,0,0]=4 5315 B14R1.988 CCC(C)[C@H](N)c1cc(O)ccc1Br Amb28384641 [0,2,0,0,0,0|2,0,0]=4 5316 B14R1.988 CCC(C)[C@H](N)c1cc(O)ccc1O Amb27964112 [0,2,0,0,0,0|2,0,0]=4 5317 B14R1.988 CCC(N)C(O)c1cc(C)ccc1C Amb17139402 [0,2,0,0,0,0|2,0,0]=4 5318 B14R1.988 CCC(N)C(O)c1cc(Cl)ccc1Br Amb28137601 [0,2,0,0,0,0|2,0,0]=4 5319 B14R1.988 CCC(N)C(O)c1cc(Cl)ccc1C Amb27878983 [0,2,0,0,0,0|2,0,0]=4 5320 B14R1.988 CCC(N)C(O)c1cc(F)ccc1Br Amb27792812 [0,2,0,0,0,0|2,0,0]=4 5321 B14R1.988 CCC(N)C(O)c1cc(N)ccc1C Amb27850084 [0,2,0,0,0,0|2,0,0]=4 5322 B14R1.988 CCC(N)C(O)c1cc(N)ccc1F Amb27437411 [0,2,0,0,0,0|2,0,0]=4 5323 B14R1.988 CCC(O)C(O)c1cc(C)ccc1C Amb27391051 [0,2,0,0,0,0|2,0,0]=4 5324 B14R1.988 CCC(O)C(O)c1cc(F)ccc1C Amb27183512 [0,2,0,0,0,0|2,0,0]=4 5325 B14R1.988 CC[C@@H](N)C(O)c1cc(Br)ccc1F Amb35601298 [0,2,0,0,0,0|2,0,0]=4 5326 B14R1.988 CC[C@@H](N)C(O)c1cc(C)ccc1C Amb35659375 [0,2,0,0,0,0|2,0,0]=4 5327 B14R1.988 CC[C@@H](N)C(O)c1cc(C)ccc1Cl Amb35659409 [0,2,0,0,0,0|2,0,0]=4 5328 B14R1.988 CC[C@@H](N)C(O)c1cc(C)ccc1F Amb35659325 [0,2,0,0,0,0|2,0,0]=4 5329 B14R1.988 CC[C@@H](N)C(O)c1cc(Cl)ccc1Cl Amb35659321 [0,2,0,0,0,0|2,0,0]=4 5330 B14R1.988 CC[C@@H](N)C(O)c1cc(F)ccc1C Amb35659322 [0,2,0,0,0,0|2,0,0]=4 5331 B14R1.988 CC[C@@H](N)C(O)c1cc(F)ccc1Cl Amb30038857 [0,2,0,0,0,0|2,0,0]=4 5332 B14R1.988 CC[C@@H](N)C(O)c1cc(F)ccc1F Amb35659410 [0,2,0,0,0,0|2,0,0]=4 5333 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(C)ccc1Cl Amb27791015 [0,2,0,0,0,0|2,0,0]=4 5334 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(C)ccc1F Amb27850076 [0,2,0,0,0,0|2,0,0]=4 5335 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(Cl)ccc1C Amb27816621 [0,2,0,0,0,0|2,0,0]=4 5336 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(F)ccc1N Amb28326153 [0,2,0,0,0,0|2,0,0]=4 5337 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(F)ccc1O Amb27985415 [0,2,0,0,0,0|2,0,0]=4 5338 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(N)ccc1C Amb28434768 [0,2,0,0,0,0|2,0,0]=4 5339 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(N)ccc1Cl Amb28384612 [0,2,0,0,0,0|2,0,0]=4 5340 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(Cl)ccc1Cl Amb27445456 [0,2,0,0,0,0|2,0,0]=4 5341 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(Cl)ccc1O Amb27879054 [0,2,0,0,0,0|2,0,0]=4 5342 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(F)ccc1C Amb27789982 [0,2,0,0,0,0|2,0,0]=4 5343 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(N)ccc1Cl Amb27491822 [0,2,0,0,0,0|2,0,0]=4 5344 B14R1.988 CC[C@H](N)C(O)c1cc(Br)ccc1F Amb35597752 [0,2,0,0,0,0|2,0,0]=4 5345 B14R1.988 CC[C@H](N)C(O)c1cc(C)ccc1C Amb35601247 [0,2,0,0,0,0|2,0,0]=4 5346 B14R1.988 CC[C@H](N)C(O)c1cc(C)ccc1Cl Amb35601509 [0,2,0,0,0,0|2,0,0]=4 5347 B14R1.988 CC[C@H](N)C(O)c1cc(C)ccc1F Amb35601437 [0,2,0,0,0,0|2,0,0]=4 5348 B14R1.988 CC[C@H](N)C(O)c1cc(Cl)ccc1Cl Amb35601433 [0,2,0,0,0,0|2,0,0]=4 5349 B14R1.988 CC[C@H](N)C(O)c1cc(F)ccc1C Amb35601434 [0,2,0,0,0,0|2,0,0]=4 5350 B14R1.988 CC[C@H](N)C(O)c1cc(F)ccc1Cl Amb35601355 [0,2,0,0,0,0|2,0,0]=4 5351 B14R1.988 CC[C@H](N)C(O)c1cc(F)ccc1F Amb35601510 [0,2,0,0,0,0|2,0,0]=4 5352 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(C)ccc1N Amb28132461 [0,2,0,0,0,0|2,0,0]=4 5353 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(Cl)ccc1C Amb28055987 [0,2,0,0,0,0|2,0,0]=4 5354 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(Cl)ccc1F Amb27792274 [0,2,0,0,0,0|2,0,0]=4 5355 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(F)ccc1F Amb28248100 [0,2,0,0,0,0|2,0,0]=4 5356 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(F)ccc1N Amb27204792 [0,2,0,0,0,0|2,0,0]=4 5357 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(N)ccc1C Amb27430503 [0,2,0,0,0,0|2,0,0]=4 5358 B14R1.988 CC[C@H](N)[C@H](O)c1cc(Cl)ccc1Cl Amb28057444 [0,2,0,0,0,0|2,0,0]=4 5359 B14R1.988 CC[C@H](N)[C@H](O)c1cc(Cl)ccc1F Amb27430322 [0,2,0,0,0,0|2,0,0]=4 5360 B14R1.988 CC[C@H](N)[C@H](O)c1cc(Cl)ccc1O Amb27818172 [0,2,0,0,0,0|2,0,0]=4 5361 B14R1.988 CC[C@H](N)[C@H](O)c1cc(F)ccc1C Amb27637912 [0,2,0,0,0,0|2,0,0]=4 5362 B14R1.988 CC[C@H](N)[C@H](O)c1cc(F)ccc1Cl Amb27864195 [0,2,0,0,0,0|2,0,0]=4 5363 B14R1.988 CC[C@H](N)[C@H](O)c1cc(F)ccc1F Amb27437383 [0,2,0,0,0,0|2,0,0]=4 5364 B14R1.988 CC[C@H](N)[C@H](O)c1cc(F)ccc1O Amb27439841 [0,2,0,0,0,0|2,0,0]=4 5365 B14R1.988 CNC(=O)C(O)c1cc(Br)ccc1C Amb26464987 [0,2,0,0,0,0|1,0,1]=4 5366 B14R1.988 CNC(=O)C(O)c1cc(Br)ccc1F Amb24672527 [0,2,0,0,0,0|1,0,1]=4 5367 B14R1.988 CNC(=O)C(O)c1cc(C)ccc1C Amb25856390 [0,2,0,0,0,0|1,0,1]=4 5368 B14R1.988 CNC(=O)C(O)c1cc(Cl)ccc1F Amb25198587 [0,2,0,0,0,0|1,0,1]=4 5369 B14R1.988 CNC(=O)C(O)c1cc(F)ccc1F Amb27157917 [0,2,0,0,0,0|1,0,1]=4 5370 B14R1.988 CNC(C)C(=O)c1cc(Br)ccc1C Amb26465146 [0,2,0,0,0,0|0,0,2]=4 5371 B14R1.988 CNC(C)C(=O)c1cc(Br)ccc1F Amb25672741 [0,2,0,0,0,0|0,0,2]=4 5372 B14R1.988 CNC(C)C(=O)c1cc(C)ccc1C Amb18564935 [0,2,0,0,0,0|0,0,2]=4 5373 B14R1.988 CNC(C)C(=O)c1cc(Cl)ccc1Cl Amb27391417 [0,2,0,0,0,0|0,0,2]=4 5374 B14R1.988 CNC(C)C(=O)c1cc(Cl)ccc1F Amb18244258 [0,2,0,0,0,0|0,0,2]=4 5375 B14R1.988 CNC(C)C(=O)c1cc(F)ccc1F Amb18566081 [0,2,0,0,0,0|0,0,2]=4 5376 B14R1.988 CNC(C)C(C)c1cc(Br)ccc1F Amb27170338 [0,2,0,0,0,0|1,0,0]=3 5377 B14R1.988 CNC(C)C(C)c1cc(Cl)ccc1Cl Amb28454467 [0,2,0,0,0,0|1,0,0]=3 5378 B14R1.988 CNC(C)C(C)c1cc(F)ccc1F Amb27443416 [0,2,0,0,0,0|1,0,0]=3 5379 B14R1.988 CNC(C)C(O)c1cc(Br)ccc1F Amb35621243 [0,2,0,0,0,0|0,0,0]=2 5380 B14R1.988 CNC(C)C(O)c1cc(C)ccc1C Amb18565365 [0,2,0,0,0,0|0,0,0]=2 5381 B14R1.988 CNC(C)C(O)c1cc(C)ccc1Cl Amb35741559 [0,2,0,0,0,0|0,0,0]=2 5382 B14R1.988 CNC(C)C(O)c1cc(C)ccc1F Amb35741307 [0,2,0,0,0,0|0,0,0]=2 5383 B14R1.988 CNC(C)C(O)c1cc(C)cnc1N Amb35621599 [0,2,0,0,0,0|1,0,0]=3 5384 B14R1.988 CNC(C)C(O)c1cc(Cl)ccc1Cl Amb35741304 [0,2,0,0,0,0|0,0,0]=2 5385 B14R1.988 CNC(C)C(O)c1cc(Cl)cnc1N Amb35621611 [0,2,0,0,0,0|1,0,0]=3 5386 B14R1.988 CNC(C)C(O)c1cc(F)ccc1C Amb35741305 [0,2,0,0,0,0|0,0,0]=2 5387 B14R1.988 CNC(C)C(O)c1cc(F)ccc1Cl Amb35621419 [0,2,0,0,0,0|0,0,0]=2 5388 B14R1.988 CNC(C)C(O)c1cc(F)ccc1F Amb18566303 [0,2,0,0,0,0|0,0,0]=2 5389 B14R1.988 CN[C@@H](C)C(=O)c1cc(Br)ccc1F Amb35662204 [0,2,0,0,0,0|0,0,2]=4 5390 B14R1.988 CN[C@@H](C)C(=O)c1cc(C)ccc1C Amb29891471 [0,2,0,0,0,0|0,0,2]=4 5391 B14R1.988 CN[C@@H](C)C(=O)c1cc(C)ccc1Cl Amb35662586 [0,2,0,0,0,0|0,0,2]=4 5392 B14R1.988 CN[C@@H](C)C(=O)c1cc(C)ccc1F Amb29891581 [0,2,0,0,0,0|0,0,2]=4 5393 B14R1.988 CN[C@@H](C)C(=O)c1cc(Cl)ccc1Cl Amb35662200 [0,2,0,0,0,0|0,0,2]=4 5394 B14R1.988 CN[C@@H](C)C(=O)c1cc(F)ccc1C Amb29891580 [0,2,0,0,0,0|0,0,2]=4 5395 B14R1.988 CN[C@@H](C)C(=O)c1cc(F)ccc1Cl Amb35662195 [0,2,0,0,0,0|0,0,2]=4 5396 B14R1.988 CN[C@@H](C)C(=O)c1cc(F)ccc1F Amb29891593 [0,2,0,0,0,0|0,0,2]=4 5397 B14R1.988 CN[C@@H](C)C(O)c1cc(Br)ccc1F Amb29891597 [0,2,0,0,0,0|0,0,0]=2 5398 B14R1.988 CN[C@@H](C)C(O)c1cc(C)ccc1C Amb35662345 [0,2,0,0,0,0|0,0,0]=2 5399 B14R1.988 CN[C@@H](C)C(O)c1cc(C)ccc1Cl Amb30038950 [0,2,0,0,0,0|0,0,0]=2 5400 B14R1.988 CN[C@@H](C)C(O)c1cc(C)ccc1F Amb35663978 [0,2,0,0,0,0|0,0,0]=2 5401 B14R1.988 CN[C@@H](C)C(O)c1cc(C)cnc1N Amb29891492 [0,2,0,0,0,0|1,0,0]=3 5402 B14R1.988 CN[C@@H](C)C(O)c1cc(Cl)ccc1Cl Amb35663976 [0,2,0,0,0,0|0,0,0]=2 5403 B14R1.988 CN[C@@H](C)C(O)c1cc(Cl)cnc1N Amb29891493 [0,2,0,0,0,0|1,0,0]=3 5404 B14R1.988 CN[C@@H](C)C(O)c1cc(F)ccc1C Amb35663931 [0,2,0,0,0,0|0,0,0]=2 5405 B14R1.988 CN[C@@H](C)C(O)c1cc(F)ccc1Cl Amb30038946 [0,2,0,0,0,0|0,0,0]=2 5406 B14R1.988 CN[C@@H](C)C(O)c1cc(F)ccc1F Amb30038951 [0,2,0,0,0,0|0,0,0]=2 5407 B14R1.988 COC(C)C(N)c1cc(C)ccc1C Amb28409733 [0,2,0,0,0,0|2,0,0]=4 5408 B14R1.988 COC(C)C(N)c1cc(C)ccc1F Amb27871375 [0,2,0,0,0,0|2,0,0]=4 5409 B14R1.988 COC(C)C(N)c1cc(Cl)ccc1Cl Amb28312897 [0,2,0,0,0,0|2,0,0]=4 5410 B14R1.988 COC(C)C(N)c1cc(F)ccc1F Amb27629496 [0,2,0,0,0,0|2,0,0]=4 5411 B14R1.988 COC(C)C(O)c1cc(Br)ccc1F Amb27747451 [0,2,0,0,0,0|1,0,0]=3 5412 B14R1.988 Cc1ccc(Br)c(C(O)C(C)CN)c1 Amb27865241 [0,2,0,0,0,0|2,0,0]=4 5413 B14R1.988 Cc1ccc(C)c(C(O)C(C)C#N)c1 Amb27654598 [0,2,0,0,0,0|2,0,0]=4 5414 B14R1.988 Cc1ccc(Cl)cc1C(O)C(C)CN Amb27658513 [0,2,0,0,0,0|2,0,0]=4 5415 B14R1.993 CC(C#N)C(O)c1cc(F)cc(Cl)c1 Amb27647197 [0,2,0,0,0,0|2,0,0]=4 5416 B14R1.993 CC(C#N)C(O)c1cc(F)cc(F)c1 Amb27837257 [0,2,0,0,0,0|2,0,0]=4 5417 B14R1.993 CC(CN)C(O)c1cc(Cl)cc(Br)c1 Amb27803561 [0,2,0,0,0,0|2,0,0]=4 5418 B14R1.993 CC(CN)C(O)c1cc(F)cc(F)c1 Amb28185310 [0,2,0,0,0,0|2,0,0]=4 5419 B14R1.993 CCC(C)C(Cl)c1cc(C)cc(F)c1 Amb27589848 [0,2,0,0,0,0|2,0,0]=4 5420 B14R1.993 CCC(C)C(Cl)c1cc(F)cc(F)c1 Amb27260564 [0,2,0,0,0,0|2,0,0]=4 5421 B14R1.993 CCC(C)C(N)c1cc(Cl)cc(Cl)c1 Amb28046691 [0,2,0,0,0,0|2,0,0]=4 5422 B14R1.993 CCC(C)C(N)c1cc(F)cc(Br)c1 Amb27225612 [0,2,0,0,0,0|2,0,0]=4 5423 B14R1.993 CCC(C)C(N)c1cc(F)cc(F)c1 Amb28381846 [0,2,0,0,0,0|2,0,0]=4 5424 B14R1.993 CCC(C)C(N)c1cc(O)cc(O)c1 Amb27217128 [0,2,0,0,0,0|2,0,0]=4 5425 B14R1.993 CCC(C)C(O)c1cc(Br)cc(Br)c1 Amb28126203 [0,2,0,0,0,0|1,0,0]=3 5426 B14R1.993 CCC(C)C(O)c1cc(C)cc(Cl)c1 Amb27766072 [0,2,0,0,0,0|1,0,0]=3 5427 B14R1.993 CCC(C)C(O)c1cc(C)nc(C)c1 Amb27399215 [0,2,0,0,0,0|2,0,0]=4 5428 B14R1.993 CCC(C)C(O)c1cc(F)cc(Br)c1 Amb27597749 [0,2,0,0,0,0|1,0,0]=3 5429 B14R1.993 CCC(C)C(O)c1cc(N)cc(Br)c1 Amb35584704 [0,2,0,0,0,0|1,0,0]=3 5430 B14R1.993 CCC(C)C(O)c1cc(N)cc(Cl)c1 Amb35742036 [0,2,0,0,0,0|1,0,0]=3 5431 B14R1.993 CCC(C)[C@@H](N)c1cc(Br)cc(Br)c1 Amb27445535 [0,2,0,0,0,0|2,0,0]=4 5432 B14R1.993 CCC(C)[C@H](N)c1cc(Br)cc(Br)c1 Amb27786050 [0,2,0,0,0,0|2,0,0]=4 5433 B14R1.993 CCC(C)[C@H](N)c1cc(Cl)cc(Cl)c1 Amb27628071 [0,2,0,0,0,0|2,0,0]=4 5434 B14R1.993 CCC(C)[C@H](N)c1cc(F)cc(Br)c1 Amb27475364 [0,2,0,0,0,0|2,0,0]=4 5435 B14R1.993 CCC(C)[C@H](N)c1cc(F)cc(F)c1 Amb27430516 [0,2,0,0,0,0|2,0,0]=4 5436 B14R1.993 CCC(N)C(O)c1cc(C)cc(F)c1 Amb27776935 [0,2,0,0,0,0|2,0,0]=4 5437 B14R1.993 CCC(N)C(O)c1cc(F)cc(Br)c1 Amb27645830 [0,2,0,0,0,0|2,0,0]=4 5438 B14R1.993 CCC(N)C(O)c1cc(F)cc(Cl)c1 Amb28071728 [0,2,0,0,0,0|2,0,0]=4 5439 B14R1.993 CCC(O)C(O)c1cc(C)cc(C)c1 Amb28200320 [0,2,0,0,0,0|2,0,0]=4 5440 B14R1.993 CC[C@@H](N)C(O)c1cc(C)cc(C)c1 Amb35659318 [0,2,0,0,0,0|2,0,0]=4 5441 B14R1.993 CC[C@@H](N)C(O)c1cc(C)cc(F)c1 Amb30038855 [0,2,0,0,0,0|2,0,0]=4 5442 B14R1.993 CC[C@@H](N)C(O)c1cc(F)cc(F)c1 Amb35659320 [0,2,0,0,0,0|2,0,0]=4 5443 B14R1.993 CC[C@@H](N)[C@@H](O)c1cc(C)cc(F)c1 Amb27630504 [0,2,0,0,0,0|2,0,0]=4 5444 B14R1.993 CC[C@@H](N)[C@@H](O)c1cc(Cl)cc(Cl)c1 Amb27791016 [0,2,0,0,0,0|2,0,0]=4 5445 B14R1.993 CC[C@@H](N)[C@H](O)c1cc(F)cc(Cl)c1 Amb27777351 [0,2,0,0,0,0|2,0,0]=4 5446 B14R1.993 CC[C@H](N)C(O)c1cc(C)cc(C)c1 Amb35601425 [0,2,0,0,0,0|2,0,0]=4 5447 B14R1.993 CC[C@H](N)C(O)c1cc(C)cc(F)c1 Amb35601360 [0,2,0,0,0,0|2,0,0]=4 5448 B14R1.993 CC[C@H](N)C(O)c1cc(F)cc(F)c1 Amb35601432 [0,2,0,0,0,0|2,0,0]=4 5449 B14R1.993 CC[C@H](N)[C@@H](O)c1cc(Cl)cc(Cl)c1 Amb27964177 [0,2,0,0,0,0|2,0,0]=4 5450 B14R1.993 CC[C@H](N)[C@@H](O)c1cc(O)cc(F)c1 Amb27818195 [0,2,0,0,0,0|2,0,0]=4 5451 B14R1.993 CC[C@H](N)[C@H](O)c1cc(Cl)cc(Cl)c1 Amb28071307 [0,2,0,0,0,0|2,0,0]=4 5452 B14R1.993 CNC(C)C(O)c1cc(C)cc(C)c1 Amb35741301 [0,2,0,0,0,0|0,0,0]=2 5453 B14R1.993 CNC(C)C(O)c1cc(C)cc(F)c1 Amb35621417 [0,2,0,0,0,0|0,0,0]=2 5454 B14R1.993 CNC(C)C(O)c1cc(F)cc(F)c1 Amb35741303 [0,2,0,0,0,0|0,0,0]=2 5455 B14R1.993 CN[C@@H](C)C(=O)c1cc(C)cc(C)c1 Amb29891470 [0,2,0,0,0,0|0,0,2]=4 5456 B14R1.993 CN[C@@H](C)C(=O)c1cc(C)cc(F)c1 Amb29891584 [0,2,0,0,0,0|0,0,2]=4 5457 B14R1.993 CN[C@@H](C)C(=O)c1cc(F)cc(F)c1 Amb29891591 [0,2,0,0,0,0|0,0,2]=4 5458 B14R1.993 CN[C@@H](C)C(O)c1cc(C)cc(C)c1 Amb35663973 [0,2,0,0,0,0|0,0,0]=2 5459 B14R1.993 CN[C@@H](C)C(O)c1cc(C)cc(F)c1 Amb30038944 [0,2,0,0,0,0|0,0,0]=2 5460 B14R1.993 CN[C@@H](C)C(O)c1cc(F)cc(F)c1 Amb35663975 [0,2,0,0,0,0|0,0,0]=2 5461 B14R1.993 COC(C)C(N)c1cc(C)cc(C)c1 Amb27170295 [0,2,0,0,0,0|2,0,0]=4 5462 B14R1.993 COC(C)C(N)c1cc(C)cc(F)c1 Amb27747349 [0,2,0,0,0,0|2,0,0]=4 5463 B14R1.993 COC(C)C(O)c1cc(C)cc(C)c1 Amb27759595 [0,2,0,0,0,0|1,0,0]=3 5464 B14R1.993 COC(C)C(O)c1cc(F)cc(F)c1 Amb28345562 [0,2,0,0,0,0|1,0,0]=3 5465 B14R1.993 Cc1cc(C)cc(C(O)C(C)C#N)c1 Amb28424025 [0,2,0,0,0,0|2,0,0]=4 5466 B14R1.993 Cc1cc(C)cc(C(O)C(C)CO)c1 Amb27772860 [0,2,0,0,0,0|2,0,0]=4 5467 B14R1.993 Cc1cc(Cl)cc(C(O)C(C)CN)c1 Amb27417985 [0,2,0,0,0,0|2,0,0]=4 5468 B14R1.1014 CC(C#N)C(C)(O)c1cccc(Cl)c1 Amb27387382 [0,2,0,0,0,0|2,0,0]=4 5469 B14R1.1014 CC(CN)C(C)(O)c1cccc(Br)c1 Amb27968657 [0,2,0,0,0,0|2,0,0]=4 5470 B14R1.1014 CCC(C)C(C)(O)c1cccc(Br)c1 Amb28241115 [0,2,0,0,0,0|1,0,0]=3 5471 B14R1.1014 CCC(C)C(C)(O)c1cccc(C)c1 Amb19050749 [0,2,0,0,0,0|1,0,0]=3 5472 B14R1.1014 CCC(C)C(C)(O)c1cccc(Cl)c1 Amb27658002 [0,2,0,0,0,0|1,0,0]=3 5473 B14R1.1014 CCC(C)C(C)(O)c1cncc(Br)c1 Amb35702494 [0,2,0,0,0,0|2,0,0]=4 5474 B14R1.1014 COC(C)C(C)(O)c1cccc(Br)c1 Amb35591780 [0,2,0,0,0,0|1,0,0]=3 5475 B14R1.1014 COC(C)C(C)(O)c1cccc(C)c1 Amb27815993 [0,2,0,0,0,0|1,0,0]=3 5476 B14R1.166 C#CCNC(=O)C(O)c1ccccc1 Amb25166183 [0,2,0,0,0,0|1,0,1]=4 5477 B14R1.166 C#CCNC(=O)[C@@H](O)c1ccccc1 Amb27234689 [0,2,0,0,0,0|1,0,1]=4 5478 B14R1.166 C#C\C=N\C(C)C(O)c1ccccc1 Amb27753011 [0,2,0,0,0,0|0,0,2]=4 5479 B14R1.166 C=CCNC(=O)C(O)c1ccccc1 Amb17401510 [0,2,0,0,0,0|1,0,1]=4 5480 B14R1.166 C=CCNC(C)C(O)c1ccccc1 Amb18092962 [0,2,0,0,0,0|0,0,0]=2 5481 B14R1.166 CCC=C=C(C)C(O)c1ccccc1 Amb27394739 [0,2,0,0,0,0|1,0,1]=4 5482 B14R1.166 CCCNC(=O)C(O)c1ccccc1 Amb17401749 [0,2,0,0,0,0|1,0,1]=4 5483 B14R1.166 CCCNC(C)C(O)c1ccccc1 Amb18604509 [0,2,0,0,0,0|0,0,0]=2 5484 B14R1.166 COC=C=C(C)C(O)c1ccccc1 Amb27773143 [0,2,0,0,0,0|1,0,1]=4 5485 B14R1.166 O=C(NCCO)C(O)c1ccccc1 Amb2613781 [0,2,0,0,0,0|1,0,1]=4 5486 B14R1.417 CC(=O)NC(C)C(=O)c1ccccc1 Amb27392210 [0,2,0,0,0,0|0,0,2]=4 5487 B14R1.417 CC(=O)NC(Cl)C(O)c1ccccc1 Amb27413588 [0,2,0,0,0,0|1,0,0]=3 5488 B14R1.417 CC(=O)N[C@@H](C)[C@@H](Cl)c1ccccc1 Amb28286735 [0,2,0,0,0,0|1,0,0]=3 5489 B14R1.417 CC(=O)N[C@@H](C)[C@H](O)c1ccccc1 Amb26646866 [0,2,0,0,0,0|0,0,0]=2 5490 B14R1.417 CC(=O)N[C@H](Cl)[C@H](O)c1ccccc1 Amb28121207 [0,2,0,0,0,0|1,0,0]=3 5491 B14R1.417 CC(=S)N[C@H](C)[C@@H](O)c1ccccc1 Amb28240471 [0,2,0,0,0,0|0,0,0]=2 5492 B14R1.417 CC(C)=CC(O)C(O)c1ccccc1 Amb27220192 [0,2,0,0,0,0|2,0,0]=4 5493 B14R1.417 CC(C)=C[C@H](C)[C@@H](O)c1ccccc1 Amb28069712 [0,2,0,0,0,0|1,0,0]=3 5494 B14R1.417 CC(C)NC(=O)C(O)c1ccccc1 Amb17401750 [0,2,0,0,0,0|1,0,1]=4 5495 B14R1.417 CC(CN(C)C)C(=O)c1ccccc1 Amb2228745 [0,2,0,0,0,0|0,0,2]=4 5496 B14R1.417 CC(CN(C)C)C(=O)c1ccccc1 Amb3940648 [0,2,0,0,0,0|0,0,2]=4 5497 B14R1.417 CN(C)\N=C(\N)C(O)c1ccccc1 Amb27233438 [0,2,0,0,0,0|1,0,1]=4 5498 B14R1.478 CCNC(CC)C(O)c1ccccc1 Amb18093006 [0,2,0,0,0,0|0,0,0]=2 5499 B14R1.510 CC(CCN)C(C)(C)c1ccccc1 Amb33475501 [0,2,0,0,0,0|2,0,0]=4 5500 B14R1.510 CC(CCN)C(F)(F)c1ccccc1 Amb33081928 [0,2,0,0,0,0|2,0,0]=4 5501 B14R1.510 CNCC(O)C(C)(C)c1ccccc1 Amb33475504 [0,2,0,0,0,0|2,0,0]=4 5502 B14R1.510 CNCC(O)C(F)(F)c1ccccc1 Amb32951283 [0,2,0,0,0,0|2,0,0]=4 5503 B14R1.3348 CC(CC#N)C(O)c1ccccc1Cl Amb17339410 [0,2,0,0,0,0|1,0,1]=4 5504 B14R1.6708 C=C=CC(C)(C)C(O)c1ccccc1 Amb28065225 [0,2,0,0,0,0|1,0,1]=4 5505 B14R1.6708 CC(c1ccccc1)C(C)(C)CCN Amb33081612 [0,2,0,0,0,0|2,0,0]=4 5506 B14R1.6708 CCNC(C)(Cl)C(=O)c1ccccc1 Amb24104241 [0,2,0,0,0,0|0,0,2]=4 5507 B14R1.6708 C\C=C\[C@](C)(O)[C@H](O)c1ccccc1 Amb28345293 [0,2,0,0,0,0|1,0,0]=3 5508 B14R1.391 CN\C(OC)=C(/OC)c1ccccc1 Amb27780161 [0,2,0,0,0,0|0,0,2]=4 5509 B14R1.391 COC(OC)C(C#N)c1ccccc1 Amb32674849 [0,2,0,0,0,0|2,0,0]=4 5510 B14R1.1017 C#CC(C(C)C)C(O)c1ccccc1 Amb28078910 [0,2,0,0,0,0|1,0,1]=4 5511 B14R1.1017 CC(C)[C@@H](C#N)[C@@H](O)c1ccccc1 Amb28370102 [0,2,0,0,0,0|1,0,1]=4 5512 B14R1.1017 CNC(C(=O)c1ccccc1)C(C)C Amb18564926 [0,2,0,0,0,0|0,0,2]=4 5513 B14R1.2883 C#CC(C)(OC)C(O)c1ccccc1 Amb27775428 [0,2,0,0,0,0|1,0,0]=3 5514 B14R1.2883 C#CC(C)(OC)[C@H](O)c1ccccc1 Amb27457722 [0,2,0,0,0,0|1,0,0]=3 5515 B14R1.2883 CCC(C)(C#N)C(O)c1ccccn1 Amb27388991 [0,2,0,0,0,0|2,0,0]=4 5516 B14R1.2883 CCC(C)(C#N)C(O)c1ccncc1 Amb27387245 [0,2,0,0,0,0|2,0,0]=4 5517 B14R1.2883 COC(C)(CN)C(C)c1ccccc1 Amb33081898 [0,2,0,0,0,0|2,0,0]=4 5518 B14R1.3624 CCC(C#N)C(O)c1ccccc1Br Amb27258595 [0,2,0,0,0,0|1,0,1]=4 5519 B14R1.3624 CCC(C#N)C(O)c1ccccc1C Amb27263506 [0,2,0,0,0,0|1,0,1]=4 5520 B14R1.3624 CCC(C#N)C(O)c1ccccc1F Amb27387315 [0,2,0,0,0,0|1,0,1]=4 5521 B14R1.243 CC(=O)C(Cl)C(O)c1ccccc1F Amb28041365 [0,2,0,0,0,0|2,0,0]=4 5522 B14R1.243 CC(=O)[C@@H](Cl)[C@@H](O)c1ccccc1F Amb27827443 [0,2,0,0,0,0|2,0,0]=4 5523 B14R1.243 CC(=O)[C@H](O)[C@@H](O)c1ccccc1F Amb27981678 [0,2,0,0,0,0|2,0,0]=4 5524 B14R1.243 CC(C(O)c1ccccc1Cl)[N+](=O)[O-] Amb32416325 [0,2,0,0,0,0|1,0,1]=4 5525 B14R1.243 CC(C(O)c1ccccc1F)[N+](=O)[O-] Amb28323269 [0,2,0,0,0,0|1,0,1]=4 5526 B14R1.243 CC(C)C(C)C(O)c1cccnc1Br Amb35702821 [0,2,0,0,0,0|2,0,0]=4 5527 B14R1.243 CC(C)C(C)C(O)c1ccncc1Cl Amb27491557 [0,2,0,0,0,0|2,0,0]=4 5528 B14R1.243 CC(C)C(C)C(O)c1cnccc1N Amb28239269 [0,2,0,0,0,0|2,0,0]=4 5529 B14R1.243 CC(C)C(C)C(O)c1ncccc1N Amb35582166 [0,2,0,0,0,0|2,0,0]=4 5530 B14R1.243 CC(C)C(N)C(O)c1ccccc1F Amb18565953 [0,2,0,0,0,0|2,0,0]=4 5531 B14R1.243 CC(C)C(N)C(O)c1ccccc1N Amb27792179 [0,2,0,0,0,0|2,0,0]=4 5532 B14R1.243 CC(C)[C@@H](N)C(O)c1ccccc1Cl Amb35623728 [0,2,0,0,0,0|2,0,0]=4 5533 B14R1.243 CC(C)[C@@H](N)C(O)c1ccccc1F Amb35623729 [0,2,0,0,0,0|2,0,0]=4 5534 B14R1.243 CC(C)[C@@H](N)[C@@H](O)c1ccccc1Cl Amb27618578 [0,2,0,0,0,0|2,0,0]=4 5535 B14R1.243 CC(C)[C@@H](N)[C@@H](O)c1ccccc1F Amb27879037 [0,2,0,0,0,0|2,0,0]=4 5536 B14R1.243 CC(C)[C@@H](N)[C@H](O)c1ccccc1N Amb27964178 [0,2,0,0,0,0|2,0,0]=4 5537 B14R1.243 CC(C)[C@H](N)C(O)c1ccccc1Cl Amb35737509 [0,2,0,0,0,0|2,0,0]=4 5538 B14R1.243 CC(C)[C@H](N)C(O)c1ccccc1F Amb35737510 [0,2,0,0,0,0|2,0,0]=4 5539 B14R1.243 CC(C)[C@H](N)[C@@H](O)c1ccccc1Br Amb27985353 [0,2,0,0,0,0|2,0,0]=4 5540 B14R1.243 CC(C)[C@H](N)[C@@H](O)c1ccccc1F Amb27635391 [0,2,0,0,0,0|2,0,0]=4 5541 B14R1.243 CC(C)[C@H](N)[C@H](O)c1ccccc1Cl Amb27777362 [0,2,0,0,0,0|2,0,0]=4 5542 B14R1.243 CC(C)[C@H](N)[C@H](O)c1ccccc1F Amb28129308 [0,2,0,0,0,0|2,0,0]=4 5543 B14R1.243 CC(N)C(C)C(O)c1ccccc1Cl Amb35624844 [0,2,0,0,0,0|1,0,0]=3 5544 B14R1.243 CC(N)C(C)C(O)c1ccccc1F Amb35624836 [0,2,0,0,0,0|1,0,0]=3 5545 B14R1.243 CC(N)C(C)C(O)c1cccnc1N Amb35624931 [0,2,0,0,0,0|2,0,0]=4 5546 B14R1.243 CC(N)C(C)C(O)c1ccncc1F Amb35584650 [0,2,0,0,0,0|2,0,0]=4 5547 B14R1.243 CC(N)C(C)C(O)c1cnccc1N Amb35624930 [0,2,0,0,0,0|2,0,0]=4 5548 B14R1.243 CN(C)C(=O)C(O)c1ccccc1Br Amb25754296 [0,2,0,0,0,0|1,0,1]=4 5549 B14R1.243 CN(C)C(=O)C(O)c1ccccc1F Amb25220155 [0,2,0,0,0,0|1,0,1]=4 5550 B14R1.243 Cc1ccccc1C(O)C(=O)N(C)C Amb24359091 [0,2,0,0,0,0|1,0,1]=4 5551 B14R1.243 Cc1ccccc1C(O)C(C)C(C)N Amb35624685 [0,2,0,0,0,0|1,0,0]=3 5552 B14R1.243 Cc1ccccc1C(O)C(C)[N+](=O)[O-] Amb27450352 [0,2,0,0,0,0|1,0,1]=4 5553 B14R1.243 Cc1ccccc1C(O)C(N)C(C)C Amb18565325 [0,2,0,0,0,0|2,0,0]=4 5554 B14R1.243 Cc1ccccc1C(O)[C@@H](N)C(C)C Amb35588418 [0,2,0,0,0,0|2,0,0]=4 5555 B14R1.243 Cc1ccccc1C(O)[C@H](N)C(C)C Amb35623662 [0,2,0,0,0,0|2,0,0]=4 5556 B14R1.243 Cc1ccccc1[C@@H](O)[C@@H](N)C(C)C Amb28076147 [0,2,0,0,0,0|2,0,0]=4 5557 B14R1.243 Cc1ccccc1[C@@H](O)[C@H](N)C(C)C Amb27626937 [0,2,0,0,0,0|2,0,0]=4 5558 B14R1.243 Cc1ccccc1[C@H](O)[C@@H](N)C(C)C Amb27467892 [0,2,0,0,0,0|2,0,0]=4 5559 B14R1.243 Cc1ccccc1[C@H](O)[C@H](N)C(C)C Amb27879048 [0,2,0,0,0,0|2,0,0]=4 5560 B14R1.243 Cc1ccncc1C(O)C(C)C(C)C Amb28282077 [0,2,0,0,0,0|2,0,0]=4 5561 B14R1.243 Cc1ccncc1C(O)C(C)C(C)N Amb35624764 [0,2,0,0,0,0|2,0,0]=4 5562 B14R1.243 Cc1cnccc1C(O)C(C)C(C)C Amb28342557 [0,2,0,0,0,0|2,0,0]=4 5563 B14R1.1027 CN(C)C(=O)C(CO)c1ccccc1 Amb28653479 [0,2,0,0,0,0|1,0,1]=4 5564 B14R1.1027 CN(C)N(C)C(CN)c1ccccc1 Amb18065028 [0,2,0,0,0,0|2,0,0]=4 5565 B14R1.6306 CC(C(=O)O)C(C)(O)c1ccccc1 Amb18990602 [0,2,0,0,0,0|2,0,0]=4 5566 B14R1.6306 CC(C)C(C)C(C)(O)c1ccccc1 Amb27492830 [0,2,0,0,0,0|1,0,0]=3 5567 B14R1.6306 CC(C)C(C)C(C)(O)c1cccnc1 Amb27830966 [0,2,0,0,0,0|2,0,0]=4 5568 B14R1.6306 CC(C)C(O)C(C)(O)c1ccccc1 Amb27653191 [0,2,0,0,0,0|2,0,0]=4 5569 B14R1.6306 CC(C)[C@@H](O)[C@](C)(O)c1ccccc1 Amb28065920 [0,2,0,0,0,0|2,0,0]=4 5570 B14R1.6306 CC(O)C(C)C(C)(N)c1ccccc1 Amb35654196 [0,2,0,0,0,0|2,0,0]=4 5571 B14R1.6306 C[C@@H](C(=O)O)[C@@](C)(O)c1ccccc1 Amb28190955 [0,2,0,0,0,0|2,0,0]=4 5572 B14R1.6306 C[C@H](C(=O)O)[C@](C)(O)c1ccccc1 Amb27263067 [0,2,0,0,0,0|2,0,0]=4 5573 B14R1.6391 CC(=O)C(C)(C)C(O)c1ccccc1 Amb27218971 [0,2,0,0,0,0|1,0,0]=3 5574 B14R1.6391 CC(=O)[C@@](C)(N)[C@@H](O)c1ccccc1 Amb27230210 [0,2,0,0,0,0|1,0,0]=3 5575 B14R1.6391 CC(C)(C(F)F)C(O)c1ccccc1 Amb35660895 [0,2,0,0,0,0|2,0,0]=4 5576 B14R1.6391 CC(C)(C(O)c1ccccc1)[N+](=O)[O-] Amb24192781 [0,2,0,0,0,0|1,0,1]=4 5577 B14R1.6391 CC(C)C(C)(C)C(O)c1ccccc1 Amb28350028 [0,2,0,0,0,0|1,0,0]=3 5578 B14R1.6391 CC(C)C(C)(O)C(N)c1ccccc1 Amb27199200 [0,2,0,0,0,0|2,0,0]=4 5579 B14R1.6391 CC(O)C(C)(O)C(O)c1ccccc1 Amb27405228 [0,2,0,0,0,0|1,0,0]=3 5580 B14R1.6391 CN(C)C(C)(C)C(=O)c1ccccc1 Amb26979865 [0,2,0,0,0,0|0,0,2]=4 5581 B14R1.6391 CN(C)C(C)(C)C(N)c1ccccc1 Amb28184079 [0,2,0,0,0,0|1,0,0]=3 5582 B14R1.6391 C[C@@](Cl)(C(=O)O)[C@@H](O)c1ccccc1 Amb28255654 [0,2,0,0,0,0|2,0,0]=4 5583 B14R1.6391 C[C@H](O)C(C)(C)[C@@H](C)c1ccccc1 Amb28350049 [0,2,0,0,0,0|2,0,0]=4 5584 B14R1.6391 C[C@](N)(C(=O)O)[C@@H](O)c1ccccc1 Amb27966817 [0,2,0,0,0,0|2,0,0]=4 5585 B14R1.10526 CC(C(Br)c1ccccc1)C(C)(C)C Amb27628005 [0,2,0,0,0,0|2,0,0]=4 5586 B14R1.10526 CC(C(Cl)c1ccccc1)C(C)(C)C Amb27631009 [0,2,0,0,0,0|2,0,0]=4 5587 B14R1.10526 CC(C(Cl)c1ccccc1)C(C)(F)F Amb28128247 [0,2,0,0,0,0|2,0,0]=4 5588 B14R1.10526 CC(C(N)c1ccccc1)S(C)(=O)=O Amb18997173 [0,2,0,0,0,0|2,0,0]=4 5589 B14R1.10526 CC(C(O)c1ccccc1)C(C)(F)F Amb27872870 [0,2,0,0,0,0|1,0,0]=3 5590 B14R1.10526 CC(C(O)c1ccccc1)[N+](C)(C)C Amb22455077 [0,2,0,0,0,0|0,0,1]=3 5591 B14R1.10526 CC(C)(C)[C@@H](N)C(O)c1ccccc1 Amb35623621 [0,2,0,0,0,0|2,0,0]=4 5592 B14R1.10526 CC(C)(C)[C@H](N)C(O)c1ccccc1 Amb35617732 [0,2,0,0,0,0|2,0,0]=4 5593 B14R1.10526 CC(C)(O)C(O)C(O)c1ccccc1 Amb28069715 [0,2,0,0,0,0|2,0,0]=4 5594 B14R1.10526 CC(C)(O)[C@@H](O)[C@H](O)c1ccccc1 Amb27405239 [0,2,0,0,0,0|2,0,0]=4 5595 B14R1.10526 CC(C)(O)[C@H](O)[C@@H](O)c1ccccc1 Amb28455131 [0,2,0,0,0,0|2,0,0]=4 5596 B14R1.10526 C[C@@H]([C@H](O)c1ccccc1)[N+](C)(C)C Amb22366802 [0,2,0,0,0,0|0,0,1]=3 5597 B14R1.10526 C[Si](C)(C)C(N)C(O)c1ccccc1 Amb27758080 [0,2,0,0,0,0|2,0,0]=4 5598 B14R1.10526 C[Si](C)(C)[C@H](N)[C@@H](O)c1ccccc1 Amb27254243 [0,2,0,0,0,0|2,0,0]=4 5599 B14R1.91 CC(C)(C#N)C(C)(O)c1ccccc1 Amb1812249 [0,2,0,0,0,0|2,0,0]=4 5600 B14R1.91 CNC(C)(C)C(C)(C)c1ccccc1 Amb25701754 [0,2,0,0,0,0|1,0,0]=3 5601 B14R1.91 CNC(C)(C)C(F)(F)c1ccccc1 Amb33082511 [0,2,0,0,0,0|1,0,0]=3 5602 B14R1.91 COC(C)(C)C(C)(O)c1ccccc1 Amb28140090 [0,2,0,0,0,0|1,0,0]=3 5603 B14R1.91 C[C@@](N)(CO)[C@](C)(O)c1ccccc1 Amb28368245 [0,2,0,0,0,0|2,0,0]=4 5604 B14R1.2903 CC(C)(NO)\C(=N\O)c1ccccc1 Amb1004702 [0,2,0,0,0,0|1,0,1]=4 5605 B14R1.2903 CNC(C)(C)\C(=N\O)c1ccccc1 Amb8559692 [0,2,0,0,0,0|0,0,1]=3 5606 B14R1.2903 C\N=C(/c1ccccc1)C(C)(C)NC Amb26078291 [0,2,0,0,0,0|1,0,1]=4 5607 B14R1.5665 CC(C)(C#N)C(O)c1ccccc1Br Amb27801489 [0,2,0,0,0,0|2,0,0]=4 5608 B14R1.5665 CC(C)(C#N)C(O)c1ccccc1Cl Amb27460699 [0,2,0,0,0,0|2,0,0]=4 5609 B14R1.5665 CC(C)(CO)[C@@H](O)c1ccccc1Cl Amb24046276 [0,2,0,0,0,0|2,0,0]=4 5610 B14R1.5665 CC(C)(CO)[C@H](O)c1ccccc1Br Amb27970219 [0,2,0,0,0,0|2,0,0]=4 5611 B14R1.5665 CC(C)(CO)[C@H](O)c1ccccc1Cl Amb27963917 [0,2,0,0,0,0|2,0,0]=4 5612 B14R1.5665 CCC(C)(C)C(O)c1ccccc1F Amb27593602 [0,2,0,0,0,0|1,0,0]=3 5613 B14R1.5665 CCC(C)(C)C(O)c1ccccc1O Amb28365232 [0,2,0,0,0,0|1,0,0]=3 5614 B14R1.5665 CCC(C)(C)C(O)c1cccnc1Br Amb35670265 [0,2,0,0,0,0|2,0,0]=4 5615 B14R1.5665 CCC(C)(C)C(O)c1cccnc1N Amb27191708 [0,2,0,0,0,0|2,0,0]=4 5616 B14R1.5665 CCC(C)(N)C(O)c1ccccc1C Amb35587090 [0,2,0,0,0,0|1,0,0]=3 5617 B14R1.5665 CCC(C)(N)C(O)c1ccccc1Cl Amb35742169 [0,2,0,0,0,0|1,0,0]=3 5618 B14R1.5665 CCC(C)(N)C(O)c1ccccc1F Amb35742149 [0,2,0,0,0,0|1,0,0]=3 5619 B14R1.5665 CCC(C)(N)C(O)c1cccnc1N Amb35742187 [0,2,0,0,0,0|2,0,0]=4 5620 B14R1.5665 CCC(C)(N)C(O)c1ccncc1F Amb35622305 [0,2,0,0,0,0|2,0,0]=4 5621 B14R1.5665 CCC(C)(N)C(O)c1cnccc1C Amb35742086 [0,2,0,0,0,0|2,0,0]=4 5622 B14R1.5665 CCC(C)(N)C(O)c1cnccc1N Amb35742214 [0,2,0,0,0,0|2,0,0]=4 5623 B14R1.5665 CCC(C)(O)C(O)c1ccccc1F Amb27661310 [0,2,0,0,0,0|1,0,0]=3 5624 B14R1.5665 CCC(F)(F)C(O)c1ccccc1C Amb35645209 [0,2,0,0,0,0|2,0,0]=4 5625 B14R1.5665 CCC(F)(F)C(O)c1ccccc1Cl Amb35645156 [0,2,0,0,0,0|2,0,0]=4 5626 B14R1.5665 CCC(F)(F)C(O)c1ccccc1F Amb35645213 [0,2,0,0,0,0|2,0,0]=4 5627 B14R1.5665 CNC(C)(C)C(F)c1ccccc1C Amb27801906 [0,2,0,0,0,0|1,0,0]=3 5628 B14R1.5665 CNC(C)(C)C(O)c1ccccc1Cl Amb27835497 [0,2,0,0,0,0|0,0,0]=2 5629 B14R1.5665 CNC(C)(C)C(O)c1cccnc1Br Amb29886990 [0,2,0,0,0,0|1,0,0]=3 5630 B14R1.5665 COC(C)(C)C(O)c1ccccc1C Amb28078233 [0,2,0,0,0,0|1,0,0]=3 5631 B14R1.5665 COC(C)(C)C(O)c1cccnc1Br Amb35670267 [0,2,0,0,0,0|2,0,0]=4 5632 B14R1.5665 CSC(C)(C)C(N)c1ccccc1F Amb27244336 [0,2,0,0,0,0|2,0,0]=4 5633 B14R1.5665 CSC(C)(C)C(O)c1ccccc1C Amb27965967 [0,2,0,0,0,0|1,0,0]=3 5634 B14R1.5665 CSC(C)(C)C(O)c1cccnc1N Amb27402743 [0,2,0,0,0,0|2,0,0]=4 5635 B14R1.5665 Cc1ccccc1C(O)C(C)(C)CN Amb18910515 [0,2,0,0,0,0|2,0,0]=4 5636 B14R1.2982 CCC(C)C(C)(C#N)c1ccccc1 Amb35711331 [0,2,0,0,0,0|2,0,0]=4 5637 B14R1.2984 CCC(C)C(C(=O)Cl)c1ccccc1 Amb6743386 [0,2,0,0,0,0|1,0,1]=4 5638 B14R1.2984 CCC(C)C(C(=O)O)c1ccccc1 Amb3939884 [0,2,0,0,0,0|1,0,0]=3 5639 B14R1.2984 CCN(C)C(C(=O)O)c1ccccc1 Amb19373061 [0,2,0,0,0,0|2,0,0]=4 5640 B14R1.2984 CNC(=O)C(C(=O)O)c1ccccc1 Amb28184092 [0,2,0,0,0,0|1,0,1]=4 5641 B14R1.7706 COC(c1ccccc1Cl)C(C)NO Amb32941939 [0,2,0,0,0,0|1,0,0]=3 5642 B14R1.95 CCC(N)C(O)c1ccccc1C#N Amb27870400 [0,2,0,0,0,0|2,0,0]=4 5643 B14R1.95 CCc1ccccc1C(O)C(C)C#N Amb27387376 [0,2,0,0,0,0|2,0,0]=4 5644 B14R1.95 CNC(=O)C(O)c1ccccc1OC Amb26022196 [0,2,0,0,0,0|1,0,1]=4 5645 B14R1.95 CNC(C)C(=O)c1ccccc1OC Amb17313591 [0,2,0,0,0,0|0,0,2]=4 5646 B14R1.2908 C=CC(C)C(C)(O)c1ccccc1O Amb27802751 [0,2,0,0,0,0|1,0,1]=4 5647 B14R1.2908 CC(C#N)C(C)(O)c1ccccc1Cl Amb27872815 [0,2,0,0,0,0|2,0,0]=4 5648 B14R1.2908 CC(C#N)C(C)(O)c1ccccc1F Amb27387314 [0,2,0,0,0,0|2,0,0]=4 5649 B14R1.2908 CCC(C)C(C)(N)c1ccccc1C Amb19050352 [0,2,0,0,0,0|2,0,0]=4 5650 B14R1.2908 CCC(C)C(C)(N)c1ccccc1Cl Amb27769805 [0,2,0,0,0,0|2,0,0]=4 5651 B14R1.2908 CCC(C)C(C)(O)c1ccccc1C Amb19050750 [0,2,0,0,0,0|1,0,0]=3 5652 B14R1.2908 CCC(C)C(C)(O)c1cccnc1Br Amb35702819 [0,2,0,0,0,0|2,0,0]=4 5653 B14R1.2908 CCC(C)C(C)(O)c1cnccc1C Amb27390440 [0,2,0,0,0,0|2,0,0]=4 5654 B14R1.2908 CCC(C)C(C)(O)c1cnccc1N Amb28381602 [0,2,0,0,0,0|2,0,0]=4 5655 B14R1.2908 COC(C)C(C)(O)c1ccccc1C Amb28461553 [0,2,0,0,0,0|1,0,0]=3 5656 B14R1.2908 COC(C)C(C)(O)c1cccnc1Br Amb29887002 [0,2,0,0,0,0|2,0,0]=4 5657 B14R1.2908 Cc1ccccc1C(C)(O)C(C)CN Amb28139256 [0,2,0,0,0,0|2,0,0]=4 5658 B14R1.8657 CC(CN)C(O)c1c(F)cccc1F Amb27827675 [0,2,0,0,0,0|2,0,0]=4 5659 B14R1.8657 CCC(C)C(Cl)c1c(F)cccc1Cl Amb28410077 [0,2,0,0,0,0|2,0,0]=4 5660 B14R1.8657 CCC(C)C(N)c1c(Cl)cccc1Br Amb28293302 [0,2,0,0,0,0|2,0,0]=4 5661 B14R1.8657 CCC(C)C(O)c1c(Br)cncc1Br Amb27878092 [0,2,0,0,0,0|2,0,0]=4 5662 B14R1.8657 CCC(C)C(O)c1c(C)cccc1C Amb28365251 [0,2,0,0,0,0|1,0,0]=3 5663 B14R1.8657 CCC(C)C(O)c1c(F)cccc1Br Amb27219641 [0,2,0,0,0,0|1,0,0]=3 5664 B14R1.8657 CCC(C)C(O)c1c(F)cccc1F Amb27450316 [0,2,0,0,0,0|1,0,0]=3 5665 B14R1.8657 CCC(C)C(O)c1c(F)cncc1F Amb29876715 [0,2,0,0,0,0|2,0,0]=4 5666 B14R1.8657 CCC(C)[C@@H](N)c1c(C)cccc1Cl Amb28056146 [0,2,0,0,0,0|2,0,0]=4 5667 B14R1.8657 CCC(C)[C@@H](N)c1c(F)cccc1F Amb27875510 [0,2,0,0,0,0|2,0,0]=4 5668 B14R1.8657 CCC(C)[C@H](N)c1c(C)cccc1C Amb27776943 [0,2,0,0,0,0|2,0,0]=4 5669 B14R1.8657 CCC(C)[C@H](N)c1c(F)cccc1Br Amb27629802 [0,2,0,0,0,0|2,0,0]=4 5670 B14R1.8657 CCC(C)[C@H](N)c1c(F)cccc1Cl Amb27618580 [0,2,0,0,0,0|2,0,0]=4 5671 B14R1.8657 CCC(N)C(O)c1c(C)cccc1Cl Amb28140760 [0,2,0,0,0,0|2,0,0]=4 5672 B14R1.8657 CCC(N)C(O)c1c(Cl)cccc1Br Amb35620686 [0,2,0,0,0,0|2,0,0]=4 5673 B14R1.8657 CCC(N)C(O)c1c(F)cccc1Br Amb27862660 [0,2,0,0,0,0|2,0,0]=4 5674 B14R1.8657 CCC(N)C(O)c1c(F)cccc1Cl Amb19149265 [0,2,0,0,0,0|2,0,0]=4 5675 B14R1.8657 CCC(N)C(O)c1c(F)cccc1Cl Amb9429028 [0,2,0,0,0,0|2,0,0]=4 5676 B14R1.8657 CCC(N)C(O)c1c(F)cccc1F Amb19149128 [0,2,0,0,0,0|2,0,0]=4 5677 B14R1.8657 CCC(N)C(O)c1c(F)cccc1F Amb9428987 [0,2,0,0,0,0|2,0,0]=4 5678 B14R1.8657 CCC(O)C(O)c1c(Cl)cccc1Br Amb28424005 [0,2,0,0,0,0|2,0,0]=4 5679 B14R1.8657 CC[C@@H](N)C(O)c1c(Cl)cccc1Br Amb35601428 [0,2,0,0,0,0|2,0,0]=4 5680 B14R1.8657 CC[C@@H](N)C(O)c1c(F)cccc1Cl Amb35601429 [0,2,0,0,0,0|2,0,0]=4 5681 B14R1.8657 CC[C@@H](N)C(O)c1c(F)cccc1F Amb30038885 [0,2,0,0,0,0|2,0,0]=4 5682 B14R1.8657 CC[C@@H](N)[C@H](O)c1c(C)cccc1C Amb27445185 [0,2,0,0,0,0|2,0,0]=4 5683 B14R1.8657 CC[C@@H](N)[C@H](O)c1c(C)cccc1Cl Amb27430509 [0,2,0,0,0,0|2,0,0]=4 5684 B14R1.8657 CC[C@@H](N)[C@H](O)c1c(O)cccc1O Amb27439976 [0,2,0,0,0,0|2,0,0]=4 5685 B14R1.8657 CC[C@H](N)C(O)c1c(Cl)cccc1Br Amb35598765 [0,2,0,0,0,0|2,0,0]=4 5686 B14R1.8657 CC[C@H](N)C(O)c1c(F)cccc1Cl Amb35598766 [0,2,0,0,0,0|2,0,0]=4 5687 B14R1.8657 CC[C@H](N)C(O)c1c(F)cccc1F Amb35596798 [0,2,0,0,0,0|2,0,0]=4 5688 B14R1.8657 CC[C@H](N)[C@@H](O)c1c(C)cccc1C Amb27620500 [0,2,0,0,0,0|2,0,0]=4 5689 B14R1.8657 CC[C@H](N)[C@@H](O)c1c(Cl)cccc1Cl Amb28346909 [0,2,0,0,0,0|2,0,0]=4 5690 B14R1.8657 CC[C@H](N)[C@@H](O)c1c(O)cccc1O Amb27430319 [0,2,0,0,0,0|2,0,0]=4 5691 B14R1.8657 CC[C@H](N)[C@H](O)c1c(C)cccc1C Amb28422779 [0,2,0,0,0,0|2,0,0]=4 5692 B14R1.8657 CNC(C)C(=O)c1c(Cl)cccc1Br Amb27174694 [0,2,0,0,0,0|0,0,2]=4 5693 B14R1.8657 CNC(C)C(=O)c1c(F)cccc1Cl Amb27455835 [0,2,0,0,0,0|0,0,2]=4 5694 B14R1.8657 CNC(C)C(=O)c1c(F)cccc1F Amb27398725 [0,2,0,0,0,0|0,0,2]=4 5695 B14R1.8657 CNC(C)C(O)c1c(C)ccnc1N Amb35621616 [0,2,0,0,0,0|1,0,0]=3 5696 B14R1.8657 CNC(C)C(O)c1c(Cl)cccc1Br Amb29875935 [0,2,0,0,0,0|0,0,0]=2 5697 B14R1.8657 CNC(C)C(O)c1c(F)cccc1Cl Amb29875936 [0,2,0,0,0,0|0,0,0]=2 5698 B14R1.8657 CNC(C)C(O)c1c(F)cccc1F Amb35621614 [0,2,0,0,0,0|0,0,0]=2 5699 B14R1.8657 CNC(C)C(O)c1c(F)cncc1F Amb35584024 [0,2,0,0,0,0|1,0,0]=3 5700 B14R1.8657 CN[C@@H](C)C(=O)c1c(Cl)cccc1Br Amb35662205 [0,2,0,0,0,0|0,0,2]=4 5701 B14R1.8657 CN[C@@H](C)C(=O)c1c(F)cccc1Cl Amb35662197 [0,2,0,0,0,0|0,0,2]=4 5702 B14R1.8657 CN[C@@H](C)C(=O)c1c(F)cccc1F Amb29891589 [0,2,0,0,0,0|0,0,2]=4 5703 B14R1.8657 CN[C@@H](C)C(O)c1c(C)ccnc1N Amb29891491 [0,2,0,0,0,0|1,0,0]=3 5704 B14R1.8657 CN[C@@H](C)C(O)c1c(Cl)cccc1Br Amb30039223 [0,2,0,0,0,0|0,0,0]=2 5705 B14R1.8657 CN[C@@H](C)C(O)c1c(F)cccc1Cl Amb30039224 [0,2,0,0,0,0|0,0,0]=2 5706 B14R1.8657 CN[C@@H](C)C(O)c1c(F)cccc1F Amb29891488 [0,2,0,0,0,0|0,0,0]=2 5707 B14R1.8657 CN[C@@H](C)C(O)c1c(F)cncc1F Amb35659846 [0,2,0,0,0,0|1,0,0]=3 5708 B14R1.8657 COC(C)C(N)c1c(F)cccc1Cl Amb28401374 [0,2,0,0,0,0|2,0,0]=4 5709 B14R1.8657 COC(C)C(N)c1c(F)cccc1F Amb28388821 [0,2,0,0,0,0|2,0,0]=4 5710 B14R1.8657 COC(C)C(O)c1c(C)ccnc1N Amb28247820 [0,2,0,0,0,0|2,0,0]=4 5711 B14R1.8657 COC(C)C(O)c1c(Cl)cccc1Br Amb27952092 [0,2,0,0,0,0|1,0,0]=3 5712 B14R1.8657 COC(C)C(O)c1c(F)cccc1Cl Amb28204406 [0,2,0,0,0,0|1,0,0]=3 5713 B14R1.8657 COC(C)C(O)c1c(F)cncc1F Amb35630015 [0,2,0,0,0,0|2,0,0]=4 5714 B14R1.8657 Cc1cccc(Br)c1C(O)C(C)CN Amb27864725 [0,2,0,0,0,0|2,0,0]=4 5715 B12R1.77 C=Cc1cccnc1C(C)NC Amb27169340 [0,0,1,1,0,0|1,0,1]=4 5716 B12R1.77 C=Cc1cccnc1[C@@H](C)NC Amb25894758 [0,0,1,1,0,0|1,0,1]=4 5717 B12R1.77 C=Cc1cccnc1[C@H](C)NC Amb24378219 [0,0,1,1,0,0|1,0,1]=4 5718 B12R1.435 C=Cc1cccc([C@@H](C)NC)n1 Amb26622213 [0,0,1,1,0,0|1,0,1]=4 5719 B12R1.435 C=Cc1cccc([C@H](C)NC)n1 Amb24683767 [0,0,1,1,0,0|1,0,1]=4 5720 B12R2.2 C1=C(c2ccccc2)CNC1 Amb22059494 [1,0,0,1,0,0|1,0,1]=4 5721 B12R2.2 C1=C(c2ccccc2)CNC1 Amb30584704 [1,0,0,1,0,0|1,0,1]=4 5722 B12R2.2 C1=N[C@@H](c2ccccc2)CN1 Amb27174575 [1,0,0,1,0,0|1,0,1]=4 5723 B12R2.2 c1cc(C2CCNC2)ccn1 Amb22233781 [1,0,0,1,0,0|2,0,0]=4 5724 B12R2.2 c1cc(C2CCNC2)ccn1 Amb33551300 [1,0,0,1,0,0|2,0,0]=4 5725 B12R2.2 c1cc(C2CCNC2)ccn1 Amb3940962 [1,0,0,1,0,0|2,0,0]=4 5726 B12R2.2 c1cc(C2CNCO2)ccn1 Amb18065319 [1,0,0,1,0,0|1,0,0]=3 5727 B12R2.2 c1ccc(C2CCCC2)cc1 Amb9787161 [1,0,0,1,0,0|2,0,0]=4 5728 B12R2.2 c1ccc(C2CCCN2)cc1 Amb10808365 [1,0,0,1,0,0|2,0,0]=4 5729 B12R2.2 c1ccc(C2CCCN2)cc1 Amb9702996 [1,0,0,1,0,0|2,0,0]=4 5730 B12R2.2 c1ccc(C2CCCO2)cc1 Amb17334283 [1,0,0,1,0,0|1,0,0]=3 5731 B12R2.2 c1ccc(C2CCC[NH2+]2)cc1 Amb33512932 [1,0,0,1,0,0|2,0,0]=4 5732 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10069263 [1,0,0,1,0,0|1,0,0]=3 5733 B12R2.2 c1ccc(C2CCNC2)cc1 Amb10072809 [1,0,0,1,0,0|1,0,0]=3 5734 B12R2.2 c1ccc(C2CCNC2)cc1 Amb701982 [1,0,0,1,0,0|1,0,0]=3 5735 B12R2.2 c1ccc(C2CCNC2)nc1 Amb10808435 [1,0,0,1,0,0|2,0,0]=4 5736 B12R2.2 c1ccc(C2CCNC2)nc1 Amb32719303 [1,0,0,1,0,0|2,0,0]=4 5737 B12R2.2 c1ccc(C2CCNC2)nc1 Amb3941368 [1,0,0,1,0,0|2,0,0]=4 5738 B12R2.2 c1ccc(C2CCSC2)cc1 Amb4140293 [1,0,0,1,0,0|2,0,0]=4 5739 B12R2.2 c1ccc(C2CC[NH2+]C2)cc1 Amb4258873 [1,0,0,1,0,0|1,0,1]=4 5740 B12R2.2 c1ccc(C2CNCO2)cc1 Amb18065307 [1,0,0,1,0,0|0,0,0]=2 5741 B12R2.2 c1ccc(C2CNCO2)nc1 Amb18065316 [1,0,0,1,0,0|1,0,0]=3 5742 B12R2.2 c1ccc(C2NCCO2)cc1 Amb17334284 [1,0,0,1,0,0|2,0,0]=4 5743 B12R2.2 c1ccc(C2OCCO2)cc1 Amb9786741 [1,0,0,1,0,0|2,0,0]=4 5744 B12R2.2 c1ccc(N2CCNC2)cc1 Amb27785561 [1,0,0,1,0,0|2,0,0]=4 5745 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb20241933 [1,0,0,1,0,0|2,0,0]=4 5746 B12R2.2 c1ccc([C@@H]2CCCN2)cc1 Amb8397178 [1,0,0,1,0,0|2,0,0]=4 5747 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb19888399 [1,0,0,1,0,0|1,0,0]=3 5748 B12R2.2 c1ccc([C@@H]2CCNC2)cc1 Amb27617269 [1,0,0,1,0,0|1,0,0]=3 5749 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb20241932 [1,0,0,1,0,0|2,0,0]=4 5750 B12R2.2 c1ccc([C@H]2CCCN2)cc1 Amb8397179 [1,0,0,1,0,0|2,0,0]=4 5751 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb19887561 [1,0,0,1,0,0|1,0,0]=3 5752 B12R2.2 c1ccc([C@H]2CCNC2)cc1 Amb24183516 [1,0,0,1,0,0|1,0,0]=3 5753 B12R2.2 c1ccc([C@H]2COCN2)cc1 Amb25877610 [1,0,0,1,0,0|2,0,0]=4 5754 B12R2.2 c1cncc(C2CCNC2)c1 Amb19958035 [1,0,0,1,0,0|2,0,0]=4 5755 B12R2.2 c1cncc(C2CCNC2)c1 Amb22490712 [1,0,0,1,0,0|2,0,0]=4 5756 B12R2.2 c1cncc(C2CCNC2)c1 Amb30647467 [1,0,0,1,0,0|2,0,0]=4 5757 B12R2.2 c1cncc(C2CCNC2)c1 Amb3938889 [1,0,0,1,0,0|2,0,0]=4 5758 B12R2.2 c1cncc(C2CNCO2)c1 Amb18065317 [1,0,0,1,0,0|1,0,0]=3 5759 B12R2.2 c1cncc(C2NNCO2)c1 Amb28249019 [1,0,0,1,0,0|2,0,0]=4 5760 B12R2.27 BrC[C@@H]1O[C@H]1c2ccccc2 Amb28249045 [1,0,0,1,0,0|2,0,0]=4 5761 B12R2.27 C#CC1OC1c2ccccc2 Amb28254723 [1,0,0,1,0,0|1,0,1]=4 5762 B12R2.27 CC[C@@H]1O[C@H]1c2ccccc2 Amb27768002 [1,0,0,1,0,0|1,0,0]=3 5763 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [1,0,0,1,0,0|1,0,0]=3 5764 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [1,0,0,1,0,0|1,0,0]=3 5765 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb28056101 [1,0,0,1,0,0|1,0,0]=3 5766 B12R2.27 CN[C@@H]1C[C@H]1c2ccccc2 Amb33309625 [1,0,0,1,0,0|1,0,0]=3 5767 B12R2.27 ClC[C@@H]1O[C@@H]1c2ccccc2 Amb28457544 [1,0,0,1,0,0|2,0,0]=4 5768 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [1,0,0,1,0,0|2,0,0]=4 5769 B12R2.27 NC[C@H]1O[C@@H]1c2ccccc2 Amb27188182 [1,0,0,1,0,0|2,0,0]=4 5770 B12R2.27 O=C[C@@H]1O[C@H]1c2ccccc2 Amb26550113 [1,0,0,1,0,0|2,0,0]=4 5771 B12R2.27 O=C[C@H]1O[C@@H]1c2ccccc2 Amb28195860 [1,0,0,1,0,0|2,0,0]=4 5772 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [1,0,0,1,0,0|2,0,0]=4 5773 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [1,0,0,1,0,0|2,0,0]=4 5774 B12R2.27 OC[C@H]1O[C@H]1c2ccccc2 Amb27432251 [1,0,0,1,0,0|2,0,0]=4 5775 B12R2.116 CC1(c2ccccc2)CNC1 Amb18065223 [1,0,0,1,0,0|1,0,0]=3 5776 B12R2.116 CC1(c2ccccc2)CNC1 Amb33551677 [1,0,0,1,0,0|1,0,0]=3 5777 B12R2.116 CC1(c2ccccc2)COC1 Amb22497353 [1,0,0,1,0,0|2,0,0]=4 5778 B12R2.116 ClC1(c2ccccc2)CNC1 Amb27444675 [1,0,0,1,0,0|1,0,0]=3 5779 B12R2.116 FC1(c2ccccc2)CNC1 Amb26450082 [1,0,0,1,0,0|1,0,0]=3 5780 B12R2.116 FC1(c2ccccc2)CNC1 Amb28872317 [1,0,0,1,0,0|1,0,0]=3 5781 B12R2.116 FC1(c2ccccc2)COC1 Amb22738854 [1,0,0,1,0,0|2,0,0]=4 5782 B12R2.116 FC1(c2cccnc2)CNC1 Amb25151802 [1,0,0,1,0,0|2,0,0]=4 5783 B12R2.116 NC1(c2ccccc2)CCC1 Amb2371533 [1,0,0,1,0,0|2,0,0]=4 5784 B12R2.116 NC1(c2ccccc2)CCC1 Amb453192 [1,0,0,1,0,0|2,0,0]=4 5785 B12R2.116 NC1(c2ccccc2)CNC1 Amb24120649 [1,0,0,1,0,0|1,0,0]=3 5786 B12R2.116 NC1(c2ccccc2)COC1 Amb22386882 [1,0,0,1,0,0|2,0,0]=4 5787 B12R2.116 NC1(c2ccccc2)COC1 Amb33534183 [1,0,0,1,0,0|2,0,0]=4 5788 B12R2.116 OC1(c2ccccc2)CCC1 Amb33544160 [1,0,0,1,0,0|1,0,0]=3 5789 B12R2.116 OC1(c2ccccc2)CNC1 Amb22406135 [1,0,0,1,0,0|0,0,0]=2 5790 B12R2.116 OC1(c2ccccc2)CNC1 Amb22496452 [1,0,0,1,0,0|0,0,0]=2 5791 B12R2.116 OC1(c2ccccc2)CNC1 Amb32758790 [1,0,0,1,0,0|0,0,0]=2 5792 B12R2.116 OC1(c2ccccc2)COC1 Amb21960821 [1,0,0,1,0,0|1,0,0]=3 5793 B12R2.116 OC1(c2ccccc2)CSC1 Amb22386890 [1,0,0,1,0,0|1,0,0]=3 5794 B12R2.116 OC1(c2ccccn2)CNC1 Amb24486814 [1,0,0,1,0,0|1,0,0]=3 5795 B12R2.116 OC1(c2ccccn2)CNC1 Amb33623661 [1,0,0,1,0,0|1,0,0]=3 5796 B12R2.116 OC1(c2cccnc2)CCC1 Amb25123095 [1,0,0,1,0,0|2,0,0]=4 5797 B12R2.116 OC1(c2cccnc2)CCC1 Amb32665519 [1,0,0,1,0,0|2,0,0]=4 5798 B12R2.116 OC1(c2cccnc2)CNC1 Amb27968637 [1,0,0,1,0,0|1,0,0]=3 5799 B12R2.116 OC1(c2cccnc2)CNC1 Amb35747823 [1,0,0,1,0,0|1,0,0]=3 5800 B12R2.116 OC1(c2cccnc2)COC1 Amb22737297 [1,0,0,1,0,0|2,0,0]=4 5801 B12R2.116 OC1(c2cccnc2)CSC1 Amb27784348 [1,0,0,1,0,0|2,0,0]=4 5802 B12R2.116 OC1(c2ccncc2)CNC1 Amb33380637 [1,0,0,1,0,0|1,0,0]=3 5803 B12R2.116 OC1(c2ccncn2)CNC1 Amb33267966 [1,0,0,1,0,0|2,0,0]=4 5804 B12R2.116 OC1(c2cnccn2)CNC1 Amb25791772 [1,0,0,1,0,0|2,0,0]=4 5805 B12R2.116 OC1(c2cncnc2)CNC1 Amb25756768 [1,0,0,1,0,0|2,0,0]=4 5806 B12R2.116 OC1(c2ncccn2)CNC1 Amb33269932 [1,0,0,1,0,0|2,0,0]=4 5807 B12R2.235 CC1CC1(O)c2ccccn2 Amb25149270 [1,0,0,1,0,0|2,0,0]=4 5808 B12R2.235 CC1CC1(O)c2ccncc2 Amb28064515 [1,0,0,1,0,0|2,0,0]=4 5809 B12R2.235 CC1OC1(O)c2ccccc2 Amb26510326 [1,0,0,1,0,0|2,0,0]=4 5810 B12R2.235 CN1NC1(C)c2ccccc2 Amb27184008 [1,0,0,1,0,0|2,0,0]=4 5811 B12R2.1081 BrC1CCCc2ccccc21 Amb8384413 [1,0,0,1,0,0|2,0,0]=4 5812 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [1,0,0,1,0,0|2,0,0]=4 5813 B12R2.1081 CC1CNCc2ccccc21 Amb17399906 [1,0,0,1,0,0|1,0,0]=3 5814 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [1,0,0,1,0,0|1,0,0]=3 5815 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [1,0,0,1,0,0|2,0,0]=4 5816 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb30594264 [1,0,0,1,0,0|1,0,0]=3 5817 B12R2.1081 ClC1CCCc2ccccc21 Amb9204490 [1,0,0,1,0,0|2,0,0]=4 5818 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [1,0,0,1,0,0|2,0,0]=4 5819 B12R2.1081 ClC1CSCc2ccccc21 Amb27454843 [1,0,0,1,0,0|2,0,0]=4 5820 B12R2.1081 FC1CNCc2ccccc21 Amb10841578 [1,0,0,1,0,0|1,0,0]=3 5821 B12R2.1081 IC1CCCc2ccccc21 Amb33714900 [1,0,0,1,0,0|2,0,0]=4 5822 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [1,0,0,1,0,0|2,0,0]=4 5823 B12R2.1081 NC1CCCc2ccccc21 Amb5716841 [1,0,0,1,0,0|2,0,0]=4 5824 B12R2.1081 NC1CCCc2ccccc21 Amb6334842 [1,0,0,1,0,0|2,0,0]=4 5825 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [1,0,0,1,0,0|1,0,0]=3 5826 B12R2.1081 NC1COCc2ccccc21 Amb10067658 [1,0,0,1,0,0|2,0,0]=4 5827 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [1,0,0,1,0,0|2,0,0]=4 5828 B12R2.1081 NC1CSCc2ccccc21 Amb10067686 [1,0,0,1,0,0|2,0,0]=4 5829 B12R2.1081 NC1CSCc2ccccc21 Amb9620859 [1,0,0,1,0,0|2,0,0]=4 5830 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb10844952 [1,0,0,1,0,0|2,0,0]=4 5831 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [1,0,0,1,0,0|2,0,0]=4 5832 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb8383429 [1,0,0,1,0,0|2,0,0]=4 5833 B12R2.1081 N[C@H]1COCc2ccccc21 Amb27839884 [1,0,0,1,0,0|2,0,0]=4 5834 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [1,0,0,1,0,0|0,0,2]=4 5835 B12R2.1081 O=C1CNCc2ccccc21 Amb9783330 [1,0,0,1,0,0|0,0,2]=4 5836 B12R2.1081 OC1CCCc2ccccc21 Amb9702810 [1,0,0,1,0,0|1,0,0]=3 5837 B12R2.1081 OC1CCCc2cccnc21 Amb17935812 [1,0,0,1,0,0|2,0,0]=4 5838 B12R2.1081 OC1CCCc2cccnc21 Amb8397302 [1,0,0,1,0,0|2,0,0]=4 5839 B12R2.1081 OC1CCCc2cnccc21 Amb23399822 [1,0,0,1,0,0|2,0,0]=4 5840 B12R2.1081 OC1CCNc2ccccc21 Amb10553386 [1,0,0,1,0,0|2,0,0]=4 5841 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [1,0,0,1,0,0|2,0,0]=4 5842 B12R2.1081 OC1CCOc2ccccc21 Amb2719725 [1,0,0,1,0,0|2,0,0]=4 5843 B12R2.1081 OC1CCSc2ccccc21 Amb9748233 [1,0,0,1,0,0|2,0,0]=4 5844 B12R2.1081 OC1CNCc2ccccc21 Amb16233378 [1,0,0,1,0,0|0,0,0]=2 5845 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [1,0,0,1,0,0|0,0,0]=2 5846 B12R2.1081 OC1CNCc2ncccc21 Amb18201914 [1,0,0,1,0,0|1,0,0]=3 5847 B12R2.1081 OC1CNCc2ncncc21 Amb18201680 [1,0,0,1,0,0|2,0,0]=4 5848 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [1,0,0,1,0,0|1,0,0]=3 5849 B12R2.1081 OC1CSCc2ccccc21 Amb9619601 [1,0,0,1,0,0|1,0,0]=3 5850 B12R2.1081 OC1OCCc2ccccc21 Amb27860258 [1,0,0,1,0,0|2,0,0]=4 5851 B12R2.1081 O[C@@H]1CC=Cc2ccccc21 Amb8384066 [1,0,0,1,0,0|1,0,1]=4 5852 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [1,0,0,1,0,0|1,0,0]=3 5853 B12R2.1081 O[C@@H]1CCCc2cccnc21 Amb24062853 [1,0,0,1,0,0|2,0,0]=4 5854 B12R2.1081 O[C@@H]1CCCc2cnccc21 Amb28065163 [1,0,0,1,0,0|2,0,0]=4 5855 B12R2.1081 O[C@@H]1CCCc2ncccc21 Amb26874431 [1,0,0,1,0,0|2,0,0]=4 5856 B12R2.1081 O[C@@H]1CCOc2ccccc21 Amb561634 [1,0,0,1,0,0|2,0,0]=4 5857 B12R2.1081 O[C@@H]1CCSc2ccccc21 Amb13952924 [1,0,0,1,0,0|2,0,0]=4 5858 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [1,0,0,1,0,0|1,0,0]=3 5859 B12R2.1081 O[C@@H]1CSCc2ccccc21 Amb27836959 [1,0,0,1,0,0|1,0,0]=3 5860 B12R2.1081 O[C@H]1C=CCc2ccccc21 Amb28249097 [1,0,0,1,0,0|1,0,1]=4 5861 B12R2.1081 O[C@H]1CC=Cc2ccccc21 Amb27804916 [1,0,0,1,0,0|1,0,1]=4 5862 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [1,0,0,1,0,0|1,0,0]=3 5863 B12R2.1081 O[C@H]1CCCc2cccnc21 Amb24083650 [1,0,0,1,0,0|2,0,0]=4 5864 B12R2.1081 O[C@H]1CCCc2cnccc21 Amb32698572 [1,0,0,1,0,0|2,0,0]=4 5865 B12R2.1081 O[C@H]1CCOc2ccccc21 Amb2609035 [1,0,0,1,0,0|2,0,0]=4 5866 B12R2.1081 O[C@H]1CCSc2ccccc21 Amb13952926 [1,0,0,1,0,0|2,0,0]=4 5867 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [1,0,0,1,0,0|0,0,0]=2 5868 B12R2.1081 SC1CCCc2ccccc21 Amb9208036 [1,0,0,1,0,0|1,1,0]=4 5869 B12R2.1081 SC1COCc2ccccc21 Amb28349489 [1,0,0,1,0,0|1,1,0]=4 5870 B12R2.1081 SC1CSCc2ccccc21 Amb32788444 [1,0,0,1,0,0|1,1,0]=4 5871 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [1,0,0,1,0,0|2,0,0]=4 5872 B12R2.2028 CC1=CC(O)c2ccccc21 Amb17778893 [1,0,0,1,0,0|1,0,1]=4 5873 B12R2.2028 CC1CC(Cl)c2ccccc21 Amb27413208 [1,0,0,1,0,0|2,0,0]=4 5874 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [1,0,0,1,0,0|2,0,0]=4 5875 B12R2.2028 CC1CC(N)c2ccccc21 Amb6705561 [1,0,0,1,0,0|2,0,0]=4 5876 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [1,0,0,1,0,0|1,1,0]=4 5877 B12R2.2028 CC1CN(C)c2ccccc21 Amb5718018 [1,0,0,1,0,0|1,0,0]=3 5878 B12R2.2028 CC1NN(C)c2ccccc21 Amb27222813 [1,0,0,1,0,0|2,0,0]=4 5879 B12R2.2028 CN1CC(N)c2ccccc21 Amb26601033 [1,0,0,1,0,0|1,0,0]=3 5880 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccccc21 Amb27623223 [1,0,0,1,0,0|1,0,0]=3 5881 B12R2.2028 C[C@@H]1C[C@@H](O)c2ccncc21 Amb25102087 [1,0,0,1,0,0|2,0,0]=4 5882 B12R2.2028 C[C@@H]1OC(O)c2ccccc21 Amb26648832 [1,0,0,1,0,0|2,0,0]=4 5883 B12R2.2028 C[C@H]1O[C@@H](O)c2ccccc21 Amb28142292 [1,0,0,1,0,0|2,0,0]=4 5884 B12R2.2028 Cn1cc(O)c2ccccc21 Amb24069283 [1,0,0,1,0,0|0,0,2]=4 5885 B12R2.2028 NC1CC(O)c2ccccc21 Amb17470387 [1,0,0,1,0,0|2,0,0]=4 5886 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [1,0,0,1,0,0|2,0,0]=4 5887 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [1,0,0,1,0,0|2,0,0]=4 5888 B12R2.2028 N[C@H]1C[C@@H](O)c2ccccc21 Amb27810799 [1,0,0,1,0,0|2,0,0]=4 5889 B12R2.2028 O=C1CC(O)c2ccccc21 Amb27872121 [1,0,0,1,0,0|2,0,0]=4 5890 B12R2.2028 OC1CC(O)c2ccccc21 Amb1110942 [1,0,0,1,0,0|2,0,0]=4 5891 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc21 Amb17938072 [1,0,0,1,0,0|2,0,0]=4 5892 B12R2.2028 O[C@H]1C[C@H](O)c2ccccc21 Amb10068281 [1,0,0,1,0,0|2,0,0]=4 5893 B12R2.2075 Br[C@@H](c1ccccc1)[C@@H]2CO2 Amb27204462 [1,0,0,1,0,0|2,0,0]=4 5894 B12R2.2075 CC(c1ccccc1)C2CO2 Amb33540219 [1,0,0,1,0,0|2,0,0]=4 5895 B12R2.2075 CC(c1ccccc1)[C@@H]2CO2 Amb33082137 [1,0,0,1,0,0|2,0,0]=4 5896 B12R2.2075 CC(c1ccccc1)[C@H]2CO2 Amb33082136 [1,0,0,1,0,0|2,0,0]=4 5897 B12R2.2075 Cl[C@@H](c1ccccc1)[C@@H]2CO2 Amb27865491 [1,0,0,1,0,0|2,0,0]=4 5898 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [1,0,0,1,0,0|2,0,0]=4 5899 B12R2.2075 NC(c1ccccc1)C2CC2 Amb482312 [1,0,0,1,0,0|2,0,0]=4 5900 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb22406366 [1,0,0,1,0,0|2,0,0]=4 5901 B12R2.2075 N[C@@H](c1ccccc1)C2CC2 Amb26960416 [1,0,0,1,0,0|2,0,0]=4 5902 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22406367 [1,0,0,1,0,0|2,0,0]=4 5903 B12R2.2075 N[C@H](c1ccccc1)C2CC2 Amb22744981 [1,0,0,1,0,0|2,0,0]=4 5904 B12R2.2075 OC(c1ccccc1)C2CC2 Amb33534747 [1,0,0,1,0,0|1,0,0]=3 5905 B12R2.2075 OC(c1ccccc1)C2CO2 Amb27210172 [1,0,0,1,0,0|1,0,0]=3 5906 B12R2.2075 OC(c1ccccn1)C2CC2 Amb27982276 [1,0,0,1,0,0|2,0,0]=4 5907 B12R2.2075 OC(c1ccccn1)C2CC2 Amb32666125 [1,0,0,1,0,0|2,0,0]=4 5908 B12R2.2075 OC(c1cccnc1)C2CC2 Amb22497231 [1,0,0,1,0,0|2,0,0]=4 5909 B12R2.2075 O[C@@H](c1ccccc1)C2CO2 Amb27839920 [1,0,0,1,0,0|1,0,0]=3 5910 B12R2.2075 O[C@@H](c1ccccn1)C2CC2 Amb32882520 [1,0,0,1,0,0|2,0,0]=4 5911 B12R2.2075 O[C@H](c1ccccc1)C2CC2 Amb27955379 [1,0,0,1,0,0|1,0,0]=3 5912 B12R2.2075 O[C@H](c1ccccc1)C2CO2 Amb27593359 [1,0,0,1,0,0|1,0,0]=3 5913 B12R2.2075 O[C@H](c1ccccc1)[C@@H]2CO2 Amb27448761 [1,0,0,1,0,0|1,0,0]=3 5914 B12R2.2075 O[C@H](c1ccccn1)C2CC2 Amb32882519 [1,0,0,1,0,0|2,0,0]=4 5915 B12R2.2075 SC(c1ccccc1)C2CC2 Amb33537940 [1,0,0,1,0,0|1,1,0]=4 5916 B12R2.18 BN1c2ccccc2CC1C Amb27445828 [1,0,0,1,0,0|2,0,0]=4 5917 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [1,0,0,1,0,0|0,0,2]=4 5918 B12R2.18 CC1=Cc2ccccc2[C@H]1O Amb28319957 [1,0,0,1,0,0|0,0,2]=4 5919 B12R2.18 CC1Cc2ccccc2C1=O Amb2724364 [1,0,0,1,0,0|0,0,2]=4 5920 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [1,0,0,1,0,0|1,0,0]=3 5921 B12R2.18 CC1Cc2ccccc2C1N Amb17232033 [1,0,0,1,0,0|1,0,0]=3 5922 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [1,0,0,1,0,0|1,0,0]=3 5923 B12R2.18 CC1Cc2ccccc2C1O Amb27228534 [1,0,0,1,0,0|0,0,0]=2 5924 B12R2.18 CC1Cc2ccccc2N1C Amb5718020 [1,0,0,1,0,0|2,0,0]=4 5925 B12R2.18 CC1Cc2ccccc2N1N Amb6298689 [1,0,0,1,0,0|2,0,0]=4 5926 B12R2.18 CC1Cc2ccccc2N1N Amb8629624 [1,0,0,1,0,0|2,0,0]=4 5927 B12R2.18 CC1Nc2ccccc2C1=O Amb17593674 [1,0,0,1,0,0|0,0,2]=4 5928 B12R2.18 CC1Nc2ccccc2C1C Amb17593676 [1,0,0,1,0,0|1,0,0]=3 5929 B12R2.18 CC1Nc2ccccc2C1O Amb28076897 [1,0,0,1,0,0|0,0,0]=2 5930 B12R2.18 CC1Nc2ccccc2[C@H]1C Amb28341472 [1,0,0,1,0,0|1,0,0]=3 5931 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [1,0,0,1,0,0|2,0,0]=4 5932 B12R2.18 CC1Oc2ccccc2C1N Amb28974067 [1,0,0,1,0,0|2,0,0]=4 5933 B12R2.18 CC1Oc2cccnc2C1O Amb28141839 [1,0,0,1,0,0|2,0,0]=4 5934 B12R2.18 CC1Oc2cnccc2C1O Amb27764814 [1,0,0,1,0,0|2,0,0]=4 5935 B12R2.18 CC1Oc2ncccc2C1O Amb22372218 [1,0,0,1,0,0|2,0,0]=4 5936 B12R2.18 CC1c2ccccc2CC1Br Amb29887209 [1,0,0,1,0,0|2,0,0]=4 5937 B12R2.18 CC1c2ccccc2CC1Cl Amb29887229 [1,0,0,1,0,0|2,0,0]=4 5938 B12R2.18 CC1c2ccccc2CC1N Amb18124847 [1,0,0,1,0,0|1,0,0]=3 5939 B12R2.18 CC1c2ccccc2CC1N Amb32666792 [1,0,0,1,0,0|1,0,0]=3 5940 B12R2.18 CC1c2ccccc2CC1O Amb20622729 [1,0,0,1,0,0|2,0,0]=4 5941 B12R2.18 CC1c2ccccc2CC1S Amb30007058 [1,0,0,1,0,0|2,0,0]=4 5942 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1O Amb27663152 [1,0,0,1,0,0|0,0,0]=2 5943 B12R2.18 C[C@@H]1Cc2ccccc2[C@H]1N Amb27440506 [1,0,0,1,0,0|1,0,0]=3 5944 B12R2.18 C[C@@H]1Nc2ccccc2[C@H]1C Amb27205062 [1,0,0,1,0,0|1,0,0]=3 5945 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1N Amb28325929 [1,0,0,1,0,0|2,0,0]=4 5946 B12R2.18 C[C@@H]1Oc2cccnc2[C@@H]1O Amb28401114 [1,0,0,1,0,0|2,0,0]=4 5947 B12R2.18 C[C@@H]1c2ccccc2C[C@H]1N Amb27817400 [1,0,0,1,0,0|1,0,0]=3 5948 B12R2.18 C[C@H]1Cc2ccccc2[C@@H]1N Amb27850448 [1,0,0,1,0,0|1,0,0]=3 5949 B12R2.18 C[C@H]1Oc2cccnc2[C@@H]1O Amb28064079 [1,0,0,1,0,0|2,0,0]=4 5950 B12R2.18 C[C@H]1Oc2cnccc2[C@@H]1O Amb27430760 [1,0,0,1,0,0|2,0,0]=4 5951 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb28723654 [1,0,0,1,0,0|1,0,0]=3 5952 B12R2.18 C[C@H]1c2ccccc2C[C@H]1N Amb32666899 [1,0,0,1,0,0|1,0,0]=3 5953 B12R2.18 F[C@H]1c2ccccc2C[C@@H]1Br Amb27268524 [1,0,0,1,0,0|2,0,0]=4 5954 B12R2.18 F[C@H]1c2ccccc2C[C@H]1Br Amb28130458 [1,0,0,1,0,0|2,0,0]=4 5955 B12R2.18 NC1Cc2ccccc2C1=O Amb17470380 [1,0,0,1,0,0|0,0,2]=4 5956 B12R2.18 NC1Cc2ccccc2C1=O Amb33548490 [1,0,0,1,0,0|0,0,2]=4 5957 B12R2.18 NC1Cc2ccccc2C1N Amb13953204 [1,0,0,1,0,0|1,0,0]=3 5958 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [1,0,0,1,0,0|0,0,0]=2 5959 B12R2.18 NC1Cc2ccccc2C1O Amb2383051 [1,0,0,1,0,0|0,0,0]=2 5960 B12R2.18 NC1c2ccccc2CC1Cl Amb4021194 [1,0,0,1,0,0|2,0,0]=4 5961 B12R2.18 NC1c2ccccc2CC1F Amb24459876 [1,0,0,1,0,0|2,0,0]=4 5962 B12R2.18 NC1c2ccccc2CC1F Amb32664161 [1,0,0,1,0,0|2,0,0]=4 5963 B12R2.18 NC1c2ccccc2CC1O Amb9781652 [1,0,0,1,0,0|2,0,0]=4 5964 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [1,0,0,1,0,0|0,0,0]=2 5965 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1F Amb27493415 [1,0,0,1,0,0|1,0,0]=3 5966 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb25911961 [1,0,0,1,0,0|1,0,0]=3 5967 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [1,0,0,1,0,0|0,0,0]=2 5968 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [1,0,0,1,0,0|0,0,0]=2 5969 B12R2.18 N[C@@H]1c2ccccc2C[C@@H]1O Amb2720522 [1,0,0,1,0,0|2,0,0]=4 5970 B12R2.18 N[C@@H]1c2ccccc2C[C@H]1O Amb10842210 [1,0,0,1,0,0|2,0,0]=4 5971 B12R2.18 N[C@@H]1c2ccccc2C[C@H]1O Amb32665023 [1,0,0,1,0,0|2,0,0]=4 5972 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1N Amb27881687 [1,0,0,1,0,0|1,0,0]=3 5973 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [1,0,0,1,0,0|0,0,0]=2 5974 B12R2.18 N[C@H]1c2ccccc2C[C@@H]1O Amb10842191 [1,0,0,1,0,0|2,0,0]=4 5975 B12R2.18 N[C@H]1c2ccccc2C[C@@H]1O Amb32665024 [1,0,0,1,0,0|2,0,0]=4 5976 B12R2.18 N[C@H]1c2ccccc2C[C@H]1F Amb32664629 [1,0,0,1,0,0|2,0,0]=4 5977 B12R2.18 N[C@H]1c2ccccc2C[C@H]1F Amb32664630 [1,0,0,1,0,0|2,0,0]=4 5978 B12R2.18 N[C@H]1c2ccccc2C[C@H]1N Amb22745804 [1,0,0,1,0,0|1,0,0]=3 5979 B12R2.18 N[C@H]1c2ccccc2C[C@H]1O Amb17779311 [1,0,0,1,0,0|2,0,0]=4 5980 B12R2.18 N[C@H]1c2ccccc2N[C@H]1O Amb27198050 [1,0,0,1,0,0|2,0,0]=4 5981 B12R2.18 O=C1Nc2ccccc2C1O Amb9748239 [1,0,0,1,0,0|1,0,1]=4 5982 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [1,0,0,1,0,0|1,0,0]=3 5983 B12R2.18 OC1Cc2ccncc2C1O Amb27425157 [1,0,0,1,0,0|2,0,0]=4 5984 B12R2.18 OC1Oc2ccccc2C1O Amb27945780 [1,0,0,1,0,0|2,0,0]=4 5985 B12R2.18 OC1Sc2ccccc2C1O Amb27853727 [1,0,0,1,0,0|2,0,0]=4 5986 B12R2.18 OC1c2ccccc2CC1Br Amb1159074 [1,0,0,1,0,0|1,0,0]=3 5987 B12R2.18 OC1c2ccccc2CC1F Amb24423988 [1,0,0,1,0,0|1,0,0]=3 5988 B12R2.18 OC1c2ccccc2CC1S Amb27397064 [1,0,0,1,0,0|1,0,0]=3 5989 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1F Amb27428306 [1,0,0,1,0,0|2,0,0]=4 5990 B12R2.18 O[C@@H]1Cc2ccccc2[C@H]1O Amb10982589 [1,0,0,1,0,0|1,0,0]=3 5991 B12R2.18 O[C@@H]1Sc2ccccc2[C@H]1O Amb28344973 [1,0,0,1,0,0|2,0,0]=4 5992 B12R2.18 O[C@@H]1c2ccccc2CC1Br Amb27176336 [1,0,0,1,0,0|1,0,0]=3 5993 B12R2.18 O[C@@H]1c2ccccc2C[C@@H]1Cl Amb8394042 [1,0,0,1,0,0|1,0,0]=3 5994 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Br Amb28053369 [1,0,0,1,0,0|1,0,0]=3 5995 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1Cl Amb24519428 [1,0,0,1,0,0|1,0,0]=3 5996 B12R2.18 O[C@@H]1c2ccccc2C[C@H]1F Amb27228144 [1,0,0,1,0,0|1,0,0]=3 5997 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Cl Amb28052052 [1,0,0,1,0,0|2,0,0]=4 5998 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1O Amb27427979 [1,0,0,1,0,0|1,0,0]=3 5999 B12R2.18 O[C@H]1Oc2ccccc2[C@H]1O Amb27782441 [1,0,0,1,0,0|2,0,0]=4 6000 B12R2.18 O[C@H]1c2ccccc2CC1Br Amb25061997 [1,0,0,1,0,0|1,0,0]=3 6001 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Br Amb8629277 [1,0,0,1,0,0|1,0,0]=3 6002 B12R2.18 O[C@H]1c2ccccc2C[C@@H]1Cl Amb26565760 [1,0,0,1,0,0|1,0,0]=3 6003 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Br Amb27446678 [1,0,0,1,0,0|1,0,0]=3 6004 B12R2.18 O[C@H]1c2ccccc2C[C@H]1Cl Amb2609427 [1,0,0,1,0,0|1,0,0]=3 6005 B12R2.18 O[C@H]1c2ccccc2C[C@H]1F Amb25176954 [1,0,0,1,0,0|1,0,0]=3 6006 B12R2.18 [NH3+]C1c2ccccc2CC1O Amb33512943 [1,0,0,1,0,0|2,0,0]=4 6007 B12R2.23 CC1CCN1c2ccccc2 Amb28312828 [1,0,0,1,0,0|2,0,0]=4 6008 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [1,0,0,1,0,0|1,0,0]=3 6009 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [1,0,0,1,0,0|1,0,0]=3 6010 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [1,0,0,1,0,0|1,0,0]=3 6011 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [1,0,0,1,0,0|1,0,0]=3 6012 B12R2.23 NC1CCC1c2ccccn2 Amb27430527 [1,0,0,1,0,0|2,0,0]=4 6013 B12R2.23 NC1CCC1c2ccncc2 Amb28055952 [1,0,0,1,0,0|2,0,0]=4 6014 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb28594309 [1,0,0,1,0,0|1,0,0]=3 6015 B12R2.23 N[C@@H]1CC[C@@H]1c2ccccc2 Amb32665507 [1,0,0,1,0,0|1,0,0]=3 6016 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [1,0,0,1,0,0|1,0,0]=3 6017 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb33447016 [1,0,0,1,0,0|1,0,0]=3 6018 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685232 [1,0,0,1,0,0|0,0,0]=2 6019 B12R2.23 N[C@@H]1CO[C@H]1c2ccccc2 Amb32685233 [1,0,0,1,0,0|0,0,0]=2 6020 B12R2.23 N[C@H]1CC[C@H]1c2ccccc2 Amb27789894 [1,0,0,1,0,0|1,0,0]=3 6021 B12R2.23 N[C@H]1CS[C@@H]1c2ccccc2 Amb28245857 [1,0,0,1,0,0|0,1,0]=3 6022 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [1,0,0,1,0,0|1,0,1]=4 6023 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [1,0,0,1,0,0|2,0,0]=4 6024 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [1,0,0,1,0,0|2,0,0]=4 6025 B12R2.23 OC1COC1c2ccccc2 Amb26336587 [1,0,0,1,0,0|1,0,0]=3 6026 B12R2.23 OC1CSC1c2ccccc2 Amb27396136 [1,0,0,1,0,0|1,1,0]=4 6027 B12R2.23 O[C@@H]1CO[C@@H]1c2ccccc2 Amb32679855 [1,0,0,1,0,0|1,0,0]=3 6028 B12R2.23 O[C@@H]1CO[C@H]1c2ccccc2 Amb32679869 [1,0,0,1,0,0|1,0,0]=3 6029 B12R2.23 O[C@H]1CC[C@H]1c2ccccc2 Amb27816201 [1,0,0,1,0,0|2,0,0]=4 6030 B12R2.23 O[C@H]1CO[C@H]1c2ccccc2 Amb28345399 [1,0,0,1,0,0|1,0,0]=3 6031 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [1,0,0,1,0,0|1,0,0]=3 6032 B12R2.92 CC1(C)NC1c2ccccc2 Amb24056776 [1,0,0,1,0,0|1,0,0]=3 6033 B12R2.92 CC1(C)OC1c2ccccc2 Amb21964286 [1,0,0,1,0,0|0,0,0]=2 6034 B12R2.92 CC1(N)CC1c2ccccc2 Amb26359436 [1,0,0,1,0,0|1,0,0]=3 6035 B12R2.92 CC1(N)CC1c2ccccc2 Amb32661502 [1,0,0,1,0,0|1,0,0]=3 6036 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [1,0,0,1,0,0|1,0,0]=3 6037 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [1,0,0,1,0,0|1,0,0]=3 6038 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb28641944 [1,0,0,1,0,0|1,0,0]=3 6039 B12R2.92 C[C@@]1(O)C[C@H]1c2ccccc2 Amb33743331 [1,0,0,1,0,0|2,0,0]=4 6040 B12R2.138 CC1(C)C(=O)c2ccccc21 Amb27663117 [1,0,0,1,0,0|0,0,2]=4 6041 B12R2.3190 CC(N)C1Cc2ccccc21 Amb33527560 [1,0,0,1,0,0|1,0,0]=3 6042 B12R2.11 BrC1CC1Cc2ccccc2 Amb27176533 [1,0,0,1,0,0|2,0,0]=4 6043 B12R2.11 Br[C@H]1C[C@@H]1Cc2ccccc2 Amb28287700 [1,0,0,1,0,0|2,0,0]=4 6044 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [1,0,0,1,0,0|2,0,0]=4 6045 B12R2.11 C[C@@H]1C[C@@H]1Nc2ccccc2 Amb28059383 [1,0,0,1,0,0|2,0,0]=4 6046 B12R2.11 Cl[C@@H]1C[C@@H]1Cc2ccccc2 Amb27640652 [1,0,0,1,0,0|2,0,0]=4 6047 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [1,0,0,1,0,0|2,0,0]=4 6048 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [1,0,0,1,0,0|2,0,0]=4 6049 B12R2.11 N[C@@H]1C[C@H]1Cc2ccccc2 Amb32953150 [1,0,0,1,0,0|2,0,0]=4 6050 B12R2.24 BrC1CCc2ccccc2C1 Amb13952699 [1,0,0,1,0,0|2,0,0]=4 6051 B12R2.24 BrC1Cc2ccccc2CO1 Amb28048803 [1,0,0,1,0,0|2,0,0]=4 6052 B12R2.24 CC1=Cc2ccccc2CN1 Amb28322961 [1,0,0,1,0,0|0,0,2]=4 6053 B12R2.24 CC1=Nc2ccccc2CN1 Amb6892861 [1,0,0,1,0,0|1,0,1]=4 6054 B12R2.24 CC1CCc2ccccc2C1 Amb27232124 [1,0,0,1,0,0|1,0,0]=3 6055 B12R2.24 CC1CCc2ccccc2N1 Amb2792500 [1,0,0,1,0,0|2,0,0]=4 6056 B12R2.24 CC1CCc2ccccc2N1 Amb6773975 [1,0,0,1,0,0|2,0,0]=4 6057 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [1,0,0,1,0,0|2,0,0]=4 6058 B12R2.24 CC1CCc2cccnc2C1 Amb25187438 [1,0,0,1,0,0|2,0,0]=4 6059 B12R2.24 CC1CCc2ncccc2C1 Amb27474500 [1,0,0,1,0,0|2,0,0]=4 6060 B12R2.24 CC1CNc2ccccc2C1 Amb5745971 [1,0,0,1,0,0|2,0,0]=4 6061 B12R2.24 CC1Cc2ccccc2C=N1 Amb27481551 [1,0,0,1,0,0|0,0,2]=4 6062 B12R2.24 CC1Cc2ccccc2CN1 Amb4125575 [1,0,0,1,0,0|0,0,0]=2 6063 B12R2.24 CC1Cc2ccccc2CO1 Amb27490040 [1,0,0,1,0,0|1,0,0]=3 6064 B12R2.24 CC1Cc2ccncc2CN1 Amb24685008 [1,0,0,1,0,0|1,0,0]=3 6065 B12R2.24 CC1Cc2ncncc2CN1 Amb18202057 [1,0,0,1,0,0|2,0,0]=4 6066 B12R2.24 CN1CCc2ccccc2C1 Amb22001820 [1,0,0,1,0,0|2,0,0]=4 6067 B12R2.24 CN1CCc2ccccc2C1 Amb2581727 [1,0,0,1,0,0|2,0,0]=4 6068 B12R2.24 CN1Cc2ccccc2CN1 Amb9677363 [1,0,0,1,0,0|1,0,0]=3 6069 B12R2.24 CN1Cc2ccccc2CO1 Amb27850763 [1,0,0,1,0,0|2,0,0]=4 6070 B12R2.24 C[C@@H]1CNc2ccccc2C1 Amb27975495 [1,0,0,1,0,0|2,0,0]=4 6071 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb8388240 [1,0,0,1,0,0|0,0,2]=4 6072 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [1,0,0,1,0,0|2,0,0]=4 6073 B12R2.24 IC1CCc2ccccc2C1 Amb33714903 [1,0,0,1,0,0|2,0,0]=4 6074 B12R2.24 NC1CCc2ccccc2C1 Amb13952050 [1,0,0,1,0,0|2,0,0]=4 6075 B12R2.24 NC1CCc2ccccc2C1 Amb2383251 [1,0,0,1,0,0|2,0,0]=4 6076 B12R2.24 N[C@@H]1CCc2ccccc2C1 Amb25113422 [1,0,0,1,0,0|2,0,0]=4 6077 B12R2.24 N[C@H]1CCc2ccccc2C1 Amb8383954 [1,0,0,1,0,0|2,0,0]=4 6078 B12R2.24 O=C1Cc2ccccc2CN1 Amb33544470 [1,0,0,1,0,0|1,0,1]=4 6079 B12R2.24 OC1CCc2ccccc2C1 Amb2721268 [1,0,0,1,0,0|2,0,0]=4 6080 B12R2.24 OC1Cc2ccccc2CO1 Amb17593730 [1,0,0,1,0,0|2,0,0]=4 6081 B12R2.24 O[C@@H]1CCc2ccccc2C1 Amb25043599 [1,0,0,1,0,0|2,0,0]=4 6082 B12R2.24 O[C@H]1CCc2ccccc2C1 Amb25149682 [1,0,0,1,0,0|2,0,0]=4 6083 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [1,0,0,1,0,0|2,0,0]=4 6084 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [1,0,0,1,0,0|2,0,0]=4 6085 B12R2.32 C#CC1Cc2ccccc2C1 Amb24074759 [1,0,0,1,0,0|1,0,1]=4 6086 B12R2.32 C=CC1Cc2ccccc2C1 Amb33342617 [1,0,0,1,0,0|1,0,1]=4 6087 B12R2.32 CCC1Cc2ccccc2N1 Amb27238349 [1,0,0,1,0,0|2,0,0]=4 6088 B12R2.32 CNC1Cc2ccccc2C1 Amb21955693 [1,0,0,1,0,0|0,0,0]=2 6089 B12R2.32 CNC1Cc2ccccc2C1 Amb9173647 [1,0,0,1,0,0|0,0,0]=2 6090 B12R2.32 CNN1Cc2ccccc2C1 Amb26035337 [1,0,0,1,0,0|1,0,0]=3 6091 B12R2.32 CON1Cc2ccccc2C1 Amb27965846 [1,0,0,1,0,0|2,0,0]=4 6092 B12R2.32 ClCC1Cc2ccccc2C1 Amb27395181 [1,0,0,1,0,0|2,0,0]=4 6093 B12R2.32 ICC1Cc2ccccc2C1 Amb27460286 [1,0,0,1,0,0|2,0,0]=4 6094 B12R2.32 N#CC1Cc2ccccc2C1 Amb9675769 [1,0,0,1,0,0|2,0,0]=4 6095 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [1,0,0,1,0,0|2,0,0]=4 6096 B12R2.32 NCC1Cc2ccccc2C1 Amb9675770 [1,0,0,1,0,0|2,0,0]=4 6097 B12R2.32 NNC1Cc2ccccc2C1 Amb10071076 [1,0,0,1,0,0|1,0,0]=3 6098 B12R2.32 NNC1Cc2ccccc2C1 Amb19890159 [1,0,0,1,0,0|1,0,0]=3 6099 B12R2.32 NNC1Cc2ccccc2C1 Amb9675735 [1,0,0,1,0,0|1,0,0]=3 6100 B12R2.32 NNC1Cc2ccccc2N1 Amb27641029 [1,0,0,1,0,0|2,0,0]=4 6101 B12R2.32 O=CC1Cc2ccccc2C1 Amb33547407 [1,0,0,1,0,0|2,0,0]=4 6102 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [1,0,0,1,0,0|2,0,0]=4 6103 B12R2.32 ONC1Cc2ccccc2C1 Amb27648605 [1,0,0,1,0,0|1,0,0]=3 6104 B12R2.32 SCC1Cc2ccccc2C1 Amb33342304 [1,0,0,1,0,0|2,0,0]=4 6105 B12R2.32 [C-]#[N+]C1Cc2ccccc2C1 Amb33342897 [1,0,0,1,0,0|0,0,2]=4 6106 B12R2.37 CC1=C(c2ccccc2)N1C Amb27602376 [1,0,0,1,0,0|0,0,2]=4 6107 B12R2.37 CC1C(=O)C1c2ccccc2 Amb28324419 [1,0,0,1,0,0|2,0,0]=4 6108 B12R2.37 CC1C(N)C1c2ccccc2 Amb26503439 [1,0,0,1,0,0|2,0,0]=4 6109 B12R2.37 CC1C(N)C1c2ccccc2 Amb35751900 [1,0,0,1,0,0|2,0,0]=4 6110 B12R2.37 CC1C(c2ccccc2)N1C Amb29838148 [1,0,0,1,0,0|0,0,0]=2 6111 B12R2.94 CC1(Cc2ccccc2)CO1 Amb26023524 [1,0,0,1,0,0|1,0,0]=3 6112 B12R2.94 CC1(Cc2ccccn2)CO1 Amb27749783 [1,0,0,1,0,0|2,0,0]=4 6113 B12R2.94 CC1(Nc2ccccc2)CC1 Amb27176430 [1,0,0,1,0,0|2,0,0]=4 6114 B12R2.94 FC1(Cc2ccccc2)CC1 Amb28326343 [1,0,0,1,0,0|2,0,0]=4 6115 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [1,0,0,1,0,0|2,0,0]=4 6116 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2607807 [1,0,0,1,0,0|2,0,0]=4 6117 B12R2.94 NC1(Cc2ccccc2)CC1 Amb2721362 [1,0,0,1,0,0|2,0,0]=4 6118 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [1,0,0,1,0,0|2,0,0]=4 6119 B12R2.2051 C=CC1(C)Cc2ccccc21 Amb17778871 [1,0,0,1,0,0|1,0,1]=4 6120 B12R2.2058 B1CC(Cc2ccccc2)C1 Amb25243383 [1,0,0,1,0,0|2,0,0]=4 6121 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb33552346 [1,0,0,1,0,0|0,0,0]=2 6122 B12R2.2058 c1ccc(CC2CCN2)cc1 Amb7808794 [1,0,0,1,0,0|0,0,0]=2 6123 B12R2.2058 c1ccc(CC2CNC2)cc1 Amb1123190 [1,0,0,1,0,0|2,0,0]=4 6124 B12R2.2058 c1ccc(CC2CNC2)cc1 Amb19373673 [1,0,0,1,0,0|2,0,0]=4 6125 B12R2.2058 c1ccc(CC2COC2)cc1 Amb27602505 [1,0,0,1,0,0|2,0,0]=4 6126 B12R2.2058 c1ccc(CN2CCC2)cc1 Amb27391196 [1,0,0,1,0,0|2,0,0]=4 6127 B12R2.2058 c1ccc(NC2CCC2)cc1 Amb18283820 [1,0,0,1,0,0|2,0,0]=4 6128 B12R2.2058 c1ccc(SC2CCC2)cc1 Amb10976023 [1,0,0,1,0,0|2,0,0]=4 6129 B12R2.102 CC1CC1C(O)c2cccs2 Amb18180165 [0,0,0,1,1,0|2,0,0]=4 6130 B12R2.302 CCC1CC1(O)c2ccco2 Amb28071730 [0,0,0,1,1,0|2,0,0]=4 6131 B12R2.302 CCC1CC1(O)c2ccsc2 Amb28365497 [0,0,0,1,1,0|2,0,0]=4 6132 B12R2.3797 OC(c1cccs1)C2CCC2 Amb17194475 [0,0,0,1,1,0|2,0,0]=4 6133 B12R2.4379 CC1(C(O)c2ccco2)CC1 Amb27801259 [0,0,0,1,1,0|2,0,0]=4 6134 B12R2.4379 CC1(C(O)c2ccoc2)CC1 Amb27627745 [0,0,0,1,1,0|2,0,0]=4 6135 B14R2.8 CCC1CNC(c2ccccc2)O1 Amb27803845 [0,0,0,1,0,1|2,0,0]=4 6136 B14R2.8 CCC1CSC(c2ccccc2)N1 Amb27180772 [0,0,0,1,0,1|1,1,0]=4 6137 B14R2.8 CC[C@H]1COC(c2ccccc2)N1 Amb27415519 [0,0,0,1,0,1|1,0,0]=3 6138 B14R2.8 CNC1CC(c2ccccc2)CN1 Amb27407842 [0,0,0,1,0,1|2,0,0]=4 6139 B14R2.8 CNC1CCC(c2ccccc2)C1 Amb18065568 [0,0,0,1,0,1|1,0,0]=3 6140 B14R2.8 CNC1COC(c2ccccc2)C1 Amb35734275 [0,0,0,1,0,1|0,0,0]=2 6141 B14R2.8 CNC1COC(c2ccccn2)C1 Amb35726770 [0,0,0,1,0,1|1,0,0]=3 6142 B14R2.8 CNC1COC(c2cccnc2)C1 Amb35734274 [0,0,0,1,0,1|1,0,0]=3 6143 B14R2.8 CNC1COC(c2ccncc2)C1 Amb35614747 [0,0,0,1,0,1|1,0,0]=3 6144 B14R2.8 CNC1COC(c2ccncn2)C1 Amb29858610 [0,0,0,1,0,1|2,0,0]=4 6145 B14R2.8 CNC1COC(c2cnccn2)C1 Amb35602929 [0,0,0,1,0,1|2,0,0]=4 6146 B14R2.8 CNC1COC(c2cncnc2)C1 Amb30027734 [0,0,0,1,0,1|2,0,0]=4 6147 B14R2.8 COC1COB(c2ccccc2)O1 Amb27771401 [0,0,0,1,0,1|2,0,0]=4 6148 B14R2.8 COC1COC(c2ccccc2)=N1 Amb25940976 [0,0,0,1,0,1|1,0,1]=4 6149 B14R2.8 ClCC1COC(c2ccccc2)O1 Amb534375 [0,0,0,1,0,1|2,0,0]=4 6150 B14R2.8 ClC[C@@H]1CO[C@H](c2ccccc2)O1 Amb28076704 [0,0,0,1,0,1|2,0,0]=4 6151 B14R2.8 ClC[C@H]1COC(c2ccccc2)O1 Amb28195089 [0,0,0,1,0,1|2,0,0]=4 6152 B14R2.8 O=CC1COC(c2ccccc2)O1 Amb28133382 [0,0,0,1,0,1|2,0,0]=4 6153 B14R2.8 OCC1COC(c2ccccc2)C1 Amb27206483 [0,0,0,1,0,1|2,0,0]=4 6154 B14R2.8 OCC1COC(c2ccccc2)O1 Amb17335395 [0,0,0,1,0,1|2,0,0]=4 6155 B14R2.21 BrC1CCOC(c2ccccc2)C1 Amb25954318 [0,0,0,1,0,1|2,0,0]=4 6156 B14R2.21 Br[C@@H]1CCO[C@@H](c2ccccc2)C1 Amb27211880 [0,0,0,1,0,1|2,0,0]=4 6157 B14R2.21 Br[C@H]1CCO[C@H](c2ccccc2)C1 Amb22898808 [0,0,0,1,0,1|2,0,0]=4 6158 B14R2.21 CC1CC(c2ccccc2)CCN1 Amb25765759 [0,0,0,1,0,1|1,0,0]=3 6159 B14R2.21 CC1CC(c2ccccc2)OCN1 Amb27793423 [0,0,0,1,0,1|0,0,0]=2 6160 B14R2.21 CC1CCCC(c2ccccc2)N1 Amb5717718 [0,0,0,1,0,1|2,0,0]=4 6161 B14R2.21 CC1CCNC(c2ccccc2)C1 Amb24066154 [0,0,0,1,0,1|2,0,0]=4 6162 B14R2.21 CC1CCNC(c2ccccc2)S1 Amb27757530 [0,0,0,1,0,1|2,0,0]=4 6163 B14R2.21 CC1CCOC(c2ccccc2)O1 Amb9787478 [0,0,0,1,0,1|1,0,0]=3 6164 B14R2.21 CC1CN(c2ccccc2)CCN1 Amb10603700 [0,0,0,1,0,1|2,0,0]=4 6165 B14R2.21 CC1CN(c2ccccc2)CCN1 Amb13948949 [0,0,0,1,0,1|2,0,0]=4 6166 B14R2.21 CC1CN(c2ccccc2)CCN1 Amb33552158 [0,0,0,1,0,1|2,0,0]=4 6167 B14R2.21 CC1NC(c2ccccc2)CCO1 Amb33193177 [0,0,0,1,0,1|2,0,0]=4 6168 B14R2.21 C[C@@H]1CCC[C@H](c2ccccc2)N1 Amb24710306 [0,0,0,1,0,1|2,0,0]=4 6169 B14R2.21 C[C@@H]1CN(c2ccccc2)CCN1 Amb26023098 [0,0,0,1,0,1|2,0,0]=4 6170 B14R2.21 C[C@@H]1CN(c2ccccc2)CCN1 Amb32679326 [0,0,0,1,0,1|2,0,0]=4 6171 B14R2.21 C[C@@H]1C[C@H](c2ccccc2)OCN1 Amb28071206 [0,0,0,1,0,1|0,0,0]=2 6172 B14R2.21 C[C@H]1CCC[C@@H](c2ccccc2)N1 Amb28052152 [0,0,0,1,0,1|2,0,0]=4 6173 B14R2.21 C[C@H]1CCO[C@@H](c2ccccc2)N1 Amb27213219 [0,0,0,1,0,1|1,0,0]=3 6174 B14R2.21 C[C@H]1CN(c2ccccc2)CCN1 Amb28365965 [0,0,0,1,0,1|2,0,0]=4 6175 B14R2.21 NC1CCOC(c2ccccc2)C1 Amb27663848 [0,0,0,1,0,1|2,0,0]=4 6176 B14R2.21 NC1CCOC(c2ccccc2)C1 Amb33551617 [0,0,0,1,0,1|2,0,0]=4 6177 B14R2.21 N[C@@H]1CCO[C@@H](c2ccccc2)C1 Amb25940690 [0,0,0,1,0,1|2,0,0]=4 6178 B14R2.21 N[C@@H]1CCO[C@H](c2ccccc2)C1 Amb27203356 [0,0,0,1,0,1|2,0,0]=4 6179 B14R2.21 N[C@H]1CCO[C@@H](c2ccccc2)C1 Amb22747497 [0,0,0,1,0,1|2,0,0]=4 6180 B14R2.21 OC1CCOC(c2ccccc2)C1 Amb21962863 [0,0,0,1,0,1|2,0,0]=4 6181 B14R2.21 O[C@@H]1CCO[C@@H](c2ccccc2)C1 Amb24722718 [0,0,0,1,0,1|2,0,0]=4 6182 B14R2.21 O[C@@H]1CCO[C@H](c2ccccc2)C1 Amb25685558 [0,0,0,1,0,1|2,0,0]=4 6183 B14R2.21 O[C@H]1CCO[C@@H](c2ccccc2)C1 Amb22746392 [0,0,0,1,0,1|2,0,0]=4 6184 B14R2.52 CC1=CCc2ccccc2C(O)C1 Amb27197095 [0,0,0,1,0,1|1,0,1]=4 6185 B14R2.52 CC1CCc2ccccc2C(N)C1 Amb18944007 [0,0,0,1,0,1|2,0,0]=4 6186 B14R2.52 CC1CN(C)c2ccccc2CN1 Amb17578284 [0,0,0,1,0,1|2,0,0]=4 6187 B14R2.52 CC1C[C@@H](O)c2ccccc2CS1 Amb27652158 [0,0,0,1,0,1|1,0,0]=3 6188 B14R2.52 CN1CCc2ccccc2C(O)C1 Amb25142465 [0,0,0,1,0,1|2,0,0]=4 6189 B14R2.52 C[C@H]1C=Cc2ccccc2[C@H](O)C1 Amb27422538 [0,0,0,1,0,1|1,0,1]=4 6190 B14R2.52 C[C@H]1CN(C)c2ccccc2CN1 Amb32668252 [0,0,0,1,0,1|2,0,0]=4 6191 B14R2.52 OC1CCc2ccccc2C(O)C1 Amb27405316 [0,0,0,1,0,1|2,0,0]=4 6192 B14R2.260 CC1CC(c2ccccc2)CN1C Amb27833490 [0,0,0,1,0,1|1,0,0]=3 6193 B14R2.260 CC1OC(c2ccccc2)OC1C Amb28251436 [0,0,0,1,0,1|1,0,0]=3 6194 B14R2.260 C[C@@H]1C[C@@H](c2ccccc2)OC1O Amb27978302 [0,0,0,1,0,1|2,0,0]=4 6195 B14R2.260 C[C@@H]1OC(c2ccccc2)CC1O Amb27164428 [0,0,0,1,0,1|2,0,0]=4 6196 B14R2.260 C[C@@H]1O[C@H](c2ccccc2)C[C@@H]1O Amb28207328 [0,0,0,1,0,1|2,0,0]=4 6197 B14R2.260 C[C@H]1NC(c2ccccc2)OC1=O Amb27482934 [0,0,0,1,0,1|2,0,0]=4 6198 B14R2.335 O=C1NCC1C(O)c2ccccc2 Amb28128474 [0,0,0,1,0,1|1,0,1]=4 6199 B14R2.335 O=C1NC[C@H]1[C@H](O)c2ccccc2 Amb27789997 [0,0,0,1,0,1|1,0,1]=4 6200 B14R2.352 CC(N[C@@H]1C[C@H]1C)c2ccccc2 Amb27809313 [0,0,0,1,0,1|2,0,0]=4 6201 B14R2.794 ClC(CC1CCC1)c2ccccc2 Amb27828299 [0,0,0,1,0,1|2,0,0]=4 6202 B14R2.794 NC(CC1CCC1)c2ccccc2 Amb27460256 [0,0,0,1,0,1|2,0,0]=4 6203 B14R2.794 OC(CC1CCC1)c2ccncc2 Amb27167160 [0,0,0,1,0,1|2,0,0]=4 6204 B14R2.958 CC(NN)C1CC1c2ccccc2 Amb27247871 [0,0,0,1,0,1|2,0,0]=4 6205 B14R2.958 CNC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb27255278 [0,0,0,1,0,1|1,0,1]=4 6206 B14R2.1019 CC[C@H]1C[C@H](O)c2ccccc2O1 Amb27261716 [0,0,0,1,0,1|2,0,0]=4 6207 B14R2.1019 OCC1Cc2ccccc2C(O)C1 Amb17470583 [0,0,0,1,0,1|2,0,0]=4 6208 B14R2.1161 CCC1CC1C(Cl)c2ccccc2 Amb27266174 [0,0,0,1,0,1|2,0,0]=4 6209 B14R2.1161 CCC1CC1C(O)c2ccccc2 Amb27250969 [0,0,0,1,0,1|1,0,0]=3 6210 B14R2.1161 CCC1CC1C(O)c2cccnc2 Amb27860477 [0,0,0,1,0,1|2,0,0]=4 6211 B14R2.1161 COC1CC1C(Br)c2ccccc2 Amb35732109 [0,0,0,1,0,1|2,0,0]=4 6212 B14R2.1161 COC1CC1C(Cl)c2ccccc2 Amb35732120 [0,0,0,1,0,1|2,0,0]=4 6213 B14R2.1161 COC1CC1C(N)c2ccccc2 Amb35732331 [0,0,0,1,0,1|2,0,0]=4 6214 B14R2.1161 COC1CC1C(O)c2ccccc2 Amb35683794 [0,0,0,1,0,1|1,0,0]=3 6215 B14R2.1161 COC1CC1C(O)c2cccnc2 Amb35683707 [0,0,0,1,0,1|2,0,0]=4 6216 B14R2.2950 CC1CC(O)(c2ccccc2)CO1 Amb35728828 [0,0,0,1,0,1|1,0,0]=3 6217 B14R2.2950 CC1CC(O)(c2cccnc2)CO1 Amb35728829 [0,0,0,1,0,1|2,0,0]=4 6218 B14R2.2950 CC1CCC(O)(c2ccccc2)C1 Amb28196285 [0,0,0,1,0,1|1,0,0]=3 6219 B14R2.2950 C[C@@H]1C[C@](C)(c2ccccc2)CN1 Amb27462044 [0,0,0,1,0,1|1,0,0]=3 6220 B14R2.2950 NC1CCC(O)(c2ccccc2)C1 Amb22749709 [0,0,0,1,0,1|2,0,0]=4 6221 B14R2.2950 O=C1CC(O)(c2ccccc2)CN1 Amb27653252 [0,0,0,1,0,1|1,0,1]=4 6222 B14R2.2950 OC1CCC(O)(c2ccccc2)C1 Amb27757349 [0,0,0,1,0,1|2,0,0]=4 6223 B14R2.2986 CCC1CC(N)(c2ccccc2)C1 Amb27798153 [0,0,0,1,0,1|2,0,0]=4 6224 B14R2.2986 CNC1CC(O)(c2ccccc2)C1 Amb27797237 [0,0,0,1,0,1|0,0,0]=2 6225 B14R2.2986 COC1CC(O)(c2ccccc2)C1 Amb28289010 [0,0,0,1,0,1|1,0,0]=3 6226 B14R2.3486 CC1(CO)CC1(O)c2ccccc2 Amb28128780 [0,0,0,1,0,1|2,0,0]=4 6227 B14R2.3486 C[C@]1(CO)C[C@]1(O)c2ccccc2 Amb27219042 [0,0,0,1,0,1|2,0,0]=4 6228 B14R2.7724 CC1CC(O)c2ccccc2C1C Amb27655473 [0,0,0,1,0,1|1,0,0]=3 6229 B14R2.7724 CC1NC(=O)c2ccccc2N1C Amb27446680 [0,0,0,1,0,1|0,0,2]=4 6230 B14R2.7724 CC1OC(O)c2ccccc2C1=O Amb28199938 [0,0,0,1,0,1|2,0,0]=4 6231 B14R2.7724 C[C@@H]1C[C@@H](O)c2ccccc2[C@@H]1O Amb27230570 [0,0,0,1,0,1|2,0,0]=4 6232 B14R2.7724 C[C@H]1C[C@@H](O)c2ccccc2[C@@H]1O Amb27849643 [0,0,0,1,0,1|2,0,0]=4 6233 B14R2.9595 CC(NC1(C)CC1)c2ccccc2 Amb28123620 [0,0,0,1,0,1|2,0,0]=4 6234 B14R2.9595 CC1(CC(N)c2ccccc2)CC1 Amb27630128 [0,0,0,1,0,1|2,0,0]=4 6235 B14R2.9595 NC1(CC(O)c2ccccc2)CC1 Amb18195918 [0,0,0,1,0,1|2,0,0]=4 6236 B14R2.30 CC1CCCC1Nc2ccccc2 Amb27470643 [0,0,0,1,0,1|2,0,0]=4 6237 B14R2.30 CC1CCN[C@H]1Cc2ccccc2 Amb27947239 [0,0,0,1,0,1|2,0,0]=4 6238 B14R2.30 CC1NCCC1Cc2ccccc2 Amb18960801 [0,0,0,1,0,1|1,0,0]=3 6239 B14R2.30 CC1NCC\C1=C/c2ccccc2 Amb18127119 [0,0,0,1,0,1|1,0,1]=4 6240 B14R2.30 CC1OCCC1Nc2ccccc2 Amb28242101 [0,0,0,1,0,1|2,0,0]=4 6241 B14R2.30 C[C@@H]1CCN[C@H]1Cc2ccccc2 Amb18197090 [0,0,0,1,0,1|2,0,0]=4 6242 B14R2.30 C[C@H]1CCN[C@@H]1Cc2ccccc2 Amb27624379 [0,0,0,1,0,1|2,0,0]=4 6243 B14R2.30 ClC1CCOC1Oc2ccccc2 Amb27632462 [0,0,0,1,0,1|2,0,0]=4 6244 B14R2.30 NC1CCOC1Cc2ccccc2 Amb28349412 [0,0,0,1,0,1|2,0,0]=4 6245 B14R2.30 OC1CCOC1Cc2ccccc2 Amb27179516 [0,0,0,1,0,1|2,0,0]=4 6246 B14R2.30 OC1NCCC1Cc2ccccc2 Amb27650899 [0,0,0,1,0,1|2,0,0]=4 6247 B14R2.343 CC1CC1C(C)Nc2ccccc2 Amb28342564 [0,0,0,1,0,1|2,0,0]=4 6248 B14R2.343 CC1CC1C(Cl)Cc2ccccc2 Amb18317922 [0,0,0,1,0,1|2,0,0]=4 6249 B14R2.343 CC1CC1C(O)Cc2ccccn2 Amb27624440 [0,0,0,1,0,1|2,0,0]=4 6250 B14R2.343 CC1CC1C(O)Cc2cccnc2 Amb27483678 [0,0,0,1,0,1|2,0,0]=4 6251 B14R2.727 CC1CCC1(O)Cc2ccccn2 Amb28381432 [0,0,0,1,0,1|2,0,0]=4 6252 B14R2.727 CC1CCC1(O)Cc2cccnc2 Amb28324740 [0,0,0,1,0,1|2,0,0]=4 6253 B14R2.741 CC1Cc2ccccc2CNC1C Amb28122885 [0,0,0,1,0,1|1,0,0]=3 6254 B14R2.741 CC1NCc2ccccc2NC1=O Amb25900602 [0,0,0,1,0,1|0,0,2]=4 6255 B14R2.741 CC1NCc2ccccc2NC1=O Amb28556000 [0,0,0,1,0,1|0,0,2]=4 6256 B14R2.741 C[C@@H]1NCc2ccccc2NC1=O Amb28071248 [0,0,0,1,0,1|0,0,2]=4 6257 B14R2.741 NC1CCc2ccccc2CC1O Amb27392292 [0,0,0,1,0,1|2,0,0]=4 6258 B14R2.972 CC(CN)C1Cc2ccccc2O1 Amb33739692 [0,0,0,1,0,1|2,0,0]=4 6259 B14R2.972 CC(CO)C1Cc2ccccc2O1 Amb33749203 [0,0,0,1,0,1|2,0,0]=4 6260 B14R2.972 CC(NN)C1Cc2ccccc2O1 Amb27828232 [0,0,0,1,0,1|1,0,0]=3 6261 B14R2.972 CC(NN)C1Cc2ccccc2S1 Amb27976512 [0,0,0,1,0,1|1,1,0]=4 6262 B14R2.972 CC(NN)c1cc2ccccc2o1 Amb6244719 [0,0,0,1,0,1|1,0,1]=4 6263 B14R2.972 CCC(C)c1cc2ccccc2o1 Amb8387757 [0,0,0,1,0,1|1,0,1]=4 6264 B14R2.972 CCC(C)c1nc2ccccc2o1 Amb17570155 [0,0,0,1,0,1|1,0,1]=4 6265 B14R2.972 CC[C@@H](N)C1Cc2ccccc2O1 Amb27240727 [0,0,0,1,0,1|2,0,0]=4 6266 B14R2.972 CNC(=O)C1Cc2ccccc2O1 Amb8328022 [0,0,0,1,0,1|1,0,1]=4 6267 B14R2.972 CNC(C)C1Cc2ccccc2N1 Amb28368766 [0,0,0,1,0,1|1,0,0]=3 6268 B14R2.972 CNC(C)C1Cc2ccccc2O1 Amb20668421 [0,0,0,1,0,1|0,0,0]=2 6269 B14R2.972 CNC(C)C1Cc2ccccc2O1 Amb22157233 [0,0,0,1,0,1|0,0,0]=2 6270 B14R2.972 CNC(C)c1cc2ccccc2o1 Amb6661257 [0,0,0,1,0,1|0,0,1]=3 6271 B14R2.972 CNC(C)c1cc2ccccc2s1 Amb19648795 [0,0,0,1,0,1|0,1,1]=4 6272 B14R2.972 CNC(C)c1nc2ccccc2s1 Amb2371159 [0,0,0,1,0,1|0,1,1]=4 6273 B14R2.972 CNC(C)c1nc2ccccc2s1 Amb9677298 [0,0,0,1,0,1|0,1,1]=4 6274 B14R2.972 CN[C@@H](C)c1cc2ccccc2o1 Amb27476108 [0,0,0,1,0,1|0,0,1]=3 6275 B14R2.972 CN[C@H](C)c1cc2ccccc2o1 Amb28291488 [0,0,0,1,0,1|0,0,1]=3 6276 B14R2.972 CSC(C)c1nc2ccccc2o1 Amb28320267 [0,0,0,1,0,1|1,0,1]=4 6277 B14R2.972 C[C@@H](CN)C1Cc2ccccc2O1 Amb33744948 [0,0,0,1,0,1|2,0,0]=4 6278 B14R2.972 C[C@@H](CO)C1Cc2ccccc2O1 Amb33727983 [0,0,0,1,0,1|2,0,0]=4 6279 B14R2.972 C[C@H](CN)C1Cc2ccccc2O1 Amb33730088 [0,0,0,1,0,1|2,0,0]=4 6280 B14R2.972 C[C@H](CO)C1Cc2ccccc2O1 Amb33738442 [0,0,0,1,0,1|2,0,0]=4 6281 B14R2.1039 CCC1CC1(O)Cc2cccnc2 Amb27168845 [0,0,0,1,0,1|2,0,0]=4 6282 B14R2.1128 C=CC1Cc2ccccc2CC1O Amb27981901 [0,0,0,1,0,1|1,0,1]=4 6283 B14R2.1128 CNC1Cc2ccccc2NC1=O Amb27984872 [0,0,0,1,0,1|0,0,2]=4 6284 B14R2.1128 CN[C@@H]1Cc2ccccc2C[C@@H]1O Amb27848968 [0,0,0,1,0,1|0,0,0]=2 6285 B14R2.1128 CN[C@@H]1Cc2ccccc2C[C@H]1O Amb28052175 [0,0,0,1,0,1|0,0,0]=2 6286 B14R2.1128 CN[C@H]1Cc2ccccc2O[C@H]1C Amb27476224 [0,0,0,1,0,1|1,0,0]=3 6287 B14R2.1128 COC1Cc2ccccc2CC1O Amb27415108 [0,0,0,1,0,1|1,0,0]=3 6288 B14R2.1128 COC1Cc2ccccc2NC1C Amb24468004 [0,0,0,1,0,1|2,0,0]=4 6289 B14R2.1128 COC1Cc2ccccc2NC1C Amb28600425 [0,0,0,1,0,1|2,0,0]=4 6290 B14R2.1128 CO[C@@H]1C=C2C=CC=CC2=C[C@@H]1O Amb28067831 [0,0,0,1,0,1|1,0,1]=4 6291 B14R2.1128 CO[C@H]1Cc2ccccc2N[C@H]1C Amb27464377 [0,0,0,1,0,1|2,0,0]=4 6292 B14R2.1134 CNC1CC(c2ccccc2)C1C Amb27811739 [0,0,0,1,0,1|1,0,0]=3 6293 B14R2.2956 C[C@]1(CO)O[C@H]1Cc2ccccc2 Amb28318181 [0,0,0,1,0,1|2,0,0]=4 6294 B14R2.4514 CC1NCN(c2ccccc2)C1=O Amb24607317 [0,0,0,1,0,1|0,0,2]=4 6295 B14R2.4514 C[C@H]1ON=C(c2ccccc2)[C@@H]1O Amb28129853 [0,0,0,1,0,1|2,0,0]=4 6296 B14R2.4514 OC1CCC(c2ccccc2)C1O Amb28318736 [0,0,0,1,0,1|2,0,0]=4 6297 B14R2.4576 CC1C(C)C1(Cl)Sc2ccccc2 Amb27231584 [0,0,0,1,0,1|2,0,0]=4 6298 B14R2.8188 CC1C(=O)c2ccccc2OC1O Amb2732120 [0,0,0,1,0,1|2,0,0]=4 6299 B14R2.8188 CC1Sc2ccccc2N(C)C1C Amb27809380 [0,0,0,1,0,1|1,0,0]=3 6300 B14R2.8188 CN1c2ccccc2NC(N)C1N Amb27415822 [0,0,0,1,0,1|2,0,0]=4 6301 B14R2.8188 C[C@H]1C(=O)c2ccccc2O[C@@H]1O Amb28253950 [0,0,0,1,0,1|2,0,0]=4 6302 B14R2.9589 BrC(Cc1ccccc1)C2CCC2 Amb27458119 [0,0,0,1,0,1|2,0,0]=4 6303 B14R2.9589 CC(Nc1ccccc1)C2CCC2 Amb27975448 [0,0,0,1,0,1|2,0,0]=4 6304 B14R2.9589 C\C(=C/c1ccccc1)C2CCN2 Amb33476717 [0,0,0,1,0,1|1,0,1]=4 6305 B14R2.9589 ClC(Cc1ccccc1)C2CCC2 Amb18317923 [0,0,0,1,0,1|2,0,0]=4 6306 B14R2.9589 O=C(Nc1ccccc1)[C@@H]2CCN2 Amb27244878 [0,0,0,1,0,1|0,0,2]=4 6307 B14R2.9589 O=C(Nc1ccccc1)[C@H]2CCN2 Amb27419103 [0,0,0,1,0,1|0,0,2]=4 6308 B14R2.9589 OC(Cc1ccccc1)C2CSC2 Amb29852086 [0,0,0,1,0,1|2,0,0]=4 6309 B14R2.9592 CC1(C(O)Cc2ccccn2)CC1 Amb28424173 [0,0,0,1,0,1|2,0,0]=4 6310 B14R2.9592 CC1(C(O)Cc2ccncc2)CC1 Amb27403832 [0,0,0,1,0,1|2,0,0]=4 6311 B14R2.9592 NC1(C(O)Cc2ccccc2)CC1 Amb29875621 [0,0,0,1,0,1|2,0,0]=4 6312 B14R2.88 CCC1CC1(N)c2ccc(Cl)cc2 Amb24394737 [0,1,0,1,0,0|2,0,0]=4 6313 B14R2.88 CCC1CC1(O)c2ccc(Br)cc2 Amb28141118 [0,1,0,1,0,0|1,0,0]=3 6314 B14R2.88 CCC1CC1(O)c2ccc(Br)cn2 Amb27751440 [0,1,0,1,0,0|2,0,0]=4 6315 B14R2.88 CCC1CC1(O)c2ccc(Cl)cc2 Amb27771919 [0,1,0,1,0,0|1,0,0]=3 6316 B14R2.88 CCC1CC1(O)c2ccc(Cl)cn2 Amb27458889 [0,1,0,1,0,0|2,0,0]=4 6317 B14R2.926 CC1CCNC1c2ccc(Cl)cc2 Amb3788591 [0,1,0,1,0,0|2,0,0]=4 6318 B14R2.926 CC1NCCC1c2ccc(Br)cc2 Amb18156968 [0,1,0,1,0,0|1,0,0]=3 6319 B14R2.926 CC1NCCC1c2ccc(Cl)cc2 Amb18280032 [0,1,0,1,0,0|1,0,0]=3 6320 B14R2.926 CN1CCOC1c2ccc(Br)cc2 Amb17349006 [0,1,0,1,0,0|2,0,0]=4 6321 B14R2.926 CN1CCOC1c2ccc(Cl)cc2 Amb17337249 [0,1,0,1,0,0|2,0,0]=4 6322 B14R2.926 CN1CCOC1c2ccc(F)cc2 Amb17335483 [0,1,0,1,0,0|2,0,0]=4 6323 B14R2.926 CN1CCOC1c2ccc(O)cc2 Amb17335296 [0,1,0,1,0,0|2,0,0]=4 6324 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(Br)cc2 Amb18156752 [0,1,0,1,0,0|2,0,0]=4 6325 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(Cl)cc2 Amb18189119 [0,1,0,1,0,0|2,0,0]=4 6326 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(F)cc2 Amb18194450 [0,1,0,1,0,0|2,0,0]=4 6327 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(O)cc2 Amb18195881 [0,1,0,1,0,0|2,0,0]=4 6328 B14R2.926 C[C@H]1CCN[C@@H]1c2ccc(Br)cc2 Amb27783060 [0,1,0,1,0,0|2,0,0]=4 6329 B14R2.926 C[C@H]1CCN[C@@H]1c2ccc(O)cc2 Amb28400112 [0,1,0,1,0,0|2,0,0]=4 6330 B14R2.926 C[C@H]1NCO[C@H]1c2ccc(Cl)cc2 Amb28052179 [0,1,0,1,0,0|0,0,0]=2 6331 B14R2.926 Cc1ccc(C2CCNC2C)cc1 Amb18947160 [0,1,0,1,0,0|1,0,0]=3 6332 B14R2.926 Cc1ccc(C2CCNC2C)cn1 Amb27664555 [0,1,0,1,0,0|2,0,0]=4 6333 B14R2.926 Cc1ccc(C2NCCC2C)cc1 Amb3788236 [0,1,0,1,0,0|2,0,0]=4 6334 B14R2.926 Cc1ccc(C2OCCC2Cl)cc1 Amb27605850 [0,1,0,1,0,0|2,0,0]=4 6335 B14R2.926 Cc1ccc(C2OCCN2C)cc1 Amb6359333 [0,1,0,1,0,0|2,0,0]=4 6336 B14R2.926 Cc1ccc([C@@H]2NCC[C@H]2C)cc1 Amb18197091 [0,1,0,1,0,0|2,0,0]=4 6337 B14R2.926 NC1CCOC1c2ccc(Cl)cc2 Amb24660263 [0,1,0,1,0,0|2,0,0]=4 6338 B14R2.926 N[C@@H]1CCO[C@@H]1c2ccc(Cl)cc2 Amb34915521 [0,1,0,1,0,0|2,0,0]=4 6339 B14R2.926 N[C@@H]1CCO[C@@H]1c2ccc(F)cc2 Amb27422015 [0,1,0,1,0,0|2,0,0]=4 6340 B14R2.926 N[C@@H]1CCO[C@H]1c2ccc(Cl)cc2 Amb31147393 [0,1,0,1,0,0|2,0,0]=4 6341 B14R2.928 CC1=C(C(O)c2ccc(C)cc2)C1 Amb28206191 [0,1,0,1,0,0|1,0,1]=4 6342 B14R2.928 CC1CC1C(Br)c2ccc(F)cc2 Amb27608939 [0,1,0,1,0,0|2,0,0]=4 6343 B14R2.928 CC1CC1C(N)c2ccc(Cl)cc2 Amb33550021 [0,1,0,1,0,0|2,0,0]=4 6344 B14R2.928 CC1CC1C(N)c2ccc(Cl)cc2 Amb8856906 [0,1,0,1,0,0|2,0,0]=4 6345 B14R2.1095 CCC1Oc2cc(Cl)ccc2C1O Amb27393346 [0,1,0,1,0,0|2,0,0]=4 6346 B14R2.1095 CNC1Cc2cc(C)ccc2C1O Amb27803764 [0,1,0,1,0,0|0,0,0]=2 6347 B14R2.1095 CNC1Cc2cc(F)ccc2C1O Amb28286954 [0,1,0,1,0,0|0,0,0]=2 6348 B14R2.3373 C[C@@]1(CO)O[C@H]1c2ccc(F)cc2 Amb27981734 [0,1,0,1,0,0|2,0,0]=4 6349 B14R2.8716 CC1C(=O)c2ccc(F)cc2C1O Amb27617632 [0,1,0,1,0,0|2,0,0]=4 6350 B14R2.8716 CC1c2ccc(F)cc2C(O)C1C Amb28321215 [0,1,0,1,0,0|1,0,0]=3 6351 B14R2.8716 CN1C(=O)C(O)c2ccc(Cl)cc21 Amb28069727 [0,1,0,1,0,0|1,0,1]=4 6352 B14R2.8716 Cc1ccc2c(c1)C(Br)C(C)C2C Amb27754552 [0,1,0,1,0,0|2,0,0]=4 6353 B14R2.8716 Cc1ccc2c(c1)C(N)C(C)C2C Amb28320085 [0,1,0,1,0,0|2,0,0]=4 6354 B14R2.8716 Cc1ccc2c(c1)C(O)C(=O)N2C Amb28079069 [0,1,0,1,0,0|1,0,1]=4 6355 B14R2.10593 CC1CCC1(N)c2ccc(F)cc2 Amb27950363 [0,1,0,1,0,0|2,0,0]=4 6356 B14R2.10593 CC1CCC1(O)c2ccc(Br)cc2 Amb35614520 [0,1,0,1,0,0|1,0,0]=3 6357 B14R2.10606 CC(c1ccc(F)cc1)C2CCN2 Amb33274139 [0,1,0,1,0,0|1,0,0]=3 6358 B14R2.10606 Cc1ccc(C(Cl)C2CCC2)cc1 Amb18321300 [0,1,0,1,0,0|2,0,0]=4 6359 B14R2.10606 Cc1ccc(C(N)C2CCC2)cc1 Amb32662458 [0,1,0,1,0,0|2,0,0]=4 6360 B14R2.10606 Cc1ccc(C(N)C2CCC2)cc1 Amb6256137 [0,1,0,1,0,0|2,0,0]=4 6361 B14R2.10606 Cc1ccc(C(O)C2CCC2)cc1 Amb17194499 [0,1,0,1,0,0|1,0,0]=3 6362 B14R2.10606 Cc1ccc(C(O)C2CSC2)cc1 Amb29852087 [0,1,0,1,0,0|2,0,0]=4 6363 B14R2.10606 Cc1ccc([C@@H](O)C2CCC2)cc1 Amb27494702 [0,1,0,1,0,0|1,0,0]=3 6364 B14R2.10606 Cc1ccc([C@H](N)C2CCC2)cc1 Amb27405776 [0,1,0,1,0,0|2,0,0]=4 6365 B14R2.10606 Cc1ccc([C@H](O)C2CCC2)cc1 Amb27464636 [0,1,0,1,0,0|1,0,0]=3 6366 B14R2.10606 ClC(c1ccc(Br)cc1)C2CCC2 Amb27662525 [0,1,0,1,0,0|2,0,0]=4 6367 B14R2.10606 NC(c1ccc(Br)cc1)C2CCC2 Amb10609590 [0,1,0,1,0,0|2,0,0]=4 6368 B14R2.10606 NC(c1ccc(Br)cc1)C2CCC2 Amb9209224 [0,1,0,1,0,0|2,0,0]=4 6369 B14R2.10606 NC(c1ccc(Cl)cc1)C2CCC2 Amb8856907 [0,1,0,1,0,0|2,0,0]=4 6370 B14R2.10606 NC(c1ccc(F)cc1)C2CCC2 Amb9718005 [0,1,0,1,0,0|2,0,0]=4 6371 B14R2.10606 NC(c1ccc(I)cc1)C2CCC2 Amb28367119 [0,1,0,1,0,0|2,0,0]=4 6372 B14R2.10606 N[C@@H](c1ccc(S)cc1)C2CCC2 Amb27494697 [0,1,0,1,0,0|2,0,0]=4 6373 B14R2.10606 N[C@H](c1ccc(F)cc1)C2CCC2 Amb28068788 [0,1,0,1,0,0|2,0,0]=4 6374 B14R2.10606 Nc1ccc(C(O)C2CCC2)nc1 Amb35625126 [0,1,0,1,0,0|2,0,0]=4 6375 B14R2.10606 OC(c1ccc(Br)cc1)C2CCC2 Amb17196187 [0,1,0,1,0,0|1,0,0]=3 6376 B14R2.10606 OC(c1ccc(Br)cc1)C2CSC2 Amb35626224 [0,1,0,1,0,0|2,0,0]=4 6377 B14R2.10606 OC(c1ccc(Br)cn1)C2CCC2 Amb27490590 [0,1,0,1,0,0|2,0,0]=4 6378 B14R2.10606 OC(c1ccc(Cl)cc1)C2CCC2 Amb17194753 [0,1,0,1,0,0|1,0,0]=3 6379 B14R2.10606 OC(c1ccc(Cl)cc1)C2CSC2 Amb29862802 [0,1,0,1,0,0|2,0,0]=4 6380 B14R2.10606 OC(c1ccc(Cl)nc1)C2CCC2 Amb27806414 [0,1,0,1,0,0|2,0,0]=4 6381 B14R2.10606 OC(c1ccc(F)cc1)C2CCC2 Amb17194541 [0,1,0,1,0,0|1,0,0]=3 6382 B14R2.10606 OC(c1ccc(F)cc1)C2CSC2 Amb29862774 [0,1,0,1,0,0|2,0,0]=4 6383 B14R2.10606 OC(c1ccc(I)cc1)C2CCC2 Amb27952148 [0,1,0,1,0,0|1,0,0]=3 6384 B14R2.10627 CC(c1ccc(F)cc1)C2(C)CO2 Amb33273684 [0,1,0,1,0,0|2,0,0]=4 6385 B14R2.10627 CC1(C(N)c2ccc(Br)cc2)CC1 Amb18070379 [0,1,0,1,0,0|2,0,0]=4 6386 B14R2.10627 CC1(C(N)c2ccc(Cl)cc2)CC1 Amb18066383 [0,1,0,1,0,0|2,0,0]=4 6387 B14R2.10627 CC1(C(N)c2ccc(F)cc2)CC1 Amb18564098 [0,1,0,1,0,0|2,0,0]=4 6388 B14R2.10627 CC1(C(O)c2ccc(Br)cc2)CC1 Amb27449692 [0,1,0,1,0,0|1,0,0]=3 6389 B14R2.10627 CC1(C(O)c2ccc(Cl)cc2)CC1 Amb28046489 [0,1,0,1,0,0|1,0,0]=3 6390 B14R2.10627 CC1(C(O)c2ccc(F)cc2)CC1 Amb27167465 [0,1,0,1,0,0|1,0,0]=3 6391 B14R2.10627 C[C@@]1([C@H](O)c2ccc(Cl)cc2)CO1 Amb27970948 [0,1,0,1,0,0|1,0,0]=3 6392 B14R2.10627 Cc1ccc(C(Br)C2(C)CC2)cc1 Amb27163357 [0,1,0,1,0,0|2,0,0]=4 6393 B14R2.10627 Cc1ccc(C(N)C2(C)CC2)cc1 Amb18065587 [0,1,0,1,0,0|2,0,0]=4 6394 B14R2.10627 Cc1ccc(C(O)C2(C)CC2)cc1 Amb27458203 [0,1,0,1,0,0|1,0,0]=3 6395 B14R2.10627 Cc1ccc(C(O)C2(C)CO2)cc1 Amb28206041 [0,1,0,1,0,0|1,0,0]=3 6396 B14R2.10627 Cc1ccc(C(O)C2(N)CC2)cc1 Amb29875616 [0,1,0,1,0,0|2,0,0]=4 6397 B14R2.10627 NC1(C(O)c2ccc(Br)cc2)CC1 Amb32651509 [0,1,0,1,0,0|2,0,0]=4 6398 B14R2.10627 NC1(C(O)c2ccc(Cl)cc2)CC1 Amb29875627 [0,1,0,1,0,0|2,0,0]=4 6399 B14R2.10627 NC1(C(O)c2ccc(F)cc2)CC1 Amb32651508 [0,1,0,1,0,0|2,0,0]=4 6400 B14R2.10627 OC(c1ccc(F)cc1)C2(O)CC2 Amb27457921 [0,1,0,1,0,0|2,0,0]=4 6401 B14R2.29369 NC1CCc2cc(Br)ccc2C1O Amb2383089 [0,1,0,1,0,0|2,0,0]=4 6402 B14R2.29369 NC1CCc2cc(F)ccc2C1O Amb2383088 [0,1,0,1,0,0|2,0,0]=4 6403 B14R2.29369 N[C@@H]1CCc2cc(Br)ccc2[C@H]1O Amb35748109 [0,1,0,1,0,0|2,0,0]=4 6404 B14R2.29369 N[C@@H]1CCc2cc(Br)ccc2[C@H]1O Amb35748110 [0,1,0,1,0,0|2,0,0]=4 6405 B14R2.29369 N[C@H]1CCc2cc(Br)ccc2[C@@H]1O Amb27431297 [0,1,0,1,0,0|2,0,0]=4 6406 B14R2.269 CC1CCCC1c2cccc(N)c2 Amb33231718 [0,1,0,1,0,0|2,0,0]=4 6407 B14R2.269 CC1CCNC1c2cccc(Br)c2 Amb3790660 [0,1,0,1,0,0|2,0,0]=4 6408 B14R2.269 CC1CCNC1c2cccc(Cl)c2 Amb3788592 [0,1,0,1,0,0|2,0,0]=4 6409 B14R2.269 CC1CCNC1c2cccc(F)c2 Amb3788288 [0,1,0,1,0,0|2,0,0]=4 6410 B14R2.269 CC1NCCC1c2cccc(Br)c2 Amb18156965 [0,1,0,1,0,0|1,0,0]=3 6411 B14R2.269 CN1CCOC1c2cccc(Br)c2 Amb17349004 [0,1,0,1,0,0|2,0,0]=4 6412 B14R2.269 CN1CCOC1c2cccc(Cl)c2 Amb6382889 [0,1,0,1,0,0|2,0,0]=4 6413 B14R2.269 CN1CCOC1c2cccc(O)c2 Amb17335298 [0,1,0,1,0,0|2,0,0]=4 6414 B14R2.269 C[C@@H]1CCN[C@H]1c2cccc(Br)c2 Amb18156533 [0,1,0,1,0,0|2,0,0]=4 6415 B14R2.269 C[C@@H]1CCN[C@H]1c2cccc(Cl)c2 Amb18189121 [0,1,0,1,0,0|2,0,0]=4 6416 B14R2.269 C[C@@H]1CCN[C@H]1c2cccc(F)c2 Amb18194452 [0,1,0,1,0,0|2,0,0]=4 6417 B14R2.269 C[C@@H]1CCN[C@H]1c2cccc(O)c2 Amb18195880 [0,1,0,1,0,0|2,0,0]=4 6418 B14R2.269 Cc1cccc(C2CCNC2C)c1 Amb18279903 [0,1,0,1,0,0|1,0,0]=3 6419 B14R2.269 Cc1cccc(C2OCCN2C)c1 Amb17335177 [0,1,0,1,0,0|2,0,0]=4 6420 B14R2.269 Cc1cccc([C@@H]2NCC[C@H]2C)c1 Amb18197092 [0,1,0,1,0,0|2,0,0]=4 6421 B14R2.269 NC1CCOC1c2cccc(Cl)c2 Amb27759239 [0,1,0,1,0,0|2,0,0]=4 6422 B14R2.269 NC1CCOC1c2cccc(F)c2 Amb28282172 [0,1,0,1,0,0|2,0,0]=4 6423 B14R2.1038 CCC1CC1(N)c2cccc(C)c2 Amb24605563 [0,1,0,1,0,0|2,0,0]=4 6424 B14R2.1038 CCC1CC1(N)c2cccc(C)c2 Amb33473717 [0,1,0,1,0,0|2,0,0]=4 6425 B14R2.1038 CCC1CC1(O)C2=CC(=O)NC=C2 Amb28060469 [0,1,0,1,0,0|2,0,0]=4 6426 B14R2.1038 CCC1CC1(O)c2cccc(C)c2 Amb27258209 [0,1,0,1,0,0|1,0,0]=3 6427 B14R2.1038 CCC1CC1(O)c2cncc(F)c2 Amb27869628 [0,1,0,1,0,0|2,0,0]=4 6428 B14R2.1038 CC[C@@H]1C[C@@]1(N)c2cccc(C)c2 Amb27631903 [0,1,0,1,0,0|2,0,0]=4 6429 B14R2.1038 CC[C@@H]1C[C@@]1(N)c2cccc(C)c2 Amb33473722 [0,1,0,1,0,0|2,0,0]=4 6430 B14R2.1038 CC[C@H]1C[C@@]1(N)c2cccc(C)c2 Amb26459679 [0,1,0,1,0,0|2,0,0]=4 6431 B14R2.1038 CC[C@H]1C[C@@]1(N)c2cccc(C)c2 Amb33172778 [0,1,0,1,0,0|2,0,0]=4 6432 B14R2.2151 CCC1Oc2c(Cl)cccc2C1O Amb27452142 [0,1,0,1,0,0|2,0,0]=4 6433 B14R2.4513 CC1SCc2ccc(F)cc2C1O Amb27661628 [0,1,0,1,0,0|1,0,0]=3 6434 B14R2.4513 C[C@H]1CCc2ccc(F)cc2[C@@H]1N Amb28135389 [0,1,0,1,0,0|2,0,0]=4 6435 B14R2.4513 Cc1ccc2c(c1)[C@H](N)C(C)CC2 Amb27814427 [0,1,0,1,0,0|2,0,0]=4 6436 B14R2.4513 Cc1ccc2c(c1)[C@H](N)[C@H](C)CC2 Amb27420095 [0,1,0,1,0,0|2,0,0]=4 6437 B14R2.4513 NC1CCc2ccc(Br)cc2C1O Amb2383074 [0,1,0,1,0,0|2,0,0]=4 6438 B14R2.4513 NC1CCc2ccc(O)cc2C1O Amb18128412 [0,1,0,1,0,0|2,0,0]=4 6439 B14R2.4513 N[C@H]1CCc2ccc(O)cc2[C@H]1O Amb27476181 [0,1,0,1,0,0|2,0,0]=4 6440 B14R2.8038 CC1CCc2c(F)cccc2C1N Amb18561722 [0,1,0,1,0,0|2,0,0]=4 6441 B14R2.8038 Cc1cccc2c1C=CC(C)C2O Amb28190270 [0,1,0,1,0,0|1,0,1]=4 6442 B14R2.8038 NC1CCc2c(F)cccc2C1O Amb2383078 [0,1,0,1,0,0|2,0,0]=4 6443 B14R2.8038 N[C@H]1CCc2c(O)cccc2[C@@H]1O Amb27252291 [0,1,0,1,0,0|2,0,0]=4 6444 B14R2.8038 Oc1cccc2c1CC[C@H](O)[C@H]2O Amb28057547 [0,1,0,1,0,0|2,0,0]=4 6445 B14R2.9035 CC1CC1C(N)c2cccc(Br)c2 Amb35626210 [0,1,0,1,0,0|2,0,0]=4 6446 B14R2.9035 CC1CC1C(N)c2cccc(F)c2 Amb27866027 [0,1,0,1,0,0|2,0,0]=4 6447 B14R2.9035 CC1CC1C(O)c2cccc(Br)c2 Amb30021899 [0,1,0,1,0,0|1,0,0]=3 6448 B14R2.9035 CC1CC1C(O)c2cccc(Cl)c2 Amb27779569 [0,1,0,1,0,0|1,0,0]=3 6449 B14R2.9035 CC1CC1C(O)c2cccc(F)c2 Amb27180243 [0,1,0,1,0,0|1,0,0]=3 6450 B14R2.9035 Cc1cncc(C(O)C2CC2C)c1 Amb27216553 [0,1,0,1,0,0|2,0,0]=4 6451 B14R2.20878 CC1CCC1(N)c2cccc(Cl)c2 Amb27644504 [0,1,0,1,0,0|2,0,0]=4 6452 B14R2.20878 CC1CCC1(O)c2cccc(Br)c2 Amb35591759 [0,1,0,1,0,0|1,0,0]=3 6453 B14R2.20878 Cc1cncc(C2(O)CCC2C)c1 Amb27476690 [0,1,0,1,0,0|2,0,0]=4 6454 B14R2.28485 CC1c2c(F)cccc2C(N)C1C Amb27415962 [0,1,0,1,0,0|2,0,0]=4 6455 B14R2.28485 Cc1cccc2c1C(C)C(C)C2Cl Amb27255861 [0,1,0,1,0,0|2,0,0]=4 6456 B14R2.28485 Cc1cccc2c1C(C)C(C)C2O Amb27415912 [0,1,0,1,0,0|1,0,0]=3 6457 B14R2.29767 Cc1cccc(C(N)C2CCC2)c1 Amb22642962 [0,1,0,1,0,0|2,0,0]=4 6458 B14R2.29767 Cc1cccc(C(N)C2CCC2)c1 Amb32662118 [0,1,0,1,0,0|2,0,0]=4 6459 B14R2.29767 Cc1cccc(C(O)C2CSC2)c1 Amb29852088 [0,1,0,1,0,0|2,0,0]=4 6460 B14R2.29767 Cc1cncc(C(O)C2CCC2)c1 Amb27173011 [0,1,0,1,0,0|2,0,0]=4 6461 B14R2.29767 NC(c1cccc(Br)c1)C2CCC2 Amb27811897 [0,1,0,1,0,0|2,0,0]=4 6462 B14R2.29767 NC(c1cccc(F)c1)C2CCC2 Amb22642954 [0,1,0,1,0,0|2,0,0]=4 6463 B14R2.29767 N[C@@H](c1cccc(Cl)c1)C2CCC2 Amb27171250 [0,1,0,1,0,0|2,0,0]=4 6464 B14R2.29767 N[C@@H](c1cccc(F)c1)C2CCC2 Amb27206650 [0,1,0,1,0,0|2,0,0]=4 6465 B14R2.29767 N[C@@H](c1cccc(I)c1)C2CCC2 Amb28047026 [0,1,0,1,0,0|2,0,0]=4 6466 B14R2.29767 N[C@@H](c1cccc(O)c1)C2CCC2 Amb27406120 [0,1,0,1,0,0|2,0,0]=4 6467 B14R2.29767 N[C@@H](c1cccc(S)c1)C2CCC2 Amb27807552 [0,1,0,1,0,0|2,0,0]=4 6468 B14R2.29767 Nc1cccc(C(O)C2CCC2)c1 Amb28047536 [0,1,0,1,0,0|1,0,0]=3 6469 B14R2.29767 Nc1cccc(C(O)C2CCC2)n1 Amb35622366 [0,1,0,1,0,0|2,0,0]=4 6470 B14R2.29767 OC(c1cccc(Br)c1)C2CCC2 Amb28125041 [0,1,0,1,0,0|1,0,0]=3 6471 B14R2.29767 OC(c1cccc(Br)c1)C2CNC2 Amb27870450 [0,1,0,1,0,0|2,0,0]=4 6472 B14R2.29767 OC(c1cccc(Br)c1)C2CSC2 Amb29879401 [0,1,0,1,0,0|2,0,0]=4 6473 B14R2.29767 OC(c1cccc(Cl)c1)C2CSC2 Amb29862804 [0,1,0,1,0,0|2,0,0]=4 6474 B14R2.29767 OC(c1cccc(F)c1)C2CCC2 Amb27187416 [0,1,0,1,0,0|1,0,0]=3 6475 B14R2.29767 OC(c1cccc(F)c1)C2CSC2 Amb29862773 [0,1,0,1,0,0|2,0,0]=4 6476 B14R2.29767 OC(c1cccc(I)c1)C2CNC2 Amb27768868 [0,1,0,1,0,0|2,0,0]=4 6477 B14R2.29767 OC(c1cncc(Cl)c1)C2CCC2 Amb27817928 [0,1,0,1,0,0|2,0,0]=4 6478 B14R2.29767 O[C@H](c1cccc(Cl)c1)C2CCC2 Amb27162253 [0,1,0,1,0,0|1,0,0]=3 6479 B14R2.29783 CC1(C(N)c2cccc(Br)c2)CC1 Amb35626221 [0,1,0,1,0,0|2,0,0]=4 6480 B14R2.29783 CC1(C(O)c2cccc(Br)c2)CC1 Amb30021900 [0,1,0,1,0,0|1,0,0]=3 6481 B14R2.29783 CC1(C(O)c2cccc(Cl)c2)N=N1 Amb33457230 [0,1,0,1,0,0|1,0,1]=4 6482 B14R2.29783 CC1(C(O)c2cccc(F)c2)CC1 Amb27609395 [0,1,0,1,0,0|1,0,0]=3 6483 B14R2.29783 CC1(C(O)c2cncc(F)c2)CC1 Amb28123996 [0,1,0,1,0,0|2,0,0]=4 6484 B14R2.29783 Cc1cccc(C(O)C2(N)CC2)c1 Amb29875630 [0,1,0,1,0,0|2,0,0]=4 6485 B14R2.29783 NC1(C(O)c2cccc(Br)c2)CC1 Amb32651506 [0,1,0,1,0,0|2,0,0]=4 6486 B14R2.29783 NC1(C(O)c2cccc(Cl)c2)CC1 Amb32651504 [0,1,0,1,0,0|2,0,0]=4 6487 B14R2.29783 NC1(C(O)c2cccc(F)c2)CC1 Amb32651507 [0,1,0,1,0,0|2,0,0]=4 6488 B14R2.24 BrC1CCOCC1c2ccccc2 Amb27786504 [0,1,0,1,0,0|2,0,0]=4 6489 B14R2.24 CC1CCCNC1c2ccccc2 Amb6271697 [0,1,0,1,0,0|2,0,0]=4 6490 B14R2.24 CC1CCNCC1c2ccccc2 Amb26855487 [0,1,0,1,0,0|2,0,0]=4 6491 B14R2.24 CC1CCNCC1c2ccccc2 Amb30051609 [0,1,0,1,0,0|2,0,0]=4 6492 B14R2.24 CC1CNCCC1c2ccccc2 Amb19148751 [0,1,0,1,0,0|1,0,0]=3 6493 B14R2.24 CC1CNCCC1c2cccnc2 Amb27664339 [0,1,0,1,0,0|2,0,0]=4 6494 B14R2.24 CC1CNCCN1c2ccccc2 Amb4017565 [0,1,0,1,0,0|2,0,0]=4 6495 B14R2.24 CC1COCOC1c2ccccc2 Amb28123545 [0,1,0,1,0,0|1,0,0]=3 6496 B14R2.24 CC1NCCCC1c2ccccc2 Amb18647927 [0,1,0,1,0,0|1,0,0]=3 6497 B14R2.24 CC1NCCOC1c2ccccc2 Amb6373978 [0,1,0,1,0,0|0,0,0]=2 6498 B14R2.24 CC1NCCOC1c2ccncc2 Amb18195195 [0,1,0,1,0,0|1,0,0]=3 6499 B14R2.24 CC1OCCNC1c2ccccc2 Amb18065713 [0,1,0,1,0,0|2,0,0]=4 6500 B14R2.24 CC1SCCNC1c2ccccc2 Amb19374434 [0,1,0,1,0,0|2,0,0]=4 6501 B14R2.24 C[C@@H]1CCCN[C@@H]1c2ccccc2 Amb27252172 [0,1,0,1,0,0|2,0,0]=4 6502 B14R2.24 C[C@@H]1CCNC[C@@H]1c2ccccc2 Amb32682441 [0,1,0,1,0,0|2,0,0]=4 6503 B14R2.24 C[C@@H]1CCNC[C@@H]1c2ccccc2 Amb32682462 [0,1,0,1,0,0|2,0,0]=4 6504 B14R2.24 C[C@@H]1NCCO[C@@H]1c2ccccc2 Amb27985899 [0,1,0,1,0,0|0,0,0]=2 6505 B14R2.24 C[C@@H]1NCCO[C@H]1c2ccccc2 Amb27858584 [0,1,0,1,0,0|0,0,0]=2 6506 B14R2.24 C[C@H]1CCCN[C@H]1c2ccccc2 Amb28325679 [0,1,0,1,0,0|2,0,0]=4 6507 B14R2.24 C[C@H]1NCCO[C@@H]1c2ccccc2 Amb27259326 [0,1,0,1,0,0|0,0,0]=2 6508 B14R2.24 ClC1COCOC1c2ccccc2 Amb25187890 [0,1,0,1,0,0|2,0,0]=4 6509 B14R2.24 Cl[C@@H]1CCCO[C@H]1c2ccccc2 Amb27444641 [0,1,0,1,0,0|2,0,0]=4 6510 B14R2.24 FC1CNCCC1c2ccccc2 Amb32412691 [0,1,0,1,0,0|2,0,0]=4 6511 B14R2.24 NC1CCOCC1c2ccccc2 Amb27199871 [0,1,0,1,0,0|2,0,0]=4 6512 B14R2.24 NC1CNCCC1c2ccccc2 Amb26448588 [0,1,0,1,0,0|2,0,0]=4 6513 B14R2.24 O=C1NCCOC1c2ccccc2 Amb28243451 [0,1,0,1,0,0|1,0,1]=4 6514 B14R2.24 OC1C=CCOC1c2ccccc2 Amb27394757 [0,1,0,1,0,0|2,0,0]=4 6515 B14R2.24 OC1CNCCC1c2ccccc2 Amb18648066 [0,1,0,1,0,0|2,0,0]=4 6516 B14R2.24 OC1CNCCC1c2ccccc2 Amb34151968 [0,1,0,1,0,0|2,0,0]=4 6517 B14R2.24 O[C@@H]1C=CCO[C@H]1c2ccccc2 Amb27853774 [0,1,0,1,0,0|2,0,0]=4 6518 B14R2.24 O[C@H]1C=CCO[C@H]1c2ccccc2 Amb28207242 [0,1,0,1,0,0|2,0,0]=4 6519 B14R2.24 O[C@H]1CNCC[C@@H]1c2ccccc2 Amb34913055 [0,1,0,1,0,0|2,0,0]=4 6520 B14R2.35 CNCC1CCC1c2cccnc2 Amb28346518 [0,1,0,1,0,0|2,0,0]=4 6521 B14R2.35 CNCC1CCN1c2ccccc2 Amb35581292 [0,1,0,1,0,0|2,0,0]=4 6522 B14R2.44 CC1c2ccccc2CC1CCN Amb35671954 [0,1,0,1,0,0|2,0,0]=4 6523 B14R2.44 CCCC1Cc2ccccc2C1Br Amb28207606 [0,1,0,1,0,0|2,0,0]=4 6524 B14R2.44 CCCC1Oc2ccccc2C1O Amb27797958 [0,1,0,1,0,0|2,0,0]=4 6525 B14R2.44 CCNC1Cc2ccccc2C1C Amb29855875 [0,1,0,1,0,0|1,0,0]=3 6526 B14R2.44 CCN[C@@H]1Cc2ccccc2[C@@H]1O Amb27848085 [0,1,0,1,0,0|0,0,0]=2 6527 B14R2.44 CCOC1Cc2ccccc2C1O Amb18809063 [0,1,0,1,0,0|1,0,0]=3 6528 B14R2.44 CNCC1Cc2ccccc2C1C Amb18127536 [0,1,0,1,0,0|1,0,0]=3 6529 B14R2.44 CONC1Cc2ccccc2C1C Amb29855876 [0,1,0,1,0,0|1,0,0]=3 6530 B14R2.44 CONC1Cc2ccccc2C1O Amb28064973 [0,1,0,1,0,0|0,0,0]=2 6531 B14R2.44 N#CCC1Cc2ccccc2C1O Amb27766589 [0,1,0,1,0,0|1,0,1]=4 6532 B14R2.44 N#CSC1Cc2ccccc2C1O Amb27174727 [0,1,0,1,0,0|1,0,1]=4 6533 B14R2.44 NC1c2ccccc2CC1CCO Amb27179761 [0,1,0,1,0,0|2,0,0]=4 6534 B14R2.44 NCCC1Cc2ccccc2C1O Amb18824971 [0,1,0,1,0,0|1,0,0]=3 6535 B14R2.44 NCCC1Oc2ccccc2C1O Amb18194704 [0,1,0,1,0,0|2,0,0]=4 6536 B14R2.44 NCCC1Sc2ccccc2C1O Amb18189298 [0,1,0,1,0,0|2,0,0]=4 6537 B14R2.44 O=CNC1Cc2ccccc2C1O Amb27791913 [0,1,0,1,0,0|0,0,1]=3 6538 B14R2.44 O=CN[C@H]1Cc2ccccc2[C@@H]1O Amb27788473 [0,1,0,1,0,0|0,0,1]=3 6539 B14R2.44 O=COC1Cc2ccccc2C1O Amb17594527 [0,1,0,1,0,0|1,0,1]=4 6540 B14R2.44 O=CO[C@H]1Cc2ccccc2[C@@H]1O Amb27220562 [0,1,0,1,0,0|1,0,1]=4 6541 B14R2.44 O=CO[C@H]1Cc2ccccc2[C@H]1O Amb17673664 [0,1,0,1,0,0|1,0,1]=4 6542 B14R2.44 OC1c2ccccc2CC1CCCl Amb27270899 [0,1,0,1,0,0|1,0,0]=3 6543 B14R2.44 [N-]=[N+]=N[C@@H]1Cc2ccccc2[C@H]1O Amb27858975 [0,1,0,1,0,0|1,0,1]=4 6544 B14R2.114 CC(C1=NCCN1)c2ccccc2 Amb27790838 [0,1,0,1,0,0|1,0,1]=4 6545 B14R2.114 CC(c1ccccc1)C2CCCN2 Amb23536676 [0,1,0,1,0,0|1,0,0]=3 6546 B14R2.114 CC(c1ccccc1)C2CCNC2 Amb18197082 [0,1,0,1,0,0|1,0,0]=3 6547 B14R2.114 CC(c1ccccc1)C2CCNC2 Amb33482692 [0,1,0,1,0,0|1,0,0]=3 6548 B14R2.114 CC(c1ccccc1)C2NCCS2 Amb18321178 [0,1,0,1,0,0|1,0,0]=3 6549 B14R2.114 CC(c1ccccc1)C2OCCO2 Amb575774 [0,1,0,1,0,0|2,0,0]=4 6550 B14R2.114 CC(c1cccnc1)C2CCNC2 Amb25703240 [0,1,0,1,0,0|2,0,0]=4 6551 B14R2.114 CC(c1cccnc1)C2CCNC2 Amb32665252 [0,1,0,1,0,0|2,0,0]=4 6552 B14R2.114 CC(c1ccncc1)C2CCNC2 Amb27593710 [0,1,0,1,0,0|2,0,0]=4 6553 B14R2.114 CN(c1ccccc1)C2CCNC2 Amb25069354 [0,1,0,1,0,0|2,0,0]=4 6554 B14R2.114 CN(c1ccccc1)C2CCNC2 Amb34158290 [0,1,0,1,0,0|2,0,0]=4 6555 B14R2.114 FC(c1ccccc1)C2CCNC2 Amb28248712 [0,1,0,1,0,0|1,0,0]=3 6556 B14R2.114 NC(c1ccccc1)C2CCCC2 Amb33548092 [0,1,0,1,0,0|2,0,0]=4 6557 B14R2.114 NC(c1ccccc1)C2CCCC2 Amb9717938 [0,1,0,1,0,0|2,0,0]=4 6558 B14R2.114 NC(c1ccccc1)C2CCCO2 Amb10609099 [0,1,0,1,0,0|2,0,0]=4 6559 B14R2.114 NC(c1ccccc1)C2CCCO2 Amb9717761 [0,1,0,1,0,0|2,0,0]=4 6560 B14R2.114 NC(c1ccccc1)C2CCNC2 Amb18196474 [0,1,0,1,0,0|1,0,0]=3 6561 B14R2.114 NC(c1ccccc1)C2CCOC2 Amb18952434 [0,1,0,1,0,0|2,0,0]=4 6562 B14R2.114 NC(c1ccccc1)C2CCOC2 Amb33291311 [0,1,0,1,0,0|2,0,0]=4 6563 B14R2.114 N[C@H](c1ccccc1)C2CCCC2 Amb27788456 [0,1,0,1,0,0|2,0,0]=4 6564 B14R2.114 O=C(c1ccccc1)C2CCCN2 Amb17988466 [0,1,0,1,0,0|0,0,2]=4 6565 B14R2.114 O=C(c1ccccc1)C2CCCN2 Amb5739645 [0,1,0,1,0,0|0,0,2]=4 6566 B14R2.114 O=C(c1ccccc1)C2CCNC2 Amb19889904 [0,1,0,1,0,0|0,0,2]=4 6567 B14R2.114 O=C(c1ccccc1)C2CCNC2 Amb21858469 [0,1,0,1,0,0|0,0,2]=4 6568 B14R2.114 O=C(c1ccccc1)[C@@H]2CCCN2 Amb24743535 [0,1,0,1,0,0|0,0,2]=4 6569 B14R2.114 O=C(c1ccccc1)[C@@H]2CCCN2 Amb28600367 [0,1,0,1,0,0|0,0,2]=4 6570 B14R2.114 O=C(c1ccccc1)[C@@H]2CCNC2 Amb29891716 [0,1,0,1,0,0|0,0,2]=4 6571 B14R2.114 O=C(c1ccccc1)[C@H]2CCCN2 Amb25175805 [0,1,0,1,0,0|0,0,2]=4 6572 B14R2.114 O=C(c1ccccc1)[C@H]2CCCN2 Amb28839709 [0,1,0,1,0,0|0,0,2]=4 6573 B14R2.114 O=C(c1ccccc1)[C@H]2CCNC2 Amb29889928 [0,1,0,1,0,0|0,0,2]=4 6574 B14R2.114 O=S(c1ccccc1)C2CCNC2 Amb27800390 [0,1,0,1,0,0|1,0,1]=4 6575 B14R2.114 OC(C1=CCCO1)c2ccccc2 Amb28281111 [0,1,0,1,0,0|1,0,1]=4 6576 B14R2.114 OC(C1=NCCN1)c2ccccc2 Amb27608669 [0,1,0,1,0,0|0,0,1]=3 6577 B14R2.114 OC(C1=NCCS1)c2ccccc2 Amb28065880 [0,1,0,1,0,0|0,0,2]=4 6578 B14R2.114 OC(c1ccccc1)C2C=CCC2 Amb27218878 [0,1,0,1,0,0|1,0,0]=3 6579 B14R2.114 OC(c1ccccc1)C2CCCC2 Amb17138792 [0,1,0,1,0,0|1,0,0]=3 6580 B14R2.114 OC(c1ccccc1)C2CCCN2 Amb17138819 [0,1,0,1,0,0|0,0,0]=2 6581 B14R2.114 OC(c1ccccc1)C2CCCN2 Amb33545282 [0,1,0,1,0,0|0,0,0]=2 6582 B14R2.114 OC(c1ccccc1)C2CCNC2 Amb27841619 [0,1,0,1,0,0|0,0,0]=2 6583 B14R2.114 OC(c1ccccc1)C2CCOC2 Amb18790941 [0,1,0,1,0,0|1,0,0]=3 6584 B14R2.114 OC(c1ccccc1)C2COCO2 Amb28185143 [0,1,0,1,0,0|1,0,0]=3 6585 B14R2.114 OC(c1ccccc1)[C@@H]2CCCN2 Amb27608662 [0,1,0,1,0,0|0,0,0]=2 6586 B14R2.114 OC(c1ccccc1)[C@@H]2CCNC2 Amb30039178 [0,1,0,1,0,0|0,0,0]=2 6587 B14R2.114 OC(c1ccccc1)[C@H]2CCNC2 Amb35662315 [0,1,0,1,0,0|0,0,0]=2 6588 B14R2.114 OC(c1ccccn1)C2CCCO2 Amb28190198 [0,1,0,1,0,0|2,0,0]=4 6589 B14R2.114 OC(c1cccnc1)C2CCCC2 Amb17233268 [0,1,0,1,0,0|2,0,0]=4 6590 B14R2.114 OC(c1cccnc1)C2CCNC2 Amb35583756 [0,1,0,1,0,0|1,0,0]=3 6591 B14R2.114 OC(c1cccnc1)[C@@H]2CCCN2 Amb27397547 [0,1,0,1,0,0|1,0,0]=3 6592 B14R2.114 OC(c1cccnc1)[C@@H]2CCNC2 Amb29891437 [0,1,0,1,0,0|1,0,0]=3 6593 B14R2.114 OC(c1cccnc1)[C@H]2CCCN2 Amb29891703 [0,1,0,1,0,0|1,0,0]=3 6594 B14R2.114 OC(c1cccnc1)[C@H]2CCNC2 Amb35662395 [0,1,0,1,0,0|1,0,0]=3 6595 B14R2.114 OC(c1ccncc1)C2C=CCN2 Amb27949799 [0,1,0,1,0,0|1,0,1]=4 6596 B14R2.114 OC(c1ccncc1)C2CCCC2 Amb18795916 [0,1,0,1,0,0|2,0,0]=4 6597 B14R2.114 OC(c1ccncc1)C2CCCN2 Amb28239724 [0,1,0,1,0,0|1,0,0]=3 6598 B14R2.114 OC(c1ccncc1)C2CCOC2 Amb28242241 [0,1,0,1,0,0|2,0,0]=4 6599 B14R2.114 OC(c1cnccn1)C2CCCN2 Amb28242409 [0,1,0,1,0,0|2,0,0]=4 6600 B14R2.114 OC(c1cnccn1)C2CCNC2 Amb29875295 [0,1,0,1,0,0|2,0,0]=4 6601 B14R2.114 OC(c1cnccn1)[C@@H]2CCCN2 Amb30039068 [0,1,0,1,0,0|2,0,0]=4 6602 B14R2.114 OC(c1cnccn1)[C@@H]2CCNC2 Amb35659925 [0,1,0,1,0,0|2,0,0]=4 6603 B14R2.114 OC(c1cnccn1)[C@H]2CCCN2 Amb29891565 [0,1,0,1,0,0|2,0,0]=4 6604 B14R2.114 OC(c1cnccn1)[C@H]2CCNC2 Amb29889949 [0,1,0,1,0,0|2,0,0]=4 6605 B14R2.114 OC(c1cncnc1)C2CCNC2 Amb35620648 [0,1,0,1,0,0|2,0,0]=4 6606 B14R2.114 OC(c1cncnc1)[C@@H]2CCCN2 Amb29891536 [0,1,0,1,0,0|2,0,0]=4 6607 B14R2.114 OC(c1cncnc1)[C@@H]2CCNC2 Amb29893160 [0,1,0,1,0,0|2,0,0]=4 6608 B14R2.114 OC(c1cncnc1)[C@H]2CCCN2 Amb30039093 [0,1,0,1,0,0|2,0,0]=4 6609 B14R2.114 OC(c1cncnc1)[C@H]2CCNC2 Amb35663904 [0,1,0,1,0,0|2,0,0]=4 6610 B14R2.114 O[C@@H](C1=NCCN1)c2ccccc2 Amb27491000 [0,1,0,1,0,0|0,0,1]=3 6611 B14R2.114 O[C@@H](c1ccccc1)[C@@H]2CCCN2 Amb27244166 [0,1,0,1,0,0|0,0,0]=2 6612 B14R2.114 O[C@@H](c1ccccc1)[C@H]2CCCN2 Amb25238672 [0,1,0,1,0,0|0,0,0]=2 6613 B14R2.114 O[C@@H](c1ccccc1)[C@H]2CCCN2 Amb32667633 [0,1,0,1,0,0|0,0,0]=2 6614 B14R2.114 O[C@H](c1ccccc1)[C@@H]2CCCN2 Amb25294762 [0,1,0,1,0,0|0,0,0]=2 6615 B14R2.114 O[C@H](c1ccccc1)[C@@H]2CCCN2 Amb32667652 [0,1,0,1,0,0|0,0,0]=2 6616 B14R2.187 CSC1C(Cl)C1(C)c2ccccc2 Amb28120098 [0,1,0,1,0,0|2,0,0]=4 6617 B14R2.279 CC1CCCc2ccccc2C1N Amb18943813 [0,1,0,1,0,0|2,0,0]=4 6618 B14R2.279 CC1CNCc2ccccc2S1=O Amb27795200 [0,1,0,1,0,0|1,0,1]=4 6619 B14R2.279 CC1CSCc2ccccc2C1O Amb27757474 [0,1,0,1,0,0|1,0,0]=3 6620 B14R2.279 NC1CCOc2ccccc2C1O Amb22035228 [0,1,0,1,0,0|2,0,0]=4 6621 B14R2.279 N[C@@H]1CCOc2ccccc2[C@H]1O Amb27788441 [0,1,0,1,0,0|2,0,0]=4 6622 B14R2.279 N[C@H]1CCCc2ccccc2[C@@H]1O Amb27791781 [0,1,0,1,0,0|2,0,0]=4 6623 B14R2.279 N[C@H]1CCOc2ccccc2[C@@H]1O Amb27774875 [0,1,0,1,0,0|2,0,0]=4 6624 B14R2.279 O[C@H]1CCCc2ccccc2[C@@H]1O Amb28319928 [0,1,0,1,0,0|2,0,0]=4 6625 B14R2.279 O[C@H]1CCCc2ccccc2[C@H]1O Amb28139888 [0,1,0,1,0,0|2,0,0]=4 6626 B14R2.279 O[C@H]1CCOc2ccccc2[C@H]1O Amb28205961 [0,1,0,1,0,0|2,0,0]=4 6627 B14R2.317 CC1CCCC1(N)c2ccccc2 Amb28041736 [0,1,0,1,0,0|2,0,0]=4 6628 B14R2.317 CC1CCCC1(O)c2ccccc2 Amb26628717 [0,1,0,1,0,0|1,0,0]=3 6629 B14R2.317 CC1CNCC1(C)c2ccccc2 Amb27856204 [0,1,0,1,0,0|1,0,0]=3 6630 B14R2.317 CC1CNCC1(C)c2ccccn2 Amb28056532 [0,1,0,1,0,0|2,0,0]=4 6631 B14R2.317 CC1CNCC1(C)c2cccnc2 Amb27475347 [0,1,0,1,0,0|2,0,0]=4 6632 B14R2.317 CC1CNCC1(C)c2ccncc2 Amb28056533 [0,1,0,1,0,0|2,0,0]=4 6633 B14R2.317 CC1COCC1(O)c2ccccc2 Amb29877586 [0,1,0,1,0,0|1,0,0]=3 6634 B14R2.317 CC1COCC1(O)c2cccnc2 Amb29877592 [0,1,0,1,0,0|2,0,0]=4 6635 B14R2.317 CC1CSCC1(O)c2ccccc2 Amb26994970 [0,1,0,1,0,0|1,0,0]=3 6636 B14R2.317 CC1NCCC1(O)c2ccccc2 Amb27259241 [0,1,0,1,0,0|0,0,0]=2 6637 B14R2.317 CC1NCCC1(O)c2cccnc2 Amb27449842 [0,1,0,1,0,0|1,0,0]=3 6638 B14R2.317 CC1NCCC1(O)c2ccncc2 Amb27603546 [0,1,0,1,0,0|1,0,0]=3 6639 B14R2.317 CC1NCCC1(O)c2cncnc2 Amb27857223 [0,1,0,1,0,0|2,0,0]=4 6640 B14R2.317 CC1OCCC1(O)c2ccccc2 Amb28066255 [0,1,0,1,0,0|1,0,0]=3 6641 B14R2.317 CC1SCCC1(O)c2ccccc2 Amb26921619 [0,1,0,1,0,0|1,0,0]=3 6642 B14R2.317 C[C@@H]1CCC[C@@]1(C)c2ccccc2 Amb26431459 [0,1,0,1,0,0|2,0,0]=4 6643 B14R2.317 C[C@H]1CCC[C@@]1(C)c2ccccc2 Amb24589220 [0,1,0,1,0,0|2,0,0]=4 6644 B14R2.317 N[C@@H]1CCC[C@]1(O)c2ccccc2 Amb27983348 [0,1,0,1,0,0|2,0,0]=4 6645 B14R2.317 OC1CCCC1(O)c2ccccc2 Amb28064165 [0,1,0,1,0,0|2,0,0]=4 6646 B14R2.422 CC1CC(C(Br)c2ccccc2)C1 Amb29884976 [0,1,0,1,0,0|2,0,0]=4 6647 B14R2.422 CC1CC(C(Cl)c2ccccc2)C1 Amb29884971 [0,1,0,1,0,0|2,0,0]=4 6648 B14R2.422 CC1CC(C(N)c2ccccc2)C1 Amb29885026 [0,1,0,1,0,0|2,0,0]=4 6649 B14R2.422 CC1CC(C(O)c2ccccc2)C1 Amb23590251 [0,1,0,1,0,0|1,0,0]=3 6650 B14R2.422 CC1CC(C(O)c2cccnc2)C1 Amb35628349 [0,1,0,1,0,0|2,0,0]=4 6651 B14R2.422 NC1CC(C(O)c2ccccc2)C1 Amb35625198 [0,1,0,1,0,0|1,0,0]=3 6652 B14R2.422 NC1CC(C(O)c2cccnc2)C1 Amb35625270 [0,1,0,1,0,0|2,0,0]=4 6653 B14R2.422 O=C1CC(C(O)c2ccccc2)N1 Amb28367722 [0,1,0,1,0,0|0,0,1]=3 6654 B14R2.433 CC1CC(=O)C1(O)c2ccccc2 Amb28381227 [0,1,0,1,0,0|1,0,1]=4 6655 B14R2.433 C[C@H]1NC(=O)[C@@]1(Cl)c2ccccc2 Amb27268509 [0,1,0,1,0,0|1,0,1]=4 6656 B14R2.564 CNCC1CC1(C)c2cccnc2 Amb18995737 [0,1,0,1,0,0|2,0,0]=4 6657 B14R2.564 NCCC1CC1(F)c2ccccc2 Amb27646393 [0,1,0,1,0,0|2,0,0]=4 6658 B14R2.564 N[C@]1(c2ccccc2)C[C@H]1CCO Amb27484782 [0,1,0,1,0,0|2,0,0]=4 6659 B14R2.598 CC1CC(=O)OC1c2ccccc2 Amb27429192 [0,1,0,1,0,0|1,0,1]=4 6660 B14R2.598 CC1CC(c2ccccc2)C(C)N1 Amb19375040 [0,1,0,1,0,0|1,0,0]=3 6661 B14R2.598 CC1CC(c2ccccc2)C(C)N1 Amb22059523 [0,1,0,1,0,0|1,0,0]=3 6662 B14R2.598 CC1CC(c2ccccn2)C(C)N1 Amb27187311 [0,1,0,1,0,0|2,0,0]=4 6663 B14R2.598 CC1CC(c2cccnc2)C(C)N1 Amb27235260 [0,1,0,1,0,0|2,0,0]=4 6664 B14R2.598 CC1CC(c2ccncc2)C(C)N1 Amb28118784 [0,1,0,1,0,0|2,0,0]=4 6665 B14R2.598 CC1N=C(N)OC1c2ccccc2 Amb22055741 [0,1,0,1,0,0|0,0,2]=4 6666 B14R2.598 CC1NC(=O)CC1c2ccccc2 Amb26880847 [0,1,0,1,0,0|1,0,1]=4 6667 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,1,0,1,0,0|0,0,1]=3 6668 B14R2.598 CC1NC(=O)OC1c2ccncc2 Amb25765525 [0,1,0,1,0,0|1,0,1]=4 6669 B14R2.598 CC1NC(=S)OC1c2ccccc2 Amb28143642 [0,1,0,1,0,0|0,0,1]=3 6670 B14R2.598 CC1NC(=S)OC1c2ccccn2 Amb27242332 [0,1,0,1,0,0|1,0,1]=4 6671 B14R2.598 CC1N[C@@H](C)[C@@H](c2ccccc2)O1 Amb27619180 [0,1,0,1,0,0|0,0,0]=2 6672 B14R2.598 CN1CC(N)C(c2ccccc2)C1 Amb18196529 [0,1,0,1,0,0|2,0,0]=4 6673 B14R2.598 CN1CC(N)C(c2ccccc2)C1 Amb20622384 [0,1,0,1,0,0|2,0,0]=4 6674 B14R2.598 CN1C[C@@H](N)[C@H](c2ccccc2)C1 Amb27409746 [0,1,0,1,0,0|2,0,0]=4 6675 B14R2.598 C[C@@H]1CC(O)O[C@H]1c2ccccc2 Amb27852859 [0,1,0,1,0,0|1,0,0]=3 6676 B14R2.598 C[C@@H]1NC(=N)O[C@H]1c2ccccc2 Amb27614345 [0,1,0,1,0,0|0,0,1]=3 6677 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,1,0,1,0,0|0,0,1]=3 6678 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,1,0,1,0,0|0,0,1]=3 6679 B14R2.598 C[C@@H]1NC(=S)S[C@@H]1c2ccccc2 Amb27620474 [0,1,0,1,0,0|0,1,1]=4 6680 B14R2.598 C[C@@H]1N[C@H](C)[C@H](c2ccccc2)S1 Amb28198916 [0,1,0,1,0,0|0,1,0]=3 6681 B14R2.598 C[C@H]1N=C(N)O[C@@H]1c2ccccc2 Amb27666984 [0,1,0,1,0,0|0,0,2]=4 6682 B14R2.598 C[C@H]1NC(=N)O[C@H]1c2ccccc2 Amb26416907 [0,1,0,1,0,0|0,0,1]=3 6683 B14R2.598 C[C@H]1NC(=O)C[C@@H]1c2ccccc2 Amb27978591 [0,1,0,1,0,0|1,0,1]=4 6684 B14R2.598 C[C@H]1NC(=O)O[C@@H]1c2ccccc2 Amb26626803 [0,1,0,1,0,0|0,0,1]=3 6685 B14R2.598 C[C@H]1NC(=O)O[C@H]1c2ccccc2 Amb541248 [0,1,0,1,0,0|0,0,1]=3 6686 B14R2.598 C[C@H]1N[C@H](C)[C@H](c2ccccc2)S1 Amb27635853 [0,1,0,1,0,0|0,1,0]=3 6687 B14R2.690 CC1(C(Br)c2ccccc2)CC1F Amb27214961 [0,1,0,1,0,0|2,0,0]=4 6688 B14R2.690 CC1(C(N)c2ccccc2)CC1F Amb27236143 [0,1,0,1,0,0|2,0,0]=4 6689 B14R2.690 CC1(C(O)c2ccccc2)CC1F Amb27620683 [0,1,0,1,0,0|1,0,0]=3 6690 B14R2.690 CC1CC1(N)C(C)c2ccccc2 Amb29852225 [0,1,0,1,0,0|2,0,0]=4 6691 B14R2.690 CC1CC1(O)C(C)c2ccccc2 Amb28422495 [0,1,0,1,0,0|2,0,0]=4 6692 B14R2.690 CN1NC1(C)C(=O)c2ccccc2 Amb28351404 [0,1,0,1,0,0|0,0,2]=4 6693 B14R2.822 CC1(CCO)CC1c2ccccc2 Amb27443613 [0,1,0,1,0,0|2,0,0]=4 6694 B14R2.15692 CC(c1ccccc1)C2(N)CCC2 Amb33082132 [0,1,0,1,0,0|2,0,0]=4 6695 B14R2.15692 CC(c1ccccc1)C2(O)CNC2 Amb33081876 [0,1,0,1,0,0|2,0,0]=4 6696 B14R2.15692 CC1(C(O)c2ccccc2)CNC1 Amb35587264 [0,1,0,1,0,0|0,0,0]=2 6697 B14R2.15692 CC1(C(O)c2cccnc2)CNC1 Amb35587397 [0,1,0,1,0,0|1,0,0]=3 6698 B14R2.15692 CC1(C(O)c2cnccn2)CNC1 Amb35587428 [0,1,0,1,0,0|2,0,0]=4 6699 B14R2.15692 CC1(C(O)c2cncnc2)CNC1 Amb35587411 [0,1,0,1,0,0|2,0,0]=4 6700 B14R2.15692 NC(c1ccccc1)C2(O)CCC2 Amb22227644 [0,1,0,1,0,0|2,0,0]=4 6701 B14R2.15692 NC(c1ccccc1)C2(O)CNC2 Amb33495302 [0,1,0,1,0,0|2,0,0]=4 6702 B14R2.15692 NC1(C(O)c2ccccc2)CCC1 Amb29875027 [0,1,0,1,0,0|1,0,0]=3 6703 B14R2.15692 NC1(C(O)c2cccnc2)CCC1 Amb29875096 [0,1,0,1,0,0|2,0,0]=4 6704 B14R2.15692 N[C@@H](c1ccccc1)C2(O)CCC2 Amb27653443 [0,1,0,1,0,0|2,0,0]=4 6705 B14R2.15692 N[C@H](c1ccccc1)C2(O)CCC2 Amb28280044 [0,1,0,1,0,0|2,0,0]=4 6706 B14R2.15694 CC(C1CC1)C(Br)c2ccccc2 Amb27641723 [0,1,0,1,0,0|2,0,0]=4 6707 B14R2.15694 C[C@@H]([C@H](O)c1ccccc1)[C@@H]2CO2 Amb27206095 [0,1,0,1,0,0|1,0,0]=3 6708 B14R2.15694 O=C(C(O)c1ccccc1)N2CC2 Amb27261014 [0,1,0,1,0,0|1,0,1]=4 6709 B14R2.15694 O=C([C@@H](O)c1ccccc1)N2CC2 Amb27399349 [0,1,0,1,0,0|1,0,1]=4 6710 B14R2.19306 CC1=C(C)C(CO)c2ccccc21 Amb28321256 [0,1,0,1,0,0|1,0,1]=4 6711 B14R2.19306 CCC1c2ccccc2C(Cl)C1C Amb27255860 [0,1,0,1,0,0|2,0,0]=4 6712 B14R2.19306 CCC1c2ccccc2C(O)C1C Amb28061109 [0,1,0,1,0,0|1,0,0]=3 6713 B14R2.19306 CCN1c2ccccc2[C@@H](C)[C@H]1C Amb27751639 [0,1,0,1,0,0|1,0,0]=3 6714 B14R2.19306 Cc1c(CO)c2ccccc2n1C Amb18224487 [0,1,0,1,0,0|0,0,2]=4 6715 B14R2.14 CCC1CCNC1c2ccccc2 Amb3788233 [0,1,0,1,0,0|2,0,0]=4 6716 B14R2.14 CCC1CNCC1c2ccccc2 Amb24563782 [0,1,0,1,0,0|2,0,0]=4 6717 B14R2.14 CCC1NCCC1c2ccccn2 Amb18285663 [0,1,0,1,0,0|2,0,0]=4 6718 B14R2.14 CCC1NCCC1c2cccnc2 Amb18285679 [0,1,0,1,0,0|2,0,0]=4 6719 B14R2.14 CCC1NCCC1c2ccncc2 Amb18285677 [0,1,0,1,0,0|2,0,0]=4 6720 B14R2.14 CCC1NCCN1c2ccccc2 Amb27778508 [0,1,0,1,0,0|2,0,0]=4 6721 B14R2.14 CCC1NCOC1c2ccccc2 Amb27631242 [0,1,0,1,0,0|0,0,0]=2 6722 B14R2.14 CCN1CCOC1c2ccccc2 Amb3735629 [0,1,0,1,0,0|2,0,0]=4 6723 B14R2.14 CC[C@@H]1CCN[C@H]1c2ccccc2 Amb27437908 [0,1,0,1,0,0|2,0,0]=4 6724 B14R2.14 CC[C@H]1CCN[C@H]1c2ccccc2 Amb27623237 [0,1,0,1,0,0|2,0,0]=4 6725 B14R2.14 CNC1CCCC1c2ccccc2 Amb18286605 [0,1,0,1,0,0|1,0,0]=3 6726 B14R2.14 CNC1CCOC1c2cccnc2 Amb27469100 [0,1,0,1,0,0|1,0,0]=3 6727 B14R2.14 CNC1CCOC1c2cccnc2 Amb32666389 [0,1,0,1,0,0|1,0,0]=3 6728 B14R2.14 CNC1COCC1c2ccccc2 Amb35635689 [0,1,0,1,0,0|0,0,0]=2 6729 B14R2.14 CNC1COCC1c2cccnc2 Amb35635706 [0,1,0,1,0,0|1,0,0]=3 6730 B14R2.14 CNC1COCC1c2cnccn2 Amb35635708 [0,1,0,1,0,0|2,0,0]=4 6731 B14R2.14 CNC1COCC1c2cncnc2 Amb35635707 [0,1,0,1,0,0|2,0,0]=4 6732 B14R2.14 CN[C@@H]1CCC[C@H]1c2ccccc2 Amb27944980 [0,1,0,1,0,0|1,0,0]=3 6733 B14R2.14 CN[C@@H]1CCO[C@H]1c2cccnc2 Amb26652343 [0,1,0,1,0,0|1,0,0]=3 6734 B14R2.14 CN[C@@H]1CCO[C@H]1c2cccnc2 Amb28921062 [0,1,0,1,0,0|1,0,0]=3 6735 B14R2.14 CN[C@H]1CCO[C@@H]1c2cccnc2 Amb27858543 [0,1,0,1,0,0|1,0,0]=3 6736 B14R2.14 COC1CCNC1c2ccccc2 Amb27646662 [0,1,0,1,0,0|2,0,0]=4 6737 B14R2.14 CO[C@@H]1CNC[C@H]1c2ccccc2 Amb27419896 [0,1,0,1,0,0|2,0,0]=4 6738 B14R2.14 ClCC1CCCC1c2ccccc2 Amb27816406 [0,1,0,1,0,0|2,0,0]=4 6739 B14R2.14 NCC1CCCC1c2ccccc2 Amb26980483 [0,1,0,1,0,0|2,0,0]=4 6740 B14R2.14 NCC1CCCC1c2ccccc2 Amb28556058 [0,1,0,1,0,0|2,0,0]=4 6741 B14R2.14 NCC1CCNC1c2ccccc2 Amb18196530 [0,1,0,1,0,0|2,0,0]=4 6742 B14R2.14 NCC1CCOC1c2ccccc2 Amb19335842 [0,1,0,1,0,0|1,0,0]=3 6743 B14R2.14 NCC1CCOC1c2ccccc2 Amb32666106 [0,1,0,1,0,0|1,0,0]=3 6744 B14R2.14 NCC1COCC1c2ccccc2 Amb27624694 [0,1,0,1,0,0|2,0,0]=4 6745 B14R2.14 NCC1OCCC1c2ccccc2 Amb27783508 [0,1,0,1,0,0|2,0,0]=4 6746 B14R2.14 NC[C@@H]1CCO[C@@H]1c2ccccc2 Amb34915745 [0,1,0,1,0,0|1,0,0]=3 6747 B14R2.14 NC[C@@H]1CCO[C@H]1c2ccccc2 Amb25168772 [0,1,0,1,0,0|1,0,0]=3 6748 B14R2.14 NC[C@@H]1CCO[C@H]1c2ccccc2 Amb26838890 [0,1,0,1,0,0|1,0,0]=3 6749 B14R2.14 NC[C@H]1CCO[C@@H]1c2ccccc2 Amb27213895 [0,1,0,1,0,0|1,0,0]=3 6750 B14R2.14 NC[C@H]1CCO[C@@H]1c2ccccc2 Amb28926687 [0,1,0,1,0,0|1,0,0]=3 6751 B14R2.14 NNC1CCCC1c2ccccc2 Amb27595616 [0,1,0,1,0,0|2,0,0]=4 6752 B14R2.14 O=CC1CCOC1c2ccccc2 Amb18127702 [0,1,0,1,0,0|1,0,1]=4 6753 B14R2.14 OCC1CCOC1c2ccccc2 Amb25118296 [0,1,0,1,0,0|1,0,0]=3 6754 B14R2.14 OCC1N=COC1c2ccccc2 Amb27456513 [0,1,0,1,0,0|0,0,2]=4 6755 B14R2.14 OCC1OCCC1c2ccccc2 Amb27604505 [0,1,0,1,0,0|2,0,0]=4 6756 B14R2.14 OC[C@@H]1CCC[C@H]1c2ccccc2 Amb27844164 [0,1,0,1,0,0|2,0,0]=4 6757 B14R2.14 OC[C@@H]1CCN[C@@H]1c2ccccc2 Amb27632392 [0,1,0,1,0,0|2,0,0]=4 6758 B14R2.14 OC[C@@H]1NCC[C@@H]1c2ccccc2 Amb28066697 [0,1,0,1,0,0|1,0,0]=3 6759 B14R2.14 OC[C@@H]1OCC[C@H]1c2ccccc2 Amb27805095 [0,1,0,1,0,0|2,0,0]=4 6760 B14R2.15 CCC1C(N)CC1c2ccccc2 Amb28136235 [0,1,0,1,0,0|2,0,0]=4 6761 B14R2.92 CC1c2ccccc2CCC1CO Amb27972522 [0,1,0,1,0,0|2,0,0]=4 6762 B14R2.92 CCC1C=Cc2ccccc2C1O Amb27484743 [0,1,0,1,0,0|1,0,1]=4 6763 B14R2.92 CCC1CCc2ccccc2C1Cl Amb19080528 [0,1,0,1,0,0|2,0,0]=4 6764 B14R2.92 CCC1NCc2ccccc2C1C Amb18127527 [0,1,0,1,0,0|1,0,0]=3 6765 B14R2.92 CC[C@@H]1C=Cc2ccccc2[C@H]1O Amb27980557 [0,1,0,1,0,0|1,0,1]=4 6766 B14R2.92 CC[C@@H]1CCc2ccccc2[C@@H]1O Amb27207816 [0,1,0,1,0,0|1,0,0]=3 6767 B14R2.92 CC[C@H]1C=Cc2ccccc2[C@@H]1O Amb28318715 [0,1,0,1,0,0|1,0,1]=4 6768 B14R2.92 CC[C@H]1CCc2ccccc2[C@H]1O Amb27270894 [0,1,0,1,0,0|1,0,0]=3 6769 B14R2.92 CNC1CCc2ccccc2C1=O Amb24696513 [0,1,0,1,0,0|0,0,2]=4 6770 B14R2.92 CNC1CCc2ccccc2C1N Amb28069266 [0,1,0,1,0,0|1,0,0]=3 6771 B14R2.92 CNC1CCc2ccccc2C1O Amb27794865 [0,1,0,1,0,0|0,0,0]=2 6772 B14R2.92 CNC1COc2ccccc2C1=O Amb27158025 [0,1,0,1,0,0|0,0,2]=4 6773 B14R2.92 CN[C@@H]1CCc2ccccc2[C@H]1O Amb27630517 [0,1,0,1,0,0|0,0,0]=2 6774 B14R2.92 CN[C@H]1CCc2ccccc2[C@H]1O Amb27216452 [0,1,0,1,0,0|0,0,0]=2 6775 B14R2.92 COC1COc2ccccc2C1N Amb6660437 [0,1,0,1,0,0|2,0,0]=4 6776 B14R2.92 CO[C@@H]1C=Cc2ccccc2[C@@H]1O Amb27197147 [0,1,0,1,0,0|1,0,1]=4 6777 B14R2.92 NC1c2ccccc2CCC1CO Amb28070812 [0,1,0,1,0,0|2,0,0]=4 6778 B14R2.92 NC1c2ccccc2CCC1CO Amb33140987 [0,1,0,1,0,0|2,0,0]=4 6779 B14R2.92 NCC1CCc2ccccc2C1N Amb32698025 [0,1,0,1,0,0|2,0,0]=4 6780 B14R2.92 NCC1CNc2ccccc2C1O Amb18063868 [0,1,0,1,0,0|2,0,0]=4 6781 B14R2.92 NCC1COc2ccccc2C1O Amb18561744 [0,1,0,1,0,0|2,0,0]=4 6782 B14R2.92 OCC1CCc2ccccc2C1O Amb27972732 [0,1,0,1,0,0|1,0,0]=3 6783 B14R2.92 OCC1COc2ccccc2C1O Amb27220582 [0,1,0,1,0,0|2,0,0]=4 6784 B14R2.92 OCC1N=Cc2ccccc2C1O Amb28125903 [0,1,0,1,0,0|0,0,2]=4 6785 B14R2.92 OC[C@@H]1CCc2ccccc2[C@@H]1O Amb27970877 [0,1,0,1,0,0|1,0,0]=3 6786 B14R2.92 OC[C@@H]1CCc2ccccc2[C@H]1O Amb28206072 [0,1,0,1,0,0|1,0,0]=3 6787 B14R2.92 OC[C@H]1CCc2ccccc2[C@H]1O Amb27853842 [0,1,0,1,0,0|1,0,0]=3 6788 B14R2.215 CC1c2ccccc2N(C)C1CO Amb27795887 [0,1,0,1,0,0|1,0,0]=3 6789 B14R2.215 C[C@H]1c2ccccc2N(C)[C@H]1CN Amb28068817 [0,1,0,1,0,0|1,0,0]=3 6790 B14R2.215 C[C@H]1c2ccccc2N(C)[C@H]1CO Amb27469788 [0,1,0,1,0,0|1,0,0]=3 6791 B14R2.3469 CC(c1ccccc1)C2(CN)CC2 Amb33081585 [0,1,0,1,0,0|2,0,0]=4 6792 B14R2.3469 CC(c1ccccc1)C2(CO)CC2 Amb33081607 [0,1,0,1,0,0|2,0,0]=4 6793 B14R2.3469 CNC1(C(C)c2ccccc2)CC1 Amb33081911 [0,1,0,1,0,0|1,0,0]=3 6794 B14R2.3469 CSC1(C(O)c2ccccc2)CC1 Amb27768957 [0,1,0,1,0,0|1,0,0]=3 6795 B14R2.3469 C[C@H](c1ccccc1)[C@]2(CO)CO2 Amb27423201 [0,1,0,1,0,0|2,0,0]=4 6796 B14R2.3469 NCC1(C(O)c2ccccc2)CC1 Amb27409830 [0,1,0,1,0,0|1,0,0]=3 6797 B14R2.3469 NCC1(C(O)c2ccccn2)CC1 Amb25997378 [0,1,0,1,0,0|2,0,0]=4 6798 B14R2.3469 NCC1(C(O)c2cccnc2)CC1 Amb28044714 [0,1,0,1,0,0|2,0,0]=4 6799 B14R2.3469 NCC1(C(O)c2ccncc2)CC1 Amb26021951 [0,1,0,1,0,0|2,0,0]=4 6800 B14R2.3469 OC[C@@]1([C@H](O)c2ccccc2)CO1 Amb27184383 [0,1,0,1,0,0|1,0,0]=3 6801 B14R2.3510 CC[C@]1(C=O)O[C@H]1c2ccccc2 Amb28287363 [0,1,0,1,0,0|1,0,1]=4 6802 B14R2.3510 N#CC1(CO)OC1c2ccccc2 Amb28065948 [0,1,0,1,0,0|2,0,0]=4 6803 B14R2.30431 C#CC(NC)C1Cc2ccccc21 Amb27396450 [0,1,0,1,0,0|1,0,1]=4 6804 B14R2.30431 C=CC(NC)C1Cc2ccccc21 Amb27174731 [0,1,0,1,0,0|1,0,1]=4 6805 B14R2.450 CC(=O)C1Sc2ccccc2C1O Amb27653069 [0,1,0,1,0,0|2,0,0]=4 6806 B14R2.450 CC(Br)C1Cc2ccccc2C1C Amb29887236 [0,1,0,1,0,0|2,0,0]=4 6807 B14R2.450 CC(C)[C@@H]1Cc2ccccc2[C@H]1O Amb28079092 [0,1,0,1,0,0|1,0,0]=3 6808 B14R2.450 CC(C)[C@H]1Cc2ccccc2[C@@H]1O Amb27196850 [0,1,0,1,0,0|1,0,0]=3 6809 B14R2.450 CC(C)[C@H]1Cc2ccccc2[C@H]1O Amb27184207 [0,1,0,1,0,0|1,0,0]=3 6810 B14R2.450 CC(Cl)C1Cc2ccccc2C1C Amb29887235 [0,1,0,1,0,0|2,0,0]=4 6811 B14R2.450 CC(N)C1Cc2ccccc2C1C Amb35722522 [0,1,0,1,0,0|2,0,0]=4 6812 B14R2.450 CC(O)C1Cc2ccccc2C1C Amb35629759 [0,1,0,1,0,0|2,0,0]=4 6813 B14R2.450 CC(O)[C@@H]1Cc2ccccc2[C@@H]1O Amb27184335 [0,1,0,1,0,0|1,0,0]=3 6814 B14R2.450 CN(C)[C@@H]1Cc2ccccc2[C@@H]1O Amb27651780 [0,1,0,1,0,0|0,0,0]=2 6815 B14R2.450 CN(C)[C@H]1Cc2ccccc2[C@@H]1N Amb28384106 [0,1,0,1,0,0|1,0,0]=3 6816 B14R2.450 CN(N)C1Cc2ccccc2C1O Amb27651675 [0,1,0,1,0,0|0,0,0]=2 6817 B14R2.450 CN(N)[C@H]1Cc2ccccc2[C@H]1O Amb27659473 [0,1,0,1,0,0|0,0,0]=2 6818 B14R2.450 CS(=O)C1Cc2ccccc2C1N Amb27606645 [0,1,0,1,0,0|2,0,0]=4 6819 B14R2.450 NC(=O)[C@@H]1Cc2ccccc2[C@@H]1O Amb27625097 [0,1,0,1,0,0|2,0,0]=4 6820 B14R2.780 CC(=O)[C@H]1CC[C@@H]1c2ccccc2 Amb27427949 [0,1,0,1,0,0|2,0,0]=4 6821 B14R2.780 CC(O)[C@H]1CO[C@@H]1c2ccccc2 Amb27184223 [0,1,0,1,0,0|1,0,0]=3 6822 B14R2.786 CC(=O)[C@@]1(C)C[C@H]1c2ccccc2 Amb27427676 [0,1,0,1,0,0|2,0,0]=4 6823 B14R2.786 CC(O)C1(C)CC1c2ccccc2 Amb27594682 [0,1,0,1,0,0|2,0,0]=4 6824 B14R2.786 CC1(C(=O)Cl)OC1c2ccccc2 Amb24366113 [0,1,0,1,0,0|2,0,0]=4 6825 B14R2.786 CC1(C(=O)O)OC1c2ccccc2 Amb27184619 [0,1,0,1,0,0|2,0,0]=4 6826 B14R2.786 C[C@@H](O)[C@]1(C)C[C@H]1c2ccccc2 Amb28079172 [0,1,0,1,0,0|2,0,0]=4 6827 B14R2.6178 CC(C)[C@@]1(C)c2ccccc2[C@H]1O Amb27206115 [0,1,0,1,0,0|1,0,0]=3 6828 B14R2.9520 CC(O)C1CC1(O)c2ccccc2 Amb27757368 [0,1,0,1,0,0|1,0,0]=3 6829 B14R2.57380 CC1(C)c2ccccc2C(O)C1N Amb28193678 [0,1,0,1,0,0|2,0,0]=4 6830 B14R2.57380 CC1(C)c2ccccc2[C@@H](O)[C@H]1O Amb27805400 [0,1,0,1,0,0|2,0,0]=4 6831 B14R2.57380 CC1(C)c2ccccc2[C@H](O)[C@H]1O Amb28079139 [0,1,0,1,0,0|2,0,0]=4 6832 B14R2.57380 CC1C(O)c2ccccc2C1(C)C Amb28077851 [0,1,0,1,0,0|1,0,0]=3 6833 B14R2.57380 CC1N(C)c2ccccc2C1(C)C Amb19394422 [0,1,0,1,0,0|1,0,0]=3 6834 B14R2.57380 CN1C(=O)C(C)(O)c2ccccc21 Amb28317257 [0,1,0,1,0,0|1,0,1]=4 6835 B14R2.57380 CN1c2ccccc2C(C)(C)C1O Amb17778658 [0,1,0,1,0,0|2,0,0]=4 6836 B14R2.333 CC1(C)NCCC1c2ccccc2 Amb18279937 [0,1,0,1,0,0|1,0,0]=3 6837 B14R2.333 CC1(C)NCCC1c2ccccn2 Amb18279948 [0,1,0,1,0,0|2,0,0]=4 6838 B14R2.333 CC1(C)NCCP1c2ccccc2 Amb27394116 [0,1,0,1,0,0|2,0,0]=4 6839 B14R2.2969 CC1(CCl)COC1c2ccccc2 Amb27413484 [0,1,0,1,0,0|2,0,0]=4 6840 B14R2.3512 CCC1(O)Cc2ccccc2C1C Amb35629622 [0,1,0,1,0,0|2,0,0]=4 6841 B14R2.3512 COC1(C)Cc2ccccc2C1O Amb28077893 [0,1,0,1,0,0|1,0,0]=3 6842 B14R2.3512 C[C@]1(CO)Cc2ccccc2[C@H]1O Amb27203340 [0,1,0,1,0,0|2,0,0]=4 6843 B14R2.4654 CC1(C)NCC1(F)c2ccccc2 Amb27866492 [0,1,0,1,0,0|1,0,0]=3 6844 B14R2.4654 CC1(C)NCC1(O)c2ccccc2 Amb27445039 [0,1,0,1,0,0|0,0,0]=2 6845 B14R2.6175 CC1(C)C=Cc2ccccc2C1O Amb27641838 [0,1,0,1,0,0|1,0,1]=4 6846 B14R2.6175 CC1(C)CCc2ccccc2C1N Amb22059730 [0,1,0,1,0,0|2,0,0]=4 6847 B14R2.6175 CC1(C)CCc2ccccc2C1O Amb26031380 [0,1,0,1,0,0|1,0,0]=3 6848 B14R2.6175 CC1(C)CCc2ccccc2C1S Amb32788717 [0,1,0,1,0,0|1,1,0]=4 6849 B14R2.6175 CC1(C)CCc2ccccc2[C@H]1N Amb32654869 [0,1,0,1,0,0|2,0,0]=4 6850 B14R2.6175 CC1(C)CCc2ccccc2[C@H]1O Amb27651903 [0,1,0,1,0,0|1,0,0]=3 6851 B14R2.6175 CC1(C)SCc2ccccc2C1N Amb27482631 [0,1,0,1,0,0|2,0,0]=4 6852 B14R2.6180 CC1(C)C(=O)c2ccccc2C1O Amb27217280 [0,1,0,1,0,0|2,0,0]=4 6853 B14R2.6180 CC1(C)C(O)c2ccccc2C1O Amb28455635 [0,1,0,1,0,0|2,0,0]=4 6854 B14R2.6180 CC1c2ccccc2C(O)C1(C)C Amb27969049 [0,1,0,1,0,0|1,0,0]=3 6855 B14R2.6180 CN1c2ccccc2C(O)C1(C)C Amb27218005 [0,1,0,1,0,0|0,0,0]=2 6856 B14R2.6180 C[C@H]1c2ccccc2[C@@H](O)C1(C)C Amb27202552 [0,1,0,1,0,0|1,0,0]=3 6857 B14R2.84 OC[C@@H]1CC(O)[C@H]1c2ccccc2 Amb27978456 [0,1,0,1,0,0|2,0,0]=4 6858 B14R2.95 CC(C=O)C1COc2ccccc21 Amb18196803 [0,1,0,1,0,0|2,0,0]=4 6859 B14R2.95 CC(CN)C1COc2ccccc21 Amb26530064 [0,1,0,1,0,0|2,0,0]=4 6860 B14R2.95 CC(CN)C1OCc2ccccc21 Amb33735118 [0,1,0,1,0,0|2,0,0]=4 6861 B14R2.95 CC(CO)C1COc2ccccc21 Amb33745861 [0,1,0,1,0,0|2,0,0]=4 6862 B14R2.95 CC(CO)C1OCc2ccccc21 Amb33746123 [0,1,0,1,0,0|2,0,0]=4 6863 B14R2.95 CC(NN)C1COc2ccccc21 Amb27872406 [0,1,0,1,0,0|1,0,0]=3 6864 B14R2.95 CC(NN)c1coc2ccccc12 Amb28346251 [0,1,0,1,0,0|1,0,1]=4 6865 B14R2.95 CCC(N)C1COc2ccccc21 Amb27601806 [0,1,0,1,0,0|2,0,0]=4 6866 B14R2.95 CC[C@H](N)C1COc2ccccc21 Amb27811825 [0,1,0,1,0,0|2,0,0]=4 6867 B14R2.95 CNC(C)C1CCc2ccccc21 Amb27593592 [0,1,0,1,0,0|1,0,0]=3 6868 B14R2.95 CNC(C)C1CNc2ccccc21 Amb27419847 [0,1,0,1,0,0|1,0,0]=3 6869 B14R2.95 CNC(C)C1COc2ccccc21 Amb27851244 [0,1,0,1,0,0|0,0,0]=2 6870 B14R2.95 CNC(C)C1CSc2ccccc21 Amb28401305 [0,1,0,1,0,0|0,1,0]=3 6871 B14R2.95 CNC(C)c1csc2ccccc12 Amb9345784 [0,1,0,1,0,0|0,1,1]=4 6872 B14R2.95 C[C@@H](CN)C1COc2ccccc21 Amb33743136 [0,1,0,1,0,0|2,0,0]=4 6873 B14R2.95 C[C@@H](CN)C1OCc2ccccc21 Amb33730008 [0,1,0,1,0,0|2,0,0]=4 6874 B14R2.95 C[C@@H](CO)C1COc2ccccc21 Amb33747146 [0,1,0,1,0,0|2,0,0]=4 6875 B14R2.95 C[C@@H](CO)C1OCc2ccccc21 Amb33739408 [0,1,0,1,0,0|2,0,0]=4 6876 B14R2.95 C[C@H](CN)C1COc2ccccc21 Amb33748004 [0,1,0,1,0,0|2,0,0]=4 6877 B14R2.95 C[C@H](CN)C1OCc2ccccc21 Amb33727720 [0,1,0,1,0,0|2,0,0]=4 6878 B14R2.95 C[C@H](CO)C1COc2ccccc21 Amb33743121 [0,1,0,1,0,0|2,0,0]=4 6879 B14R2.95 C[C@H](CO)C1OCc2ccccc21 Amb33748553 [0,1,0,1,0,0|2,0,0]=4 6880 B14R2.203 CC[C@H]1c2ccccc2CN[C@H]1C Amb27423292 [0,1,0,1,0,0|1,0,0]=3 6881 B14R2.203 COC1c2ccccc2CCC1Cl Amb27484027 [0,1,0,1,0,0|2,0,0]=4 6882 B14R2.203 COC1c2ccccc2CCC1O Amb27977910 [0,1,0,1,0,0|2,0,0]=4 6883 B14R2.203 C[C@@H]1COc2ccccc2[C@@H]1CO Amb27221132 [0,1,0,1,0,0|2,0,0]=4 6884 B14R2.203 C[C@H]1C=Cc2ccccc2[C@@H]1CO Amb28319976 [0,1,0,1,0,0|1,0,1]=4 6885 B14R2.203 O=C1NCc2ccccc2C1CO Amb27749046 [0,1,0,1,0,0|1,0,1]=4 6886 B14R2.277 CC1CNC(C)C1c2ccncc2 Amb27489835 [0,1,0,1,0,0|2,0,0]=4 6887 B14R2.277 CC1CNC(C)N1c2ccccc2 Amb27482651 [0,1,0,1,0,0|2,0,0]=4 6888 B14R2.277 CC1NCC(=O)N1c2ccccc2 Amb27163153 [0,1,0,1,0,0|1,0,1]=4 6889 B14R2.277 C[C@H]1CCC(=O)[C@@H]1c2ccccc2 Amb27855033 [0,1,0,1,0,0|1,0,1]=4 6890 B14R2.979 CC(NN)C1(c2ccccc2)CC1 Amb27951246 [0,1,0,1,0,0|2,0,0]=4 6891 B14R2.1033 C=C[C@@H]1C[C@@]1(CO)c2ccccc2 Amb27420336 [0,1,0,1,0,0|1,0,1]=4 6892 B14R2.1033 CCC1CC1(CN)c2ccccc2 Amb27241514 [0,1,0,1,0,0|2,0,0]=4 6893 B14R2.1033 CCC1CC1(CO)c2ccccc2 Amb27179512 [0,1,0,1,0,0|1,0,0]=3 6894 B14R2.1033 CC[C@@H]1C[C@@]1(CO)c2ccccc2 Amb28455223 [0,1,0,1,0,0|1,0,0]=3 6895 B14R2.1033 CC[C@H]1C[C@@]1(CO)c2ccccc2 Amb27219047 [0,1,0,1,0,0|1,0,0]=3 6896 B14R2.1033 COC1(c2ccccc2)CC1C#N Amb26495494 [0,1,0,1,0,0|2,0,0]=4 6897 B14R2.1033 COC1(c2ccccc2)CC1CN Amb23538752 [0,1,0,1,0,0|2,0,0]=4 6898 B14R2.1033 OCC1CC1(CO)c2ccccc2 Amb27853871 [0,1,0,1,0,0|2,0,0]=4 6899 B14R2.1033 OC[C@@H]1C[C@]1(CO)c2ccccc2 Amb27422457 [0,1,0,1,0,0|2,0,0]=4 6900 B14R2.1033 OC[C@]1(c2ccccc2)C[C@@H]1CCl Amb27650551 [0,1,0,1,0,0|2,0,0]=4 6901 B14R2.1129 CCC1Cc2ccccc2C1NC Amb18958578 [0,1,0,1,0,0|2,0,0]=4 6902 B14R2.2850 NCC(c1ccccc1)C2CCC2 Amb17087352 [0,1,0,1,0,0|2,0,0]=4 6903 B14R2.2850 O=CC(c1ccccc1)C2CCC2 Amb25839748 [0,1,0,1,0,0|1,0,1]=4 6904 B14R2.2850 OCC(c1ccccc1)C2CCC2 Amb27664520 [0,1,0,1,0,0|1,0,0]=3 6905 B14R2.2850 O\N=C(/c1ccccc1)C2CCC2 Amb27609766 [0,1,0,1,0,0|1,0,1]=4 6906 B14R2.2861 CNC(c1ccccc1)C2(C)CC2 Amb28071959 [0,1,0,1,0,0|2,0,0]=4 6907 B14R2.3435 C=C1C(C)C1(CO)c2ccccc2 Amb27775388 [0,1,0,1,0,0|1,0,1]=4 6908 B14R2.296 CC1CCNC1c2ccccc2F Amb3788284 [0,1,0,1,0,0|2,0,0]=4 6909 B14R2.296 CC1NCCC1c2ccccc2Br Amb18730965 [0,1,0,1,0,0|1,0,0]=3 6910 B14R2.296 CN1CCOC1c2ccccc2Cl Amb6382888 [0,1,0,1,0,0|2,0,0]=4 6911 B14R2.296 CN1CCOC1c2ccccc2F Amb17335481 [0,1,0,1,0,0|2,0,0]=4 6912 B14R2.296 CN1CCOC1c2ccccc2O Amb3735631 [0,1,0,1,0,0|2,0,0]=4 6913 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2Br Amb18156536 [0,1,0,1,0,0|2,0,0]=4 6914 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2Cl Amb18189118 [0,1,0,1,0,0|2,0,0]=4 6915 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2F Amb18194451 [0,1,0,1,0,0|2,0,0]=4 6916 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2O Amb18195878 [0,1,0,1,0,0|2,0,0]=4 6917 B14R2.296 C[C@H]1CCN[C@@H]1c2ccccc2Br Amb27798470 [0,1,0,1,0,0|2,0,0]=4 6918 B14R2.296 C[C@H]1CCN[C@@H]1c2ccccc2F Amb27459670 [0,1,0,1,0,0|2,0,0]=4 6919 B14R2.296 C[C@H]1CCN[C@@H]1c2ccccc2O Amb27814552 [0,1,0,1,0,0|2,0,0]=4 6920 B14R2.296 Cc1ccccc1C2OCCN2C Amb17335175 [0,1,0,1,0,0|2,0,0]=4 6921 B14R2.296 Cc1ccccc1[C@@H]2NCC[C@H]2C Amb18197089 [0,1,0,1,0,0|2,0,0]=4 6922 B14R2.296 Cc1ccccc1[C@H]2NCC[C@@H]2C Amb27798483 [0,1,0,1,0,0|2,0,0]=4 6923 B14R2.296 NC1CCOC1c2ccccc2Br Amb28368931 [0,1,0,1,0,0|2,0,0]=4 6924 B14R2.296 NC1CCOC1c2ccccc2Cl Amb28428040 [0,1,0,1,0,0|2,0,0]=4 6925 B14R2.4618 CC1CC1C(O)c2cnccc2N Amb27390905 [0,1,0,1,0,0|2,0,0]=4 6926 B14R2.4628 CC1CCC1(N)c2ccccc2Br Amb27639721 [0,1,0,1,0,0|2,0,0]=4 6927 B14R2.4628 CC1CCC1(N)c2ccccc2Cl Amb28424014 [0,1,0,1,0,0|2,0,0]=4 6928 B14R2.4628 CC1CCC1(O)c2cccnc2Br Amb35702783 [0,1,0,1,0,0|2,0,0]=4 6929 B14R2.7957 CC1(C(N)c2ccccc2Br)CC1 Amb18731585 [0,1,0,1,0,0|2,0,0]=4 6930 B14R2.7957 CC1(C(N)c2ccccc2Cl)CC1 Amb27751478 [0,1,0,1,0,0|2,0,0]=4 6931 B14R2.7957 Cc1ccccc1C(N)C2(C)CC2 Amb27836358 [0,1,0,1,0,0|2,0,0]=4 6932 B14R2.7957 Cc1ccccc1C(O)C2(N)CC2 Amb29875628 [0,1,0,1,0,0|2,0,0]=4 6933 B14R2.7957 Cc1ccncc1C(O)C2(C)CC2 Amb27654750 [0,1,0,1,0,0|2,0,0]=4 6934 B14R2.7957 NC1(C(O)c2ccccc2Br)CC1 Amb32651502 [0,1,0,1,0,0|2,0,0]=4 6935 B14R2.7957 NC1(C(O)c2ccccc2Cl)CC1 Amb32651500 [0,1,0,1,0,0|2,0,0]=4 6936 B14R2.7957 NC1(C(O)c2ccccc2F)CC1 Amb32651503 [0,1,0,1,0,0|2,0,0]=4 6937 B14R2.11166 CCC1CC1(O)c2cccnc2C Amb27872820 [0,1,0,1,0,0|2,0,0]=4 6938 B14R2.11166 CCC1CC1(O)c2cnccc2C Amb30009491 [0,1,0,1,0,0|2,0,0]=4 6939 B14R2.11166 CCC1CC1(O)c2ncccc2Br Amb27792784 [0,1,0,1,0,0|2,0,0]=4 6940 B14R2.21545 Cc1ccccc1C(=O)C2CCN2 Amb27813573 [0,1,0,1,0,0|0,0,2]=4 6941 B14R2.21545 Cc1ccccc1C(N)C2CCC2 Amb22642960 [0,1,0,1,0,0|2,0,0]=4 6942 B14R2.21545 Cc1ccccc1C(N)C2CCC2 Amb32662095 [0,1,0,1,0,0|2,0,0]=4 6943 B14R2.21545 Cc1ccccc1C(O)C2CSC2 Amb29852085 [0,1,0,1,0,0|2,0,0]=4 6944 B14R2.21545 Cc1ncccc1C(O)C2CCC2 Amb27258773 [0,1,0,1,0,0|2,0,0]=4 6945 B14R2.21545 NC(c1ccccc1F)C2CCC2 Amb22642956 [0,1,0,1,0,0|2,0,0]=4 6946 B14R2.21545 NC(c1ccccc1F)C2CCC2 Amb30982466 [0,1,0,1,0,0|2,0,0]=4 6947 B14R2.21545 N[C@@H](c1ccccc1Cl)C2CCC2 Amb27775147 [0,1,0,1,0,0|2,0,0]=4 6948 B14R2.21545 N[C@H](c1ccccc1Br)C2CCC2 Amb27196408 [0,1,0,1,0,0|2,0,0]=4 6949 B14R2.21545 N[C@H](c1ccccc1Cl)C2CCC2 Amb27247442 [0,1,0,1,0,0|2,0,0]=4 6950 B14R2.21545 Nc1ccccc1C(N)C2CCC2 Amb27450475 [0,1,0,1,0,0|2,0,0]=4 6951 B14R2.21545 Nc1cccnc1C(O)C2CCC2 Amb35622605 [0,1,0,1,0,0|2,0,0]=4 6952 B14R2.21545 OC(c1ccccc1Cl)C2CNC2 Amb28241562 [0,1,0,1,0,0|2,0,0]=4 6953 B14R2.21545 OC(c1ccccc1Cl)C2CSC2 Amb29862803 [0,1,0,1,0,0|2,0,0]=4 6954 B14R2.21545 OC(c1ccccc1F)C2CNC2 Amb28383226 [0,1,0,1,0,0|2,0,0]=4 6955 B14R2.21545 OC(c1ccccc1F)C2CSC2 Amb29862772 [0,1,0,1,0,0|2,0,0]=4 6956 B14R2.21545 OC(c1cccnc1Br)C2CCC2 Amb35702782 [0,1,0,1,0,0|2,0,0]=4 6957 B14R2.21545 OC(c1ccncc1F)C2CCC2 Amb27610149 [0,1,0,1,0,0|2,0,0]=4 6958 B14R2.28523 CC1NCc2cccc(F)c2C1C Amb28194878 [0,1,0,1,0,0|1,0,0]=3 6959 B14R2.28523 CN1CCc2cccc(N)c2C1O Amb27179219 [0,1,0,1,0,0|2,0,0]=4 6960 B14R2.28523 C[C@H]1CCc2cccc(O)c2[C@@H]1O Amb28411286 [0,1,0,1,0,0|1,0,0]=3 6961 B14R2.743 C[C@]1(O)c2ccccc2CC[C@H]1Cl Amb28052072 [0,1,0,1,0,0|2,0,0]=4 6962 B14R2.1109 COC1Nc2ccccc2C1(C)O Amb27264450 [0,1,0,1,0,0|2,0,0]=4 6963 B14R2.4878 CC(O)(c1ccccc1)C2(Cl)CC2 Amb35621172 [0,1,0,1,0,0|2,0,0]=4 6964 B14R2.4878 CC(O)(c1ccccc1)C2(N)CC2 Amb28193689 [0,1,0,1,0,0|2,0,0]=4 6965 B14R2.4878 CC1(C(C)(C)c2ccccc2)CO1 Amb33175819 [0,1,0,1,0,0|2,0,0]=4 6966 B14R2.4878 CC1(C(C)(O)c2ccccc2)CC1 Amb4017708 [0,1,0,1,0,0|1,0,0]=3 6967 B14R2.4878 CC1(C(F)(F)c2ccccc2)CO1 Amb33082251 [0,1,0,1,0,0|2,0,0]=4 6968 B14R2.21287 CC(C)(c1ccccc1)C2CCN2 Amb33475553 [0,1,0,1,0,0|1,0,0]=3 6969 B14R2.21287 CC(N)(c1ccccc1)C2CCC2 Amb35657673 [0,1,0,1,0,0|2,0,0]=4 6970 B14R2.21287 CC(O)(c1ccccc1)C2CNC2 Amb27446424 [0,1,0,1,0,0|2,0,0]=4 6971 B14R2.21287 CC(O)(c1ccccn1)C2CCC2 Amb27453770 [0,1,0,1,0,0|2,0,0]=4 6972 B14R2.21287 CC(O)(c1cccnc1)C2CCC2 Amb28317246 [0,1,0,1,0,0|2,0,0]=4 6973 B14R2.21287 FC(F)(c1ccccc1)C2CCC2 Amb20670167 [0,1,0,1,0,0|2,0,0]=4 6974 B14R2.21287 FC(F)(c1ccccc1)C2CCN2 Amb33082013 [0,1,0,1,0,0|1,0,0]=3 6975 B14R3.44 c1ccc(C2NCC3CC32)cc1 Amb35826261 [0,0,0,2,0,0|2,0,0]=4 6976 B14R3.44 c1ccc(C2NCC3CC32)cc1 Amb7808795 [0,0,0,2,0,0|2,0,0]=4 6977 B14R3.44 c1ccc([C@H]2NC[C@H]3C[C@H]32)cc1 Amb28245851 [0,0,0,2,0,0|2,0,0]=4 6978 B14R3.49 C1=CC2c3ccccc3CC2N1 Amb28351295 [0,0,0,2,0,0|1,0,1]=4 6979 B14R3.49 c1ccc2c(c1)CC3CCNC23 Amb27770096 [0,0,0,2,0,0|2,0,0]=4 6980 B14R3.608 NC1CC2OC1c3ccccc32 Amb27403109 [0,0,0,2,0,0|2,0,0]=4 6981 B14R3.608 N[C@@H]1C[C@@H]2O[C@H]1c3ccccc32 Amb27858253 [0,0,0,2,0,0|2,0,0]=4 6982 B14R3.52 c1ccc2c(c1)CCC3CNC23 Amb27231062 [0,0,0,2,0,0|2,0,0]=4 6983 B14R3.418 C[C@@H]1[C@H]2Cc3ccccc3[C@@]12N Amb27638081 [0,0,0,2,0,0|2,0,0]=4 6984 B14R3.418 C[C@H]1[C@H]2Cc3ccccc3[C@@]12N Amb28052037 [0,0,0,2,0,0|2,0,0]=4 6985 B14R3.455 OC1c2ccccc2SC3CC31 Amb27405314 [0,0,0,2,0,0|2,0,0]=4 6986 B14R3.457 NC1c2ccccc2C3CC1C3 Amb25798658 [0,0,0,2,0,0|2,0,0]=4 6987 B14R3.457 OC1c2ccccc2C3CC1C3 Amb25687886 [0,0,0,2,0,0|1,0,0]=3 6988 B14R3.453 CC1c2ccccc2CC13CO3 Amb29887234 [0,0,0,2,0,0|2,0,0]=4 6989 B14R3.453 NC1c2ccccc2CC13CC3 Amb18063823 [0,0,0,2,0,0|2,0,0]=4 6990 B14R3.453 OC1c2ccccc2NC13CC3 Amb18829939 [0,0,0,2,0,0|2,0,0]=4 6991 B14R3.456 CC1C2c3ccccc3C(O)C12 Amb28138493 [0,0,0,2,0,0|1,0,0]=3 6992 B14R3.456 C[C@H]1[C@@H]2[C@H](O)c3ccccc3[C@@H]21 Amb27423111 [0,0,0,2,0,0|1,0,0]=3 6993 B14R3.459 CC1c2ccccc2C3NCC13 Amb27808979 [0,0,0,2,0,0|2,0,0]=4 6994 B14R3.14833 c1ccc(C2CCC23CO3)cc1 Amb33748324 [0,0,0,2,0,0|2,0,0]=4 6995 B14R3.458 C[C@]12C[C@H]1C(O)c3ccccc32 Amb27452042 [0,0,0,2,0,0|1,0,0]=3 6996 B14R3.3985 OC1(c2ccccc2)C3CC1C3 Amb578335 [0,0,0,2,0,0|1,0,0]=3 6997 B10R1.11 CCCC(O)c1ccco1 Amb4139715 [1,0,0,0,1,0|2,0,0]=4 6998 B10R1.11 CCCC(O)c1cccs1 Amb4314141 [1,0,0,0,1,0|2,0,0]=4 6999 B10R1.11 CNCC(C)c1cccs1 Amb17232163 [1,0,0,0,1,0|2,0,0]=4 7000 B10R1.11 CNCC(O)c1ccco1 Amb5750893 [1,0,0,0,1,0|1,0,0]=3 7001 B10R1.11 CNCC(O)c1cccs1 Amb5750894 [1,0,0,0,1,0|1,0,0]=3 7002 B10R1.11 CNCC(O)c1ccoc1 Amb27870982 [1,0,0,0,1,0|1,0,0]=3 7003 B10R1.11 CNCC(O)c1ccon1 Amb33198787 [1,0,0,0,1,0|2,0,0]=4 7004 B10R1.11 CNCC(O)c1ccsc1 Amb18997460 [1,0,0,0,1,0|1,0,0]=3 7005 B10R1.11 CNCC(O)c1cnco1 Amb33415280 [1,0,0,0,1,0|2,0,0]=4 7006 B10R1.11 CNCC(O)c1cncs1 Amb24478439 [1,0,0,0,1,0|2,0,0]=4 7007 B10R1.11 CNCC(O)c1cnsc1 Amb35711426 [1,0,0,0,1,0|2,0,0]=4 7008 B10R1.11 CNCC(O)c1cscn1 Amb24371861 [1,0,0,0,1,0|2,0,0]=4 7009 B10R1.11 CNCC(O)c1nccs1 Amb24334731 [1,0,0,0,1,0|2,0,0]=4 7010 B10R1.11 CNC[C@@H](O)c1ccco1 Amb26968688 [1,0,0,0,1,0|1,0,0]=3 7011 B10R1.11 CNC[C@@H](O)c1cccs1 Amb27228422 [1,0,0,0,1,0|1,0,0]=3 7012 B10R1.11 CNC[C@@H](O)c1nccs1 Amb27955862 [1,0,0,0,1,0|2,0,0]=4 7013 B10R1.11 COCC(O)c1cccs1 Amb18791923 [1,0,0,0,1,0|2,0,0]=4 7014 B10R1.11 COCC(O)c1ccoc1 Amb27639195 [1,0,0,0,1,0|2,0,0]=4 7015 B10R1.11 CSCC(O)c1ccco1 Amb25703539 [1,0,0,0,1,0|2,0,0]=4 7016 B10R1.11 CSCC(O)c1cccs1 Amb18183876 [1,0,0,0,1,0|2,0,0]=4 7017 B10R1.11 CSCC(O)c1ccoc1 Amb27234597 [1,0,0,0,1,0|2,0,0]=4 7018 B10R1.11 NNCC(O)c1ccco1 Amb17231941 [1,0,0,0,1,0|2,0,0]=4 7019 B10R1.11 NNCC(O)c1cccs1 Amb17232256 [1,0,0,0,1,0|2,0,0]=4 7020 B10R1.11 ONCC(O)c1ccco1 Amb17334210 [1,0,0,0,1,0|2,0,0]=4 7021 B10R1.11 ONCC(O)c1cccs1 Amb17334462 [1,0,0,0,1,0|2,0,0]=4 7022 B10R1.23 CC(C)C(C)n1cccc1 Amb9371400 [1,0,0,0,1,0|2,0,0]=4 7023 B10R1.23 CC(C)C(Cl)c1ccco1 Amb17138478 [1,0,0,0,1,0|2,0,0]=4 7024 B10R1.23 CC(C)C(Cl)c1cccs1 Amb17138752 [1,0,0,0,1,0|2,0,0]=4 7025 B10R1.23 CC(C)C(Cl)c1ccoc1 Amb27948771 [1,0,0,0,1,0|2,0,0]=4 7026 B10R1.23 CC(C)C(N)c1ccco1 Amb18283654 [1,0,0,0,1,0|2,0,0]=4 7027 B10R1.23 CC(C)C(N)c1ccco1 Amb35745896 [1,0,0,0,1,0|2,0,0]=4 7028 B10R1.23 CC(C)C(N)c1cccs1 Amb1163534 [1,0,0,0,1,0|2,0,0]=4 7029 B10R1.23 CC(C)C(N)c1ccoc1 Amb28072874 [1,0,0,0,1,0|2,0,0]=4 7030 B10R1.23 CC(C)C(N)c1ccsc1 Amb18949713 [1,0,0,0,1,0|2,0,0]=4 7031 B10R1.23 CC(C)C(O)c1ccco1 Amb17138390 [1,0,0,0,1,0|1,0,0]=3 7032 B10R1.23 CC(C)C(O)c1cccs1 Amb9619571 [1,0,0,0,1,0|1,0,0]=3 7033 B10R1.23 CC(C)C(O)c1ccoc1 Amb27827679 [1,0,0,0,1,0|1,0,0]=3 7034 B10R1.23 CC(C)C(O)c1ccsn1 Amb27174840 [1,0,0,0,1,0|2,0,0]=4 7035 B10R1.23 CC(C)C(O)c1cncs1 Amb28387706 [1,0,0,0,1,0|2,0,0]=4 7036 B10R1.23 CC(C)C(O)c1cnsc1 Amb35719525 [1,0,0,0,1,0|2,0,0]=4 7037 B10R1.23 CC(C)C(O)c1cscn1 Amb28049596 [1,0,0,0,1,0|2,0,0]=4 7038 B10R1.23 CC(C)C(O)c1nccs1 Amb24470222 [1,0,0,0,1,0|2,0,0]=4 7039 B10R1.23 CC(C)C(S)c1cccs1 Amb18180378 [1,0,0,0,1,0|1,1,0]=4 7040 B10R1.23 CC(C)[C@@H](N)c1ccco1 Amb27877435 [1,0,0,0,1,0|2,0,0]=4 7041 B10R1.23 CC(C)[C@@H](O)c1ccco1 Amb28077780 [1,0,0,0,1,0|1,0,0]=3 7042 B10R1.23 CC(C)[C@@H](O)c1cccs1 Amb27826331 [1,0,0,0,1,0|1,0,0]=3 7043 B10R1.23 CC(C)[C@@H](O)c1ccsc1 Amb27396385 [1,0,0,0,1,0|1,0,0]=3 7044 B10R1.23 CC(C)[C@@H](O)n1cccc1 Amb27594776 [1,0,0,0,1,0|1,0,0]=3 7045 B10R1.23 CC(C)[C@H](N)c1cccs1 Amb27860251 [1,0,0,0,1,0|2,0,0]=4 7046 B10R1.23 CC(C)[C@H](O)c1cccs1 Amb27839497 [1,0,0,0,1,0|1,0,0]=3 7047 B10R1.23 CC(C)[C@H](O)c1ccsc1 Amb27651895 [1,0,0,0,1,0|1,0,0]=3 7048 B10R1.23 CC(C)[C@H](O)n1cccc1 Amb27427121 [1,0,0,0,1,0|1,0,0]=3 7049 B10R1.23 CC(N)C(C)c1cccs1 Amb18830838 [1,0,0,0,1,0|2,0,0]=4 7050 B10R1.23 CC(N)C(N)c1ccco1 Amb27429900 [1,0,0,0,1,0|2,0,0]=4 7051 B10R1.23 CC(N)C(N)c1cccs1 Amb28349343 [1,0,0,0,1,0|2,0,0]=4 7052 B10R1.23 CC(N)C(O)c1ccno1 Amb27966234 [1,0,0,0,1,0|2,0,0]=4 7053 B10R1.23 CC(N)C(O)c1ccns1 Amb35730831 [1,0,0,0,1,0|2,0,0]=4 7054 B10R1.23 CC(N)C(O)c1ccoc1 Amb27838055 [1,0,0,0,1,0|1,0,0]=3 7055 B10R1.23 CC(N)C(O)c1ccsn1 Amb35588618 [1,0,0,0,1,0|2,0,0]=4 7056 B10R1.23 CC(N)C(O)c1cnsc1 Amb35588664 [1,0,0,0,1,0|2,0,0]=4 7057 B10R1.23 CC(N)C(O)c1nccs1 Amb26381721 [1,0,0,0,1,0|2,0,0]=4 7058 B10R1.23 CC(O)C(O)c1cccs1 Amb27191027 [1,0,0,0,1,0|2,0,0]=4 7059 B10R1.23 C[C@@H](N)C(O)c1ccco1 Amb30024560 [1,0,0,0,1,0|1,0,0]=3 7060 B10R1.23 C[C@@H](N)C(O)c1cccs1 Amb35617953 [1,0,0,0,1,0|1,0,0]=3 7061 B10R1.23 C[C@@H](N)C(O)c1ccns1 Amb35738178 [1,0,0,0,1,0|2,0,0]=4 7062 B10R1.23 C[C@@H](N)C(O)c1ccoc1 Amb35624305 [1,0,0,0,1,0|1,0,0]=3 7063 B10R1.23 C[C@@H](N)C(O)c1ccsc1 Amb35624303 [1,0,0,0,1,0|1,0,0]=3 7064 B10R1.23 C[C@@H](N)C(O)c1ccsn1 Amb35738167 [1,0,0,0,1,0|2,0,0]=4 7065 B10R1.23 C[C@@H](N)C(O)c1cncs1 Amb35582955 [1,0,0,0,1,0|2,0,0]=4 7066 B10R1.23 C[C@@H](N)C(O)c1cnsc1 Amb35624452 [1,0,0,0,1,0|2,0,0]=4 7067 B10R1.23 C[C@@H](N)C(O)c1cscn1 Amb35624454 [1,0,0,0,1,0|2,0,0]=4 7068 B10R1.23 C[C@@H](N)[C@@H](O)c1cccs1 Amb28196401 [1,0,0,0,1,0|1,0,0]=3 7069 B10R1.23 C[C@@H](N)[C@H](O)c1ccoc1 Amb27216678 [1,0,0,0,1,0|1,0,0]=3 7070 B10R1.23 C[C@@H](O)[C@@H](O)c1cccs1 Amb28079076 [1,0,0,0,1,0|2,0,0]=4 7071 B10R1.23 C[C@H](N)C(O)c1ccco1 Amb35737792 [1,0,0,0,1,0|1,0,0]=3 7072 B10R1.23 C[C@H](N)C(O)c1cccs1 Amb35588772 [1,0,0,0,1,0|1,0,0]=3 7073 B10R1.23 C[C@H](N)C(O)c1ccns1 Amb35617864 [1,0,0,0,1,0|2,0,0]=4 7074 B10R1.23 C[C@H](N)C(O)c1ccoc1 Amb35618416 [1,0,0,0,1,0|1,0,0]=3 7075 B10R1.23 C[C@H](N)C(O)c1ccsc1 Amb35618415 [1,0,0,0,1,0|1,0,0]=3 7076 B10R1.23 C[C@H](N)C(O)c1ccsn1 Amb35617853 [1,0,0,0,1,0|2,0,0]=4 7077 B10R1.23 C[C@H](N)C(O)c1cncs1 Amb35617926 [1,0,0,0,1,0|2,0,0]=4 7078 B10R1.23 C[C@H](N)C(O)c1cnsc1 Amb35617910 [1,0,0,0,1,0|2,0,0]=4 7079 B10R1.23 C[C@H](N)C(O)c1cscn1 Amb35617911 [1,0,0,0,1,0|2,0,0]=4 7080 B10R1.23 C[C@H](N)[C@@H](N)c1cccs1 Amb27429450 [1,0,0,0,1,0|2,0,0]=4 7081 B10R1.23 C[C@H](N)[C@@H](O)c1cccs1 Amb27393377 [1,0,0,0,1,0|1,0,0]=3 7082 B10R1.23 C[C@H](N)[C@H](O)c1nccs1 Amb27833660 [1,0,0,0,1,0|2,0,0]=4 7083 B10R1.23 C[C@H](O)[C@H](O)c1ccco1 Amb27432112 [1,0,0,0,1,0|2,0,0]=4 7084 B10R1.27 CC(Cc1cccs1)NN Amb27856825 [1,0,0,0,1,0|2,0,0]=4 7085 B10R1.27 CC(Cc1ccoc1)NN Amb28367528 [1,0,0,0,1,0|2,0,0]=4 7086 B10R1.27 CC(Cc1ccsc1)NN Amb27851269 [1,0,0,0,1,0|2,0,0]=4 7087 B10R1.27 CC(Cc1ccsc1)NO Amb29859686 [1,0,0,0,1,0|2,0,0]=4 7088 B10R1.27 CNC(C)Cc1ccco1 Amb5735446 [1,0,0,0,1,0|1,0,0]=3 7089 B10R1.27 CNC(C)Cc1cccs1 Amb20623809 [1,0,0,0,1,0|1,0,0]=3 7090 B10R1.27 CNC(C)Cc1cccs1 Amb5735447 [1,0,0,0,1,0|1,0,0]=3 7091 B10R1.27 CNC(C)Cc1ccno1 Amb27796673 [1,0,0,0,1,0|2,0,0]=4 7092 B10R1.27 CNC(C)Cc1ccns1 Amb35658642 [1,0,0,0,1,0|2,0,0]=4 7093 B10R1.27 CNC(C)Cc1ccoc1 Amb27205555 [1,0,0,0,1,0|1,0,0]=3 7094 B10R1.27 CNC(C)Cc1ccsc1 Amb18292049 [1,0,0,0,1,0|1,0,0]=3 7095 B10R1.27 CNC(C)Cc1ccsc1 Amb33551688 [1,0,0,0,1,0|1,0,0]=3 7096 B10R1.27 CNC(C)Cc1cscn1 Amb27823201 [1,0,0,0,1,0|2,0,0]=4 7097 B10R1.27 CNC(C)Cc1nccs1 Amb17232177 [1,0,0,0,1,0|2,0,0]=4 7098 B12R1.2197 CC(C)C(O)C1C=CCC=CC1 Amb27472656 [1,0,0,0,0,1|0,0,2]=4 7099 B12R1.2197 CN(C)C(O)=C1C=CC=CC=C1 Amb25359188 [1,0,0,0,0,1|1,0,1]=4 7100 B12R1.27 C#CC(C)CCc1ccccc1 Amb32951850 [1,0,0,0,0,1|1,0,1]=4 7101 B12R1.27 C#CC(C)NCc1ccccc1 Amb27866300 [1,0,0,0,0,1|1,0,1]=4 7102 B12R1.27 C#C[C@H](C)NCc1ccccc1 Amb28461424 [1,0,0,0,0,1|1,0,1]=4 7103 B12R1.27 C=C[C@@H](C)NCc1ccccc1 Amb27616678 [1,0,0,0,0,1|1,0,1]=4 7104 B12R1.27 CC(C#N)CCc1ccccc1 Amb8950031 [1,0,0,0,0,1|2,0,0]=4 7105 B12R1.27 CC(C#N)CNc1ccccc1 Amb8867341 [1,0,0,0,0,1|2,0,0]=4 7106 B12R1.27 CC(C#N)COc1ccccc1 Amb9028581 [1,0,0,0,0,1|2,0,0]=4 7107 B12R1.27 CC(C#N)CSc1ccccc1 Amb4014426 [1,0,0,0,0,1|2,0,0]=4 7108 B12R1.27 CC(C#N)NCc1ccccc1 Amb17044860 [1,0,0,0,0,1|2,0,0]=4 7109 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [1,0,0,0,0,1|2,0,0]=4 7110 B12R1.27 CC(C=O)CCc1ccccc1 Amb4358580 [1,0,0,0,0,1|2,0,0]=4 7111 B12R1.27 CC(C=O)CSc1ccccc1 Amb17594629 [1,0,0,0,0,1|2,0,0]=4 7112 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [1,0,0,0,0,1|2,0,0]=4 7113 B12R1.27 CC(C=O)SCc1ccccc1 Amb18648419 [1,0,0,0,0,1|2,0,0]=4 7114 B12R1.27 CC(CBr)CCc1ccccc1 Amb32954572 [1,0,0,0,0,1|2,0,0]=4 7115 B12R1.27 CC(CBr)NCc1ccccc1 Amb28318958 [1,0,0,0,0,1|2,0,0]=4 7116 B12R1.27 CC(CCc1ccccc1)ON Amb32951848 [1,0,0,0,0,1|2,0,0]=4 7117 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [1,0,0,0,0,1|2,0,0]=4 7118 B12R1.27 CC(CN)CCc1ccccc1 Amb4358596 [1,0,0,0,0,1|2,0,0]=4 7119 B12R1.27 CC(CN)COc1ccccc1 Amb9029321 [1,0,0,0,0,1|2,0,0]=4 7120 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [1,0,0,0,0,1|2,0,0]=4 7121 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [1,0,0,0,0,1|2,0,0]=4 7122 B12R1.27 CC(CN)SCc1ccccc1 Amb19024833 [1,0,0,0,0,1|2,0,0]=4 7123 B12R1.27 CC(CO)CCc1ccccc1 Amb32413001 [1,0,0,0,0,1|2,0,0]=4 7124 B12R1.27 CC(CO)COc1ccccc1 Amb17232599 [1,0,0,0,0,1|2,0,0]=4 7125 B12R1.27 CC(CO)NCc1ccccc1 Amb2697658 [1,0,0,0,0,1|2,0,0]=4 7126 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [1,0,0,0,0,1|2,0,0]=4 7127 B12R1.27 CC(COc1ccccc1)NN Amb18563755 [1,0,0,0,0,1|1,0,0]=3 7128 B12R1.27 CC(COc1ccccc1)NN Amb33552558 [1,0,0,0,0,1|1,0,0]=3 7129 B12R1.27 CC(CS)NCc1ccccc1 Amb27606358 [1,0,0,0,0,1|2,0,0]=4 7130 B12R1.27 CCC(C)CNc1cccnc1 Amb6719795 [1,0,0,0,0,1|2,0,0]=4 7131 B12R1.27 CCC(C)NCc1ccccc1 Amb5729099 [1,0,0,0,0,1|1,0,0]=3 7132 B12R1.27 CCC(C)NCc1ccccc1 Amb837601 [1,0,0,0,0,1|1,0,0]=3 7133 B12R1.27 CCC(C)NCc1ccccn1 Amb20673664 [1,0,0,0,0,1|2,0,0]=4 7134 B12R1.27 CCC(C)NCc1ccccn1 Amb6868322 [1,0,0,0,0,1|2,0,0]=4 7135 B12R1.27 CCC(C)NCc1ccccn1 Amb9749024 [1,0,0,0,0,1|2,0,0]=4 7136 B12R1.27 CCC(C)NCc1cccnc1 Amb20673665 [1,0,0,0,0,1|2,0,0]=4 7137 B12R1.27 CCC(C)NCc1cccnc1 Amb6864746 [1,0,0,0,0,1|2,0,0]=4 7138 B12R1.27 CCC(C)NCc1cccnc1 Amb9740406 [1,0,0,0,0,1|2,0,0]=4 7139 B12R1.27 CCC(C)NCc1ccncc1 Amb20673659 [1,0,0,0,0,1|2,0,0]=4 7140 B12R1.27 CCC(C)NCc1ccncc1 Amb6864745 [1,0,0,0,0,1|2,0,0]=4 7141 B12R1.27 CCC(C)NCc1ccncc1 Amb9740411 [1,0,0,0,0,1|2,0,0]=4 7142 B12R1.27 CCC(N)CCc1ccccc1 Amb9031865 [1,0,0,0,0,1|2,0,0]=4 7143 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [1,0,0,0,0,1|2,0,0]=4 7144 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [1,0,0,0,0,1|2,0,0]=4 7145 B12R1.27 CCC(N)CSc1ccccc1 Amb17485970 [1,0,0,0,0,1|2,0,0]=4 7146 B12R1.27 CCC(O)CCc1ccccc1 Amb17138574 [1,0,0,0,0,1|2,0,0]=4 7147 B12R1.27 CCC(O)CNc1ccccc1 Amb13952005 [1,0,0,0,0,1|2,0,0]=4 7148 B12R1.27 CC[C@@H](C)NCc1ccccc1 Amb28283155 [1,0,0,0,0,1|1,0,0]=3 7149 B12R1.27 CC[C@@H](O)CNc1ccccc1 Amb27793988 [1,0,0,0,0,1|2,0,0]=4 7150 B12R1.27 CC[C@H](N)CNc1ccccc1 Amb27965358 [1,0,0,0,0,1|2,0,0]=4 7151 B12R1.27 CC[C@H](O)CNc1ccccc1 Amb28071833 [1,0,0,0,0,1|2,0,0]=4 7152 B12R1.27 CNC(=N)SCc1ccccc1 Amb26537028 [1,0,0,0,0,1|1,0,1]=4 7153 B12R1.27 CNC(=O)CCc1ccccc1 Amb3886651 [1,0,0,0,0,1|1,0,1]=4 7154 B12R1.27 CNC(=O)CSc1ccccc1 Amb33545141 [1,0,0,0,0,1|1,0,1]=4 7155 B12R1.27 CNC(=O)OCc1ccccc1 Amb26883461 [1,0,0,0,0,1|1,0,1]=4 7156 B12R1.27 CNC(=O)SCc1ccccc1 Amb28243771 [1,0,0,0,0,1|1,0,1]=4 7157 B12R1.27 CNC(=S)CCc1ccccc1 Amb4430624 [1,0,0,0,0,1|1,0,1]=4 7158 B12R1.27 CNC(=S)NCc1ccccc1 Amb2684640 [1,0,0,0,0,1|1,0,1]=4 7159 B12R1.27 CNC(=S)SCc1ccccc1 Amb27202269 [1,0,0,0,0,1|1,0,1]=4 7160 B12R1.27 CNC(C)C#Cc1ccccc1 Amb27756782 [1,0,0,0,0,1|0,0,1]=3 7161 B12R1.27 CNC(C)CCc1ccccc1 Amb1138722 [1,0,0,0,0,1|0,0,0]=2 7162 B12R1.27 CNC(C)CCc1cccnc1 Amb17507452 [1,0,0,0,0,1|1,0,0]=3 7163 B12R1.27 CNC(C)CNc1cccnn1 Amb27480124 [1,0,0,0,0,1|2,0,0]=4 7164 B12R1.27 CNC(C)CSc1ccccc1 Amb32663529 [1,0,0,0,0,1|0,0,0]=2 7165 B12R1.27 CNC(C)CSc1ccccc1 Amb32664540 [1,0,0,0,0,1|0,0,0]=2 7166 B12R1.27 CN[C@H](C)CNc1ccccc1 Amb28076762 [1,0,0,0,0,1|0,0,0]=2 7167 B12R1.27 COC(C)CNc1ccncc1 Amb27748266 [1,0,0,0,0,1|2,0,0]=4 7168 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [1,0,0,0,0,1|1,0,0]=3 7169 B12R1.27 CSC(C)CNc1ccccn1 Amb28320603 [1,0,0,0,0,1|2,0,0]=4 7170 B12R1.27 CSC(C)CNc1ccncc1 Amb27403780 [1,0,0,0,0,1|2,0,0]=4 7171 B12R1.27 C[C@@H](C=O)OCc1ccccc1 Amb17609288 [1,0,0,0,0,1|2,0,0]=4 7172 B12R1.27 C[C@@H](CF)NCc1ccccc1 Amb28145925 [1,0,0,0,0,1|2,0,0]=4 7173 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [1,0,0,0,0,1|2,0,0]=4 7174 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [1,0,0,0,0,1|2,0,0]=4 7175 B12R1.27 C[C@@H](CO)OCc1ccccc1 Amb17609287 [1,0,0,0,0,1|2,0,0]=4 7176 B12R1.27 C[C@H](CF)NCc1ccccc1 Amb28066677 [1,0,0,0,0,1|2,0,0]=4 7177 B12R1.27 C[C@H](CN)NCc1ccccc1 Amb25861224 [1,0,0,0,0,1|2,0,0]=4 7178 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [1,0,0,0,0,1|2,0,0]=4 7179 B12R1.27 C\N=C(\C)OCc1ccccc1 Amb27784725 [1,0,0,0,0,1|0,0,2]=4 7180 B12R1.27 [C-]#[N+]C(C)CCc1ccccc1 Amb2689630 [1,0,0,0,0,1|0,0,2]=4 7181 B12R1.27 [C-]#[N+]C(C)COc1ccccc1 Amb28385134 [1,0,0,0,0,1|0,0,2]=4 7182 B14R1.163 CC(CO)NCC(O)c1ccccc1 Amb19052327 [0,0,0,0,0,2|2,0,0]=4 7183 B14R1.163 CCC(C)CNC(C)c1ccccc1 Amb6719459 [0,0,0,0,0,2|2,0,0]=4 7184 B14R1.163 CCC(C)NCC(C)c1ccccc1 Amb2119579 [0,0,0,0,0,2|2,0,0]=4 7185 B14R1.163 CCC(C)NCC(C)c1ccccc1 Amb6729200 [0,0,0,0,0,2|2,0,0]=4 7186 B14R1.163 CNC(=O)CCC(O)c1ccccc1 Amb17336618 [0,0,0,0,0,2|1,0,1]=4 7187 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,0,0,0,0,2|1,0,1]=4 7188 B14R1.756 C#CC(C)C(O)\C=C\c1ccccc1 Amb27588967 [0,0,0,0,0,2|1,0,1]=4 7189 B14R1.756 C=CC(C)C(O)C#Cc1ccccc1 Amb27772835 [0,0,0,0,0,2|1,0,1]=4 7190 B14R1.756 C=C[C@@H](C)[C@@H](O)C#Cc1ccccc1 Amb28188213 [0,0,0,0,0,2|1,0,1]=4 7191 B14R1.756 C=C[C@H](C)[C@H](O)C#Cc1ccccc1 Amb27397066 [0,0,0,0,0,2|1,0,1]=4 7192 B14R1.756 CC(CN)C(O)C#Cc1ccccc1 Amb27875280 [0,0,0,0,0,2|2,0,0]=4 7193 B14R1.756 CCC(C)C(C)NCc1ccccc1 Amb6719960 [0,0,0,0,0,2|2,0,0]=4 7194 B14R1.756 CCC(C)C(N)C#Cc1ccccc1 Amb27758108 [0,0,0,0,0,2|2,0,0]=4 7195 B14R1.756 CCC(C)C(N)CSc1ccccc1 Amb22642757 [0,0,0,0,0,2|2,0,0]=4 7196 B14R1.756 CCC(C)C(N)CSc1ccccc1 Amb32662454 [0,0,0,0,0,2|2,0,0]=4 7197 B14R1.756 CCC(C)C(O)C#Cc1ccccc1 Amb27650333 [0,0,0,0,0,2|1,0,0]=3 7198 B14R1.756 CCC(N)C(O)C#Cc1ccccc1 Amb35583538 [0,0,0,0,0,2|2,0,0]=4 7199 B14R1.756 CCC(O)C(O)C#Cc1ccccc1 Amb27773134 [0,0,0,0,0,2|2,0,0]=4 7200 B14R1.756 CC[C@@H](N)C(O)C#Cc1ccccc1 Amb30038900 [0,0,0,0,0,2|2,0,0]=4 7201 B14R1.756 CC[C@H](N)C(O)C#Cc1ccccc1 Amb35594883 [0,0,0,0,0,2|2,0,0]=4 7202 B14R1.756 CNC(=O)C(O)\C=C\c1ccccc1 Amb25243537 [0,0,0,0,0,2|1,0,1]=4 7203 B14R1.756 CNC(C)C(=O)C#Cc1ccccc1 Amb28142911 [0,0,0,0,0,2|0,0,2]=4 7204 B14R1.756 CNC(C)C(=O)OCc1ccccc1 Amb19061736 [0,0,0,0,0,2|0,0,2]=4 7205 B14R1.756 CNC(C)C(O)C#Cc1ccccc1 Amb35621621 [0,0,0,0,0,2|0,0,0]=2 7206 B14R1.756 CN[C@@H](C)C(=O)C#Cc1ccccc1 Amb35662587 [0,0,0,0,0,2|0,0,2]=4 7207 B14R1.756 CN[C@@H](C)C(=O)NCc1ccccc1 Amb27657297 [0,0,0,0,0,2|0,0,2]=4 7208 B14R1.756 CN[C@@H](C)C(=O)OCc1ccccc1 Amb27650608 [0,0,0,0,0,2|0,0,2]=4 7209 B14R1.756 CN[C@@H](C)C(O)C#Cc1ccccc1 Amb29889819 [0,0,0,0,0,2|0,0,0]=2 7210 B14R1.756 COC(C)C(C)NCc1ccccc1 Amb27981487 [0,0,0,0,0,2|2,0,0]=4 7211 B14R1.756 COC(C)C(N)C#Cc1ccccc1 Amb28343297 [0,0,0,0,0,2|2,0,0]=4 7212 B14R1.756 COC(C)C(O)C#Cc1ccccc1 Amb27863807 [0,0,0,0,0,2|1,0,0]=3 7213 B14R1.756 COC(C)[C@H](C)NCc1ccccc1 Amb27241761 [0,0,0,0,0,2|2,0,0]=4 7214 B14R1.756 C[C@@H](CO)[C@H](O)C#Cc1ccccc1 Amb28292114 [0,0,0,0,0,2|2,0,0]=4 7215 B14R1.756 C[C@H](CO)[C@H](O)C#Cc1ccccc1 Amb27169926 [0,0,0,0,0,2|2,0,0]=4 7216 B14R1.756 C\C=C(\C)[C@H](O)C#Cc1ccccc1 Amb27451960 [0,0,0,0,0,2|1,0,1]=4