0 B12R1.34 BrCC(Br)C(Br)c1ccccc1 Amb25114235 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.34 C#CC(=O)C(O)c1ccccc1 Amb25373683 [0,0,0,0,0,0|2,0,2]=4 2 B12R1.34 C#CC(F)C(O)c1ccccc1 Amb25129675 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.34 C#C[C@@H](O)[C@@H](O)c1ccccc1 Amb25138509 [0,0,0,0,0,0|2,0,1]=3 4 B12R1.34 C#C[C@H](F)[C@@H](O)c1ccccc1 Amb24733476 [0,0,0,0,0,0|2,0,1]=3 5 B12R1.34 C#C[C@H](O)[C@@H](O)c1ccccc1 Amb24748425 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.34 C=C(C=C)C(O)c1ccccc1 Amb25334723 [0,0,0,0,0,0|1,0,3]=4 7 B12R1.34 C=C(C=C)[C@@H](O)c1ccccc1 Amb25215362 [0,0,0,0,0,0|1,0,3]=4 8 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [0,0,0,0,0,0|2,0,2]=4 9 B12R1.34 C=C(CO)C(O)c1ccccc1 Amb24671500 [0,0,0,0,0,0|2,0,2]=4 10 B12R1.34 C=CC(C(c1ccccc1)O)C Amb10567365 [0,0,0,0,0,0|1,0,1]=2 11 B12R1.34 C=CC(Cl)C(O)c1ccccc1 Amb24374608 [0,0,0,0,0,0|2,0,1]=3 12 B12R1.34 C=CC(N)C(O)c1ccccc1 Amb24106047 [0,0,0,0,0,0|2,0,1]=3 13 B12R1.34 C=CC(O)C(N)c1ccccc1 Amb22831164 [0,0,0,0,0,0|3,0,1]=4 14 B12R1.34 C=CC(O)C(O)c1c[n]ccc1 Amb24431863 [0,0,0,0,0,0|3,0,1]=4 15 B12R1.34 C=CC(O)C(O)c1ccccc1 Amb24704468 [0,0,0,0,0,0|2,0,1]=3 16 B12R1.34 C=CC(O)[C@H](N)c1ccccc1 Amb24468873 [0,0,0,0,0,0|3,0,1]=4 17 B12R1.34 C=C[C@@H](N)[C@H](O)c1ccccc1 Amb24386492 [0,0,0,0,0,0|2,0,1]=3 18 B12R1.34 C=C[C@@H](O)[C@@H](N)c1ccccc1 Amb25375938 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.34 C=C[C@@H](O)[C@@H](O)c1c[n]ccc1 Amb25157964 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.34 C=C[C@@H](O)[C@@H](O)c1ccccc1 Amb25279737 [0,0,0,0,0,0|2,0,1]=3 21 B12R1.34 C=C[C@H](Cl)[C@@H](O)c1ccccc1 Amb25241929 [0,0,0,0,0,0|2,0,1]=3 22 B12R1.34 C=C[C@H](N)[C@@H](N)c1ccccc1 Amb25758971 [0,0,0,0,0,0|3,0,1]=4 23 B12R1.34 C=C[C@H](O)[C@@H](O)c1ccccc1 Amb25859224 [0,0,0,0,0,0|2,0,1]=3 24 B12R1.34 C=C[C@H](O)[C@H](O)c1ccccc1 Amb25058473 [0,0,0,0,0,0|2,0,1]=3 25 B12R1.34 CC(=C=C)C(O)c1cccc[n]1 Amb25158040 [0,0,0,0,0,0|2,0,2]=4 26 B12R1.34 CC(=C=C)[C@H](O)c1ccccc1 Amb24352242 [0,0,0,0,0,0|1,0,2]=3 27 B12R1.34 CC(C#C)C(O)c1ccccc1 Amb25145323 [0,0,0,0,0,0|1,0,1]=2 28 B12R1.34 CC(C#N)C(O)c1cc[n]cc1 Amb25790725 [0,0,0,0,0,0|3,0,0]=3 29 B12R1.34 CC(C#N)C(O)c1ccc[n]c1 Amb25127430 [0,0,0,0,0,0|3,0,0]=3 30 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [0,0,0,0,0,0|3,0,1]=4 31 B12R1.34 CC(C(Br)CC)c1cccc[n]1 Amb24737683 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [0,0,0,0,0,0|3,0,0]=3 34 B12R1.34 CC(C(C)CN)c1c[n]ccc1 Amb18828712 [0,0,0,0,0,0|4,0,0]=4 35 B12R1.34 CC(C(C)CN)c1ccccc1 Amb18829124 [0,0,0,0,0,0|3,0,0]=3 36 B12R1.34 CC(C(C)NN)c1ccccc1 Amb24488638 [0,0,0,0,0,0|2,0,0]=2 37 B12R1.34 CC(C(Cl)C#N)c1ccccc1 Amb18791080 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [0,0,0,0,0,0|4,0,0]=4 39 B12R1.34 CC(C(F)CO)c1ccccc1 Amb25316277 [0,0,0,0,0,0|4,0,0]=4 40 B12R1.34 CC(C(N)C#C)c1ccccc1 Amb25159878 [0,0,0,0,0,0|3,0,1]=4 41 B12R1.34 CC(C(N)C#N)c1ccccc1 Amb18953074 [0,0,0,0,0,0|4,0,0]=4 42 B12R1.34 CC(C(N)CC)c1cc[n]cc1 Amb18828706 [0,0,0,0,0,0|4,0,0]=4 43 B12R1.34 CC(C(N)CC)c1cccc[n]1 Amb18828694 [0,0,0,0,0,0|4,0,0]=4 44 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [0,0,0,0,0,0|3,0,0]=3 45 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [0,0,0,0,0,0|3,0,0]=3 46 B12R1.34 CC(C(N)CN)c1ccccc1 Amb18972125 [0,0,0,0,0,0|4,0,0]=4 47 B12R1.34 CC(C(N)CO)c1ccccc1 Amb18975503 [0,0,0,0,0,0|4,0,0]=4 48 B12R1.34 CC(C(N)CO)c1ccccc1 Amb19349648 [0,0,0,0,0,0|4,0,0]=4 49 B12R1.34 CC(C(O)C#C)c1ccccc1 Amb25700248 [0,0,0,0,0,0|3,0,1]=4 50 B12R1.34 CC(C(O)C#N)c1ccccc1 Amb18788076 [0,0,0,0,0,0|4,0,0]=4 51 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [0,0,0,0,0,0|3,0,1]=4 52 B12R1.34 CC(C(O)CC)c1cccc[n]1 Amb24367087 [0,0,0,0,0,0|4,0,0]=4 53 B12R1.34 CC(C=C)C(N)c1cccc[n]1 Amb25159295 [0,0,0,0,0,0|3,0,1]=4 54 B12R1.34 CC(C=C)C(O)c1cc[n]cc1 Amb24688275 [0,0,0,0,0,0|2,0,1]=3 55 B12R1.34 CC(C=C)C(O)c1ccc[n]c1 Amb25681403 [0,0,0,0,0,0|2,0,1]=3 56 B12R1.34 CC(C=O)C(=O)c1ccccc1 Amb18645647 [0,0,0,0,0,0|2,0,2]=4 57 B12R1.34 CC(C=O)C(O)c1cc[n]cc1 Amb25735254 [0,0,0,0,0,0|3,0,0]=3 58 B12R1.34 CC(C=O)C(O)c1ccc[n]c1 Amb24669013 [0,0,0,0,0,0|3,0,0]=3 59 B12R1.34 CC(CC)C(Br)c1ccccc1 Amb24618999 [0,0,0,0,0,0|2,0,0]=2 60 B12R1.34 CC(CC)C(Cl)c1c[n]ccc1 Amb25156869 [0,0,0,0,0,0|3,0,0]=3 61 B12R1.34 CC(CC)C(Cl)c1ccccc1 Amb19057046 [0,0,0,0,0,0|2,0,0]=2 62 B12R1.34 CC(CC)C(N)c1c[n]c[n]c1 Amb18199662 [0,0,0,0,0,0|4,0,0]=4 63 B12R1.34 CC(CC)C(N)c1c[n]cc[n]1 Amb24694964 [0,0,0,0,0,0|4,0,0]=4 64 B12R1.34 CC(CC)C(N)c1cc[n]c[n]1 Amb18199657 [0,0,0,0,0,0|4,0,0]=4 65 B12R1.34 CC(CC)C(N)c1cc[n]cc1 Amb18828651 [0,0,0,0,0,0|3,0,0]=3 66 B12R1.34 CC(CC)C(N)c1cccc[n]1 Amb25674376 [0,0,0,0,0,0|3,0,0]=3 67 B12R1.34 CC(CC)C(O)c1c[n][n]cc1 Amb24359599 [0,0,0,0,0,0|3,0,0]=3 68 B12R1.34 CC(CC)C(O)c1c[n]c[n]c1 Amb25313030 [0,0,0,0,0,0|3,0,0]=3 69 B12R1.34 CC(CC)C(O)c1c[n]cc[n]1 Amb24469031 [0,0,0,0,0,0|3,0,0]=3 70 B12R1.34 CC(CC)C(O)c1c[n]ccc1 Amb24665088 [0,0,0,0,0,0|2,0,0]=2 71 B12R1.34 CC(CC)C(O)c1cc[n]c[n]1 Amb25327991 [0,0,0,0,0,0|3,0,0]=3 72 B12R1.34 CC(CC)C(O)c1cc[n]cc1 Amb24446286 [0,0,0,0,0,0|2,0,0]=2 73 B12R1.34 CC(CC)C(O)c1cccc[n]1 Amb24437193 [0,0,0,0,0,0|2,0,0]=2 74 B12R1.34 CC(CC)C(O)c1ccccc1 Amb18792585 [0,0,0,0,0,0|1,0,0]=1 75 B12R1.34 CC(CC)[C@@H](N)c1c[n]ccc1 Amb25201730 [0,0,0,0,0,0|3,0,0]=3 76 B12R1.34 CC(CC)[C@@H](N)c1ccccc1 Amb23438852 [0,0,0,0,0,0|2,0,0]=2 77 B12R1.34 CC(CC)[C@@H](O)c1ccccc1 Amb25158043 [0,0,0,0,0,0|1,0,0]=1 78 B12R1.34 CC(CN)C(=O)c1ccccc1 Amb18829249 [0,0,0,0,0,0|2,0,2]=4 79 B12R1.34 CC(CN)C(O)c1cc[n]c[n]1 Amb24539872 [0,0,0,0,0,0|4,0,0]=4 80 B12R1.34 CC(CN)C(O)c1ccc[n]c1 Amb25762523 [0,0,0,0,0,0|3,0,0]=3 81 B12R1.34 CC(CN)C(O)c1cccc[n]1 Amb25380785 [0,0,0,0,0,0|3,0,0]=3 82 B12R1.34 CC(CN)C(O)c1ccccc1 Amb18646366 [0,0,0,0,0,0|2,0,0]=2 83 B12R1.34 CC(CN)S(=O)c1ccccc1 Amb24469474 [0,0,0,0,0,0|3,0,1]=4 84 B12R1.34 CC(CO)C(N)c1ccccc1 Amb18646383 [0,0,0,0,0,0|3,0,0]=3 85 B12R1.34 CC(CO)C(O)c1c[n]ccc1 Amb25036612 [0,0,0,0,0,0|3,0,0]=3 86 B12R1.34 CC(CO)C(O)c1cc[n]cc1 Amb24412972 [0,0,0,0,0,0|3,0,0]=3 87 B12R1.34 CC(CO)C(O)c1ccccc1 Amb25220934 [0,0,0,0,0,0|2,0,0]=2 88 B12R1.34 CC(CO)[C@@H](O)c1ccccc1 Amb25832639 [0,0,0,0,0,0|2,0,0]=2 89 B12R1.34 CC(N(C)C=O)c1ccccc1 Amb17672989 [0,0,0,0,0,0|4,0,0]=4 90 B12R1.34 CC(N=O)C(=O)c1ccccc1 Amb24545660 [0,0,0,0,0,0|1,0,3]=4 91 B12R1.34 CC(NC)C(N)c1ccccc1 Amb24652517 [0,0,0,0,0,0|1,0,0]=1 92 B12R1.34 CC(NC)C(O)c1c[n]ccc1 Amb24728174 [0,0,0,0,0,0|1,0,0]=1 93 B12R1.34 CC(NC)C(O)c1ccccc1 Amb20246611 [0,0,0,0,0,0|0,0,0]=0 94 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22489693 [0,0,0,0,0,0|0,0,0]=0 95 B12R1.34 CC(NC)C(O)c1ccccc1 Amb22729748 [0,0,0,0,0,0|0,0,0]=0 96 B12R1.34 CC(NO)C(=O)c1ccccc1 Amb25130640 [0,0,0,0,0,0|1,0,2]=3 97 B12R1.34 CC(OC)C(Cl)c1ccccc1 Amb24391584 [0,0,0,0,0,0|2,0,0]=2 98 B12R1.34 CC(OC)C(N)c1c[n]cc[n]1 Amb24382961 [0,0,0,0,0,0|4,0,0]=4 99 B12R1.34 CC(OC)C(N)c1c[n]ccc1 Amb25307005 [0,0,0,0,0,0|3,0,0]=3 100 B12R1.34 CC(OC)C(O)c1c[n]c[n]c1 Amb24720027 [0,0,0,0,0,0|3,0,0]=3 101 B12R1.34 CC(OC)C(O)c1c[n]ccc1 Amb25847380 [0,0,0,0,0,0|2,0,0]=2 102 B12R1.34 CC(OC)C(O)c1ccccc1 Amb18801037 [0,0,0,0,0,0|1,0,0]=1 103 B12R1.34 CC(SC)C(N)c1ccccc1 Amb18648548 [0,0,0,0,0,0|2,0,0]=2 104 B12R1.34 CC(SC)[C@H](O)c1ccccc1 Amb24648340 [0,0,0,0,0,0|1,0,0]=1 105 B12R1.34 CC([NH2+]C)C(O)c1ccccc1 Amb22334155 [0,0,0,0,0,0|0,0,1]=1 106 B12R1.34 CC(c1ccccc1)N(C)N=O Amb24408926 [0,0,0,0,0,0|3,0,1]=4 107 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [0,0,0,0,0,0|2,0,2]=4 108 B12R1.34 CCC(=C)C(O)c1ccc[n]c1 Amb24752184 [0,0,0,0,0,0|2,0,2]=4 109 B12R1.34 CCC(=C)[C@@H](O)c1ccccc1 Amb25356347 [0,0,0,0,0,0|1,0,2]=3 110 B12R1.34 CCC(=O)C(O)c1cc[n]cc1 Amb25298507 [0,0,0,0,0,0|3,0,1]=4 111 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [0,0,0,0,0,0|3,0,1]=4 112 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [0,0,0,0,0,0|3,0,1]=4 113 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [0,0,0,0,0,0|3,0,1]=4 114 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [0,0,0,0,0,0|3,0,1]=4 115 B12R1.34 CCC(C(=O)c1ccccc1)N Amb17138555 [0,0,0,0,0,0|2,0,2]=4 116 B12R1.34 CCC(C)C(=C)c1ccccc1 Amb24598173 [0,0,0,0,0,0|2,0,1]=3 117 B12R1.34 CCC(C)C(=O)c1cccc[n]1 Amb24649735 [0,0,0,0,0,0|2,0,2]=4 118 B12R1.34 CCC(C)N(C)c1ccccc1 Amb24525678 [0,0,0,0,0,0|3,0,0]=3 119 B12R1.34 CCC(Cl)C(=O)c1ccccc1 Amb19074252 [0,0,0,0,0,0|2,0,2]=4 120 B12R1.34 CCC(Cl)C(Cl)c1ccccc1 Amb25039087 [0,0,0,0,0,0|3,0,0]=3 121 B12R1.34 CCC(F)C(O)c1ccccc1 Amb25158096 [0,0,0,0,0,0|2,0,0]=2 122 B12R1.34 CCC(I)C(=O)c1ccccc1 Amb20621476 [0,0,0,0,0,0|2,0,2]=4 123 B12R1.34 CCC(N)C(=O)c1ccccc1 Amb22549075 [0,0,0,0,0,0|2,0,2]=4 124 B12R1.34 CCC(N)C(N)c1c[n]ccc1 Amb24558425 [0,0,0,0,0,0|4,0,0]=4 125 B12R1.34 CCC(N)C(N)c1cccc[n]1 Amb25261365 [0,0,0,0,0,0|4,0,0]=4 126 B12R1.34 CCC(N)C(N)c1ccccc1 Amb25765179 [0,0,0,0,0,0|3,0,0]=3 127 B12R1.34 CCC(N)C(O)c1[n]ccc[n]1 Amb24587303 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.34 CCC(N)C(O)c1c[n]c[n]c1 Amb24692022 [0,0,0,0,0,0|4,0,0]=4 129 B12R1.34 CCC(N)C(O)c1cc[n]c[n]1 Amb25678439 [0,0,0,0,0,0|4,0,0]=4 130 B12R1.34 CCC(N)C(O)c1ccccc1 Amb19373101 [0,0,0,0,0,0|2,0,0]=2 131 B12R1.34 CCC(O)C(=O)c1ccccc1 Amb18800792 [0,0,0,0,0,0|2,0,2]=4 132 B12R1.34 CCC(O)C(N)c1ccc[n]c1 Amb25343553 [0,0,0,0,0,0|4,0,0]=4 133 B12R1.34 CCC(O)C(O)c1c[n]c[n]c1 Amb25088948 [0,0,0,0,0,0|4,0,0]=4 134 B12R1.34 CCC(O)C(O)c1c[n]cc[n]1 Amb25280326 [0,0,0,0,0,0|4,0,0]=4 135 B12R1.34 CCC(O)C(O)c1c[n]ccc1 Amb25354449 [0,0,0,0,0,0|3,0,0]=3 136 B12R1.34 CCC(O)C(O)c1cc[n]cc1 Amb24524979 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.34 CCC(O)C(O)c1cccc[n]1 Amb25769439 [0,0,0,0,0,0|3,0,0]=3 138 B12R1.34 CC[C@@H](C)C(=O)c1ccccc1 Amb24724257 [0,0,0,0,0,0|1,0,2]=3 139 B12R1.34 CC[C@@H](N)C(=O)c1ccccc1 Amb24595929 [0,0,0,0,0,0|2,0,2]=4 140 B12R1.34 CC[C@@H](N)[C@@H](N)c1ccccc1 Amb25151083 [0,0,0,0,0,0|3,0,0]=3 141 B12R1.34 CC[C@@H](N)[C@H](O)c1[n]ccc[n]1 Amb24542736 [0,0,0,0,0,0|4,0,0]=4 142 B12R1.34 CC[C@@H](N)[C@H](O)c1ccc[n]c1 Amb25228779 [0,0,0,0,0,0|3,0,0]=3 143 B12R1.34 CC[C@@H](N)[C@H](O)c1ccccc1 Amb25793544 [0,0,0,0,0,0|2,0,0]=2 144 B12R1.34 CC[C@@H](O)C(=O)c1ccccc1 Amb24691713 [0,0,0,0,0,0|2,0,2]=4 145 B12R1.34 CC[C@@H](O)[C@@H](N)c1cc[n]cc1 Amb25251848 [0,0,0,0,0,0|4,0,0]=4 146 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccc[n]c1 Amb24450166 [0,0,0,0,0,0|4,0,0]=4 147 B12R1.34 CC[C@@H](O)[C@@H](N)c1cccc[n]1 Amb25714479 [0,0,0,0,0,0|4,0,0]=4 148 B12R1.34 CC[C@@H](O)[C@@H](N)c1ccccc1 Amb25760697 [0,0,0,0,0,0|3,0,0]=3 149 B12R1.34 CC[C@@H](O)[C@H](N)c1ccccc1 Amb25301206 [0,0,0,0,0,0|3,0,0]=3 150 B12R1.34 CC[C@H](C)C(=O)c1ccccc1 Amb24378367 [0,0,0,0,0,0|1,0,2]=3 151 B12R1.34 CC[C@H](N)C(=O)c1ccccc1 Amb25302294 [0,0,0,0,0,0|2,0,2]=4 152 B12R1.34 CC[C@H](N)[C@@H](N)c1cc[n]cc1 Amb24744764 [0,0,0,0,0,0|4,0,0]=4 153 B12R1.34 CC[C@H](N)[C@@H](O)c1c[n]c[n]c1 Amb25264880 [0,0,0,0,0,0|4,0,0]=4 154 B12R1.34 CC[C@H](N)[C@@H](O)c1ccccc1 Amb24677748 [0,0,0,0,0,0|2,0,0]=2 155 B12R1.34 CC[C@H](N)[C@H](O)c1[n]ccc[n]1 Amb24542887 [0,0,0,0,0,0|4,0,0]=4 156 B12R1.34 CC[C@H](N)[C@H](O)c1c[n]c[n]c1 Amb25201717 [0,0,0,0,0,0|4,0,0]=4 157 B12R1.34 CC[C@H](O)C(=O)c1ccccc1 Amb25799278 [0,0,0,0,0,0|2,0,2]=4 158 B12R1.34 CC[C@H](O)[C@@H](O)c1ccccc1 Amb25280169 [0,0,0,0,0,0|2,0,0]=2 159 B12R1.34 CC[C@H](O)[C@H](N)c1cc[n]cc1 Amb25245868 [0,0,0,0,0,0|4,0,0]=4 160 B12R1.34 CC[C@H](O)[C@H](N)c1cccc[n]1 Amb25159912 [0,0,0,0,0,0|4,0,0]=4 161 B12R1.34 CN(C(=N)NC)c1ccccc1 Amb18798220 [0,0,0,0,0,0|3,0,1]=4 162 B12R1.34 CN(C(=O)NC)c1ccccc1 Amb24488531 [0,0,0,0,0,0|3,0,1]=4 163 B12R1.34 CN(CC)C(=O)c1ccccc1 Amb24096608 [0,0,0,0,0,0|2,0,2]=4 164 B12R1.34 CN(N=O)C(O)c1ccccc1 Amb25343971 [0,0,0,0,0,0|2,0,1]=3 165 B12R1.34 CN(NC)C(=O)c1ccccc1 Amb25174185 [0,0,0,0,0,0|1,0,2]=3 166 B12R1.34 CNC(=O)C(=O)c1ccccc1 Amb17334577 [0,0,0,0,0,0|1,0,3]=4 167 B12R1.34 CNC(=O)C(C)c1ccc[n]c1 Amb25093295 [0,0,0,0,0,0|3,0,1]=4 168 B12R1.34 CNC(=O)C(Cl)c1ccc[n]c1 Amb19075150 [0,0,0,0,0,0|3,0,1]=4 169 B12R1.34 CNC(=O)C(N)c1cc[n]cc1 Amb24396250 [0,0,0,0,0,0|3,0,1]=4 170 B12R1.34 CNC(=O)C(O)c1cc[n]cc1 Amb24497547 [0,0,0,0,0,0|2,0,1]=3 171 B12R1.34 CNC(=O)C(c1ccccc1)N Amb10609276 [0,0,0,0,0,0|2,0,1]=3 172 B12R1.34 CNC(=O)C(c1ccccc1)O Amb17400179 [0,0,0,0,0,0|1,0,1]=2 173 B12R1.34 CNC(=O)N(N)c1ccccc1 Amb18646326 [0,0,0,0,0,0|3,0,1]=4 174 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [0,0,0,0,0,0|2,0,1]=3 175 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [0,0,0,0,0,0|2,0,1]=3 176 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [0,0,0,0,0,0|2,0,1]=3 177 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [0,0,0,0,0,0|1,0,1]=2 178 B12R1.34 CNC(=O)[C@H](c1ccccc1)N Amb17232478 [0,0,0,0,0,0|2,0,1]=3 179 B12R1.34 CNC(=S)C(C)c1ccccc1 Amb24756688 [0,0,0,0,0,0|2,0,1]=3 180 B12R1.34 CNC(=S)N(N)c1ccccc1 Amb25732915 [0,0,0,0,0,0|3,0,1]=4 181 B12R1.34 CNC(=S)[C@@H](C)c1ccccc1 Amb24383001 [0,0,0,0,0,0|2,0,1]=3 182 B12R1.34 CNC(C(=O)c1ccccc1)C Amb17616803 [0,0,0,0,0,0|0,0,2]=2 183 B12R1.34 CNC(C(c1ccccc1)Cl)C Amb17594731 [0,0,0,0,0,0|1,0,0]=1 184 B12R1.34 CNC(C)C(=O)c1c[n]c[n]c1 Amb25789690 [0,0,0,0,0,0|2,0,2]=4 185 B12R1.34 CNC(C)C(=O)c1c[n]cc[n]1 Amb25154042 [0,0,0,0,0,0|2,0,2]=4 186 B12R1.34 CNC(C)C(=O)c1cc[n]cc1 Amb25381151 [0,0,0,0,0,0|1,0,2]=3 187 B12R1.34 CNC(C)C(C)c1cc[n]cc1 Amb24366596 [0,0,0,0,0,0|2,0,0]=2 188 B12R1.34 CNC(C)C(C)c1cccc[n]1 Amb25751315 [0,0,0,0,0,0|2,0,0]=2 189 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [0,0,0,0,0,0|1,0,0]=1 190 B12R1.34 CN[C@@H](C)C(=C)c1ccccc1 Amb24758988 [0,0,0,0,0,0|1,0,1]=2 191 B12R1.34 CN[C@@H](C)C(=O)c1ccccc1 Amb25312230 [0,0,0,0,0,0|0,0,2]=2 192 B12R1.34 CN[C@@H](C)[C@@H](C)c1ccccc1 Amb25674163 [0,0,0,0,0,0|1,0,0]=1 193 B12R1.34 CN[C@@H]([C@H](c1ccccc1)O)C Amb17613676 [0,0,0,0,0,0|0,0,0]=0 194 B12R1.34 CN[C@H](C)C(=C)c1ccccc1 Amb24697574 [0,0,0,0,0,0|1,0,1]=2 195 B12R1.34 CN[C@H](C)[C@@H](C)c1ccccc1 Amb24373827 [0,0,0,0,0,0|1,0,0]=1 196 B12R1.34 COC(=N)C(C)c1ccccc1 Amb24095998 [0,0,0,0,0,0|3,0,1]=4 197 B12R1.34 COC(=N)C(N)c1ccccc1 Amb22471822 [0,0,0,0,0,0|3,0,1]=4 198 B12R1.34 COC(=N)[C@H](O)c1ccccc1 Amb25832728 [0,0,0,0,0,0|2,0,1]=3 199 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [0,0,0,0,0,0|3,0,1]=4 200 B12R1.34 COC(=O)C(O)c1cc[n]cc1 Amb23580591 [0,0,0,0,0,0|3,0,1]=4 201 B12R1.34 COC(=O)C(O)c1ccc[n]c1 Amb18805578 [0,0,0,0,0,0|3,0,1]=4 202 B12R1.34 COC(=O)C(O)c1ccc[n]c1 Amb19351687 [0,0,0,0,0,0|3,0,1]=4 203 B12R1.34 COC(=O)C(O)c1ccccc1 Amb22500374 [0,0,0,0,0,0|2,0,1]=3 204 B12R1.34 COC(=O)C(c1ccccc1)C Amb16185437 [0,0,0,0,0,0|3,0,1]=4 205 B12R1.34 COC(=O)C(c1ccccc1)Cl Amb1212399 [0,0,0,0,0,0|3,0,1]=4 206 B12R1.34 COC(=O)C(c1ccccc1)N Amb1196141 [0,0,0,0,0,0|3,0,1]=4 207 B12R1.34 COC(=O)C(c1ccccc1)N Amb1911591 [0,0,0,0,0,0|3,0,1]=4 208 B12R1.34 COC(=O)N(O)c1ccccc1 Amb25174008 [0,0,0,0,0,0|3,0,1]=4 209 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [0,0,0,0,0,0|3,0,1]=4 210 B12R1.34 COC(=O)[C@H](Cl)c1ccccc1 Amb25210876 [0,0,0,0,0,0|3,0,1]=4 211 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [0,0,0,0,0,0|3,0,1]=4 212 B12R1.34 COC(Br)C(=O)c1ccccc1 Amb25729950 [0,0,0,0,0,0|2,0,2]=4 213 B12R1.34 COC(C(c1ccccc1)N)C Amb1139088 [0,0,0,0,0,0|2,0,0]=2 214 B12R1.34 COC(C)C(=O)c1cccc[n]1 Amb24434623 [0,0,0,0,0,0|2,0,2]=4 215 B12R1.34 COC(Cl)C(Cl)c1ccccc1 Amb24539299 [0,0,0,0,0,0|3,0,0]=3 216 B12R1.34 COC(O)C(=O)c1ccccc1 Amb24416714 [0,0,0,0,0,0|2,0,2]=4 217 B12R1.34 COC(O)C(N)c1ccccc1 Amb24599253 [0,0,0,0,0,0|3,0,0]=3 218 B12R1.34 COP(=O)[C@@H](O)c1ccccc1 Amb25065497 [0,0,0,0,0,0|3,0,0]=3 219 B12R1.34 CO[C@@H](C)C(=O)c1cccc[n]1 Amb25035202 [0,0,0,0,0,0|2,0,2]=4 220 B12R1.34 CO[C@@H](C)C(=O)c1ccccc1 Amb25116501 [0,0,0,0,0,0|1,0,2]=3 221 B12R1.34 CO[C@H](N)[C@@H](O)c1ccccc1 Amb25322160 [0,0,0,0,0,0|2,0,0]=2 222 B12R1.34 CO[C@H](O)C(=O)c1ccccc1 Amb25735094 [0,0,0,0,0,0|2,0,2]=4 223 B12R1.34 CSC(C(=O)c1ccccc1)O Amb17594697 [0,0,0,0,0,0|2,0,2]=4 224 B12R1.34 CSC(C)C(=O)c1ccccc1 Amb18796322 [0,0,0,0,0,0|1,0,2]=3 225 B12R1.34 C[C@@H](C(=O)NN)c1ccccc1 Amb25361548 [0,0,0,0,0,0|3,0,1]=4 226 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [0,0,0,0,0,0|3,0,1]=4 227 B12R1.34 C[C@@H](C=C)C(=O)c1ccccc1 Amb24621322 [0,0,0,0,0,0|1,0,3]=4 228 B12R1.34 C[C@@H](C=C)[C@@H](N)c1ccccc1 Amb25837307 [0,0,0,0,0,0|2,0,1]=3 229 B12R1.34 C[C@@H](C=C)[C@@H](O)c1ccccc1 Amb25071531 [0,0,0,0,0,0|1,0,1]=2 230 B12R1.34 C[C@@H](C=C)[C@H](N)c1ccccc1 Amb25053412 [0,0,0,0,0,0|2,0,1]=3 231 B12R1.34 C[C@@H](C=C)[C@H](O)c1cccc[n]1 Amb25306439 [0,0,0,0,0,0|2,0,1]=3 232 B12R1.34 C[C@@H](C=C)[C@H](O)c1ccccc1 Amb25347648 [0,0,0,0,0,0|1,0,1]=2 233 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [0,0,0,0,0,0|2,0,0]=2 234 B12R1.34 C[C@@H](C=O)[C@@H](O)c1ccc[n]c1 Amb25767826 [0,0,0,0,0,0|3,0,0]=3 235 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [0,0,0,0,0,0|2,0,0]=2 236 B12R1.34 C[C@@H](CN)[C@@H](N)c1ccccc1 Amb25738664 [0,0,0,0,0,0|3,0,0]=3 237 B12R1.34 C[C@@H](CN)[C@@H](O)c1ccccc1 Amb24711275 [0,0,0,0,0,0|2,0,0]=2 238 B12R1.34 C[C@@H](CO)C(O)c1ccccc1 Amb25769383 [0,0,0,0,0,0|2,0,0]=2 239 B12R1.34 C[C@@H](CO)S(=O)c1ccccc1 Amb24733124 [0,0,0,0,0,0|3,0,1]=4 240 B12R1.34 C[C@@H](CO)[C@@H](N)c1ccccc1 Amb25152441 [0,0,0,0,0,0|3,0,0]=3 241 B12R1.34 C[C@@H](CO)[C@@H](O)c1ccccc1 Amb24497744 [0,0,0,0,0,0|2,0,0]=2 242 B12R1.34 C[C@@H](CO)[C@H](N)c1ccccc1 Amb25320937 [0,0,0,0,0,0|3,0,0]=3 243 B12R1.34 C[C@@H](CO)[C@H](O)c1c[n]ccc1 Amb24407542 [0,0,0,0,0,0|3,0,0]=3 244 B12R1.34 C[C@@H](CO)[C@H](O)c1ccccc1 Amb24412993 [0,0,0,0,0,0|2,0,0]=2 245 B12R1.34 C[C@@H](NC)C(Cl)c1ccccc1 Amb25366190 [0,0,0,0,0,0|1,0,0]=1 246 B12R1.34 C[C@@H](NC)C(O)c1ccccc1 Amb25095866 [0,0,0,0,0,0|0,0,0]=0 247 B12R1.34 C[C@@H](NC)[C@@H](O)c1ccccc1 Amb22366967 [0,0,0,0,0,0|0,0,0]=0 248 B12R1.34 C[C@@H](NC)[C@@H](S)c1ccccc1 Amb25302304 [0,0,0,0,0,0|0,1,0]=1 249 B12R1.34 C[C@@H](NC)[C@H](F)c1ccccc1 Amb24367049 [0,0,0,0,0,0|1,0,0]=1 250 B12R1.34 C[C@@H](NC)[C@H](O)c1ccccc1 Amb19133732 [0,0,0,0,0,0|0,0,0]=0 251 B12R1.34 C[C@@H](OC)[C@@H](Cl)c1ccccc1 Amb25751354 [0,0,0,0,0,0|2,0,0]=2 252 B12R1.34 C[C@@H](OC)[C@@H](O)c1ccccc1 Amb24464720 [0,0,0,0,0,0|1,0,0]=1 253 B12R1.34 C[C@@H](SC)[C@@H](O)c1ccccc1 Amb25106008 [0,0,0,0,0,0|1,0,0]=1 254 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [0,0,0,0,0,0|4,0,0]=4 255 B12R1.34 C[C@@H]([C@@H](F)CO)c1ccccc1 Amb24362837 [0,0,0,0,0,0|4,0,0]=4 256 B12R1.34 C[C@@H]([C@@H](O)C#N)c1ccccc1 Amb25099408 [0,0,0,0,0,0|4,0,0]=4 257 B12R1.34 C[C@@H]([C@@H](O)CF)c1ccccc1 Amb24372036 [0,0,0,0,0,0|4,0,0]=4 258 B12R1.34 C[C@@H]([C@@H](O)CO)c1ccccc1 Amb24662545 [0,0,0,0,0,0|4,0,0]=4 259 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [0,0,0,0,0,0|4,0,0]=4 260 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [0,0,0,0,0,0|3,0,0]=3 261 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [0,0,0,0,0,0|3,0,1]=4 262 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [0,0,0,0,0,0|4,0,0]=4 263 B12R1.34 C[C@H](C=C)[C@@H](O)c1cc[n]cc1 Amb24576652 [0,0,0,0,0,0|2,0,1]=3 264 B12R1.34 C[C@H](C=C)[C@H](O)c1ccccc1 Amb25246183 [0,0,0,0,0,0|1,0,1]=2 265 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [0,0,0,0,0,0|2,0,0]=2 266 B12R1.34 C[C@H](CC)C(O)c1ccccc1 Amb24735208 [0,0,0,0,0,0|1,0,0]=1 267 B12R1.34 C[C@H](CC)[C@@H](O)c1ccccc1 Amb25047673 [0,0,0,0,0,0|1,0,0]=1 268 B12R1.34 C[C@H](CN)[C@@H](N)c1ccccc1 Amb25669594 [0,0,0,0,0,0|3,0,0]=3 269 B12R1.34 C[C@H](CN)[C@@H](O)c1ccccc1 Amb24710137 [0,0,0,0,0,0|2,0,0]=2 270 B12R1.34 C[C@H](CO)C(=O)c1ccccc1 Amb25139941 [0,0,0,0,0,0|2,0,2]=4 271 B12R1.34 C[C@H](CO)[C@@H](N)c1ccccc1 Amb24373854 [0,0,0,0,0,0|3,0,0]=3 272 B12R1.34 C[C@H](CO)[C@@H](O)c1c[n]ccc1 Amb24675561 [0,0,0,0,0,0|3,0,0]=3 273 B12R1.34 C[C@H](CO)[C@@H](O)c1ccccc1 Amb25687837 [0,0,0,0,0,0|2,0,0]=2 274 B12R1.34 C[C@H](CO)[C@H](O)c1c[n]ccc1 Amb25221434 [0,0,0,0,0,0|3,0,0]=3 275 B12R1.34 C[C@H](CO)[C@H](O)c1ccccc1 Amb24448086 [0,0,0,0,0,0|2,0,0]=2 276 B12R1.34 C[C@H](NC)[C@@H](Cl)c1ccccc1 Amb24692816 [0,0,0,0,0,0|1,0,0]=1 277 B12R1.34 C[C@H](NC)[C@@H](S)c1ccccc1 Amb24453442 [0,0,0,0,0,0|0,1,0]=1 278 B12R1.34 C[C@H](NC)[C@H](N)c1ccccc1 Amb24739761 [0,0,0,0,0,0|1,0,0]=1 279 B12R1.34 C[C@H](NC)[C@H](O)c1ccccc1 Amb22351362 [0,0,0,0,0,0|0,0,0]=0 280 B12R1.34 C[C@H](NC)[C@H](S)c1ccccc1 Amb24727185 [0,0,0,0,0,0|0,1,0]=1 281 B12R1.34 C[C@H](NN)[C@H](O)c1ccccc1 Amb25346319 [0,0,0,0,0,0|1,0,0]=1 282 B12R1.34 C[C@H](NO)[C@H](O)c1ccccc1 Amb24475112 [0,0,0,0,0,0|1,0,0]=1 283 B12R1.34 C[C@H](OC)C(O)c1cccc[n]1 Amb25306303 [0,0,0,0,0,0|2,0,0]=2 284 B12R1.34 C[C@H](OC)[C@@H](Cl)c1ccccc1 Amb25274934 [0,0,0,0,0,0|2,0,0]=2 285 B12R1.34 C[C@H](OC)[C@H](O)c1cccc[n]1 Amb25832718 [0,0,0,0,0,0|2,0,0]=2 286 B12R1.34 C[C@H](OC)[C@H](O)c1ccccc1 Amb25106038 [0,0,0,0,0,0|1,0,0]=1 287 B12R1.34 C[C@H]([C@@H](O)NC)c1ccccc1 Amb25803440 [0,0,0,0,0,0|2,0,0]=2 288 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [0,0,0,0,0,0|3,0,0]=3 289 B12R1.34 C[C@H]([C@H](N)CO)c1ccccc1 Amb24427355 [0,0,0,0,0,0|4,0,0]=4 290 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [0,0,0,0,0,0|3,0,1]=4 291 B12R1.34 C[C@H]([C@H](O)CO)c1ccccc1 Amb24735213 [0,0,0,0,0,0|4,0,0]=4 292 B12R1.34 C\C(=C\C)\C(=O)c1ccccc1 Amb25730208 [0,0,0,0,0,0|1,0,3]=4 293 B12R1.34 C\C(=C\C)\C(O)c1c[n]ccc1 Amb25157689 [0,0,0,0,0,0|2,0,1]=3 294 B12R1.34 C\C(=C\C)\C(O)c1cc[n]cc1 Amb25792477 [0,0,0,0,0,0|2,0,1]=3 295 B12R1.34 C\C(=N/C)\C(N)c1ccccc1 Amb24100399 [0,0,0,0,0,0|1,0,2]=3 296 B12R1.34 C\C(=N/N)\C(C)c1ccccc1 Amb25271286 [0,0,0,0,0,0|2,0,2]=4 297 B12R1.34 C\C(=N/O)\C(C)c1ccccc1 Amb24518613 [0,0,0,0,0,0|2,0,2]=4 298 B12R1.34 C\C(=N\C)\C(N)c1ccccc1 Amb24493500 [0,0,0,0,0,0|1,0,2]=3 299 B12R1.34 C\C(=N\O)\C(O)c1ccc[n]c1 Amb24387728 [0,0,0,0,0,0|2,0,2]=4 300 B12R1.34 C\C(\CO)=C(\O)/c1ccccc1 Amb24520521 [0,0,0,0,0,0|2,0,2]=4 301 B12R1.34 C\C=C(/Cl)\C(Cl)c1ccccc1 Amb24728456 [0,0,0,0,0,0|3,0,1]=4 302 B12R1.34 C\C=C(\Cl)/C(Cl)c1ccccc1 Amb24593524 [0,0,0,0,0,0|3,0,1]=4 303 B12R1.34 C\C=C(\Cl)/C(O)c1ccccc1 Amb25092807 [0,0,0,0,0,0|2,0,1]=3 304 B12R1.34 N#CC(Cl)C(Cl)c1ccccc1 Amb18130480 [0,0,0,0,0,0|4,0,0]=4 305 B12R1.34 N#CC(O)C(F)c1ccccc1 Amb25320704 [0,0,0,0,0,0|4,0,0]=4 306 B12R1.34 N#CC(O)[C@@H](O)c1ccccc1 Amb24353058 [0,0,0,0,0,0|3,0,0]=3 307 B12R1.34 N#C[C@@H](F)[C@@H](O)c1ccccc1 Amb24386850 [0,0,0,0,0,0|3,0,0]=3 308 B12R1.34 N#C[C@@H](O)[C@H](O)c1ccccc1 Amb25157844 [0,0,0,0,0,0|3,0,0]=3 309 B12R1.34 N#C[C@H](O)[C@@H](F)c1ccccc1 Amb25157415 [0,0,0,0,0,0|4,0,0]=4 310 B12R1.34 N#C[C@H](O)[C@@H](O)c1ccccc1 Amb24705594 [0,0,0,0,0,0|3,0,0]=3 311 B12R1.34 N#C[C@H](O)[C@H](O)c1ccccc1 Amb25285601 [0,0,0,0,0,0|3,0,0]=3 312 B12R1.34 NC(C#N)C(F)c1ccccc1 Amb25335487 [0,0,0,0,0,0|4,0,0]=4 313 B12R1.34 NC(C(N)C#N)c1ccccc1 Amb25121131 [0,0,0,0,0,0|4,0,0]=4 314 B12R1.34 NC(C(O)C#N)c1ccccc1 Amb24713669 [0,0,0,0,0,0|4,0,0]=4 315 B12R1.34 NC(C(O)CO)c1ccccc1 Amb18646773 [0,0,0,0,0,0|4,0,0]=4 316 B12R1.34 NC(CF)C(O)c1ccccc1 Amb25101573 [0,0,0,0,0,0|3,0,0]=3 317 B12R1.34 NC(CN)C(O)c1ccccc1 Amb25150994 [0,0,0,0,0,0|3,0,0]=3 318 B12R1.34 NC(CO)C(Cl)c1ccccc1 Amb25159303 [0,0,0,0,0,0|4,0,0]=4 319 B12R1.34 NC(CO)C(F)c1ccccc1 Amb25299166 [0,0,0,0,0,0|4,0,0]=4 320 B12R1.34 NC(CO)C(O)c1c[n]ccc1 Amb18826621 [0,0,0,0,0,0|4,0,0]=4 321 B12R1.34 NC(CO)C(O)c1cccc[n]1 Amb25736521 [0,0,0,0,0,0|4,0,0]=4 322 B12R1.34 NC(CO)[C@H](O)c1ccccc1 Amb25247266 [0,0,0,0,0,0|3,0,0]=3 323 B12R1.34 NCC(C(c1ccccc1)C)O Amb17232553 [0,0,0,0,0,0|4,0,0]=4 324 B12R1.34 NCC(F)C(F)c1ccccc1 Amb25851560 [0,0,0,0,0,0|4,0,0]=4 325 B12R1.34 NCC(N(c1ccccc1)C)C Amb1128364 [0,0,0,0,0,0|4,0,0]=4 326 B12R1.34 NCC(N(c1ccccc1)C)C Amb13949221 [0,0,0,0,0,0|4,0,0]=4 327 B12R1.34 NCC(O)C(O)c1ccccc1 Amb19148004 [0,0,0,0,0,0|3,0,0]=3 328 B12R1.34 NC[C@@H](O)[C@H](O)c1ccccc1 Amb24401596 [0,0,0,0,0,0|3,0,0]=3 329 B12R1.34 NC[C@H](O)[C@@H](F)c1ccccc1 Amb24678302 [0,0,0,0,0,0|4,0,0]=4 330 B12R1.34 NC[C@H](O)[C@@H](O)c1ccccc1 Amb24461599 [0,0,0,0,0,0|3,0,0]=3 331 B12R1.34 NC[C@H](O)[C@H](O)c1ccccc1 Amb24695219 [0,0,0,0,0,0|3,0,0]=3 332 B12R1.34 NNC(=O)C(F)c1ccccc1 Amb25799083 [0,0,0,0,0,0|3,0,1]=4 333 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [0,0,0,0,0,0|3,0,1]=4 334 B12R1.34 NNC(=O)C(S)c1ccccc1 Amb24716717 [0,0,0,0,0,0|2,1,1]=4 335 B12R1.34 NNC(=O)C(c1ccccc1)O Amb1786264 [0,0,0,0,0,0|2,0,1]=3 336 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [0,0,0,0,0,0|2,0,1]=3 337 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [0,0,0,0,0,0|2,0,1]=3 338 B12R1.34 NNC(=S)N(O)c1ccccc1 Amb24401970 [0,0,0,0,0,0|3,0,1]=4 339 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [0,0,0,0,0,0|3,0,1]=4 340 B12R1.34 N[C@@H](CO)C(O)c1ccccc1 Amb24739572 [0,0,0,0,0,0|3,0,0]=3 341 B12R1.34 N[C@@H](CO)[C@H](O)c1ccccc1 Amb24487235 [0,0,0,0,0,0|3,0,0]=3 342 B12R1.34 N[C@H](CO)[C@@H](O)c1ccccc1 Amb25789451 [0,0,0,0,0,0|3,0,0]=3 343 B12R1.34 N[C@H]([C@@H](N)C#N)c1ccccc1 Amb25084618 [0,0,0,0,0,0|4,0,0]=4 344 B12R1.34 N[C@H]([C@H](N)CO)c1ccccc1 Amb24558772 [0,0,0,0,0,0|4,0,0]=4 345 B12R1.34 N\C(=N\O)\C(O)c1ccccc1 Amb22052910 [0,0,0,0,0,0|2,0,2]=4 346 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [0,0,0,0,0,0|4,0,0]=4 347 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [0,0,0,0,0,0|4,0,0]=4 348 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [0,0,0,0,0,0|4,0,0]=4 349 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [0,0,0,0,0,0|3,0,0]=3 350 B12R1.34 OC(CCl)C(Cl)c1ccccc1 Amb25803612 [0,0,0,0,0,0|4,0,0]=4 351 B12R1.34 OC(CO)C(F)c1ccccc1 Amb25792385 [0,0,0,0,0,0|4,0,0]=4 352 B12R1.34 OC(c1ccccc1)\C(\F)=C\F Amb25317636 [0,0,0,0,0,0|3,0,1]=4 353 B12R1.34 OCC(=O)C(O)c1ccccc1 Amb24364158 [0,0,0,0,0,0|3,0,1]=4 354 B12R1.34 OCC(=O)[C@@H](O)c1ccccc1 Amb24357245 [0,0,0,0,0,0|3,0,1]=4 355 B12R1.34 OCC(C(c1ccccc1)O)Br Amb17596330 [0,0,0,0,0,0|3,0,0]=3 356 B12R1.34 OCC(C(c1ccccc1)O)Cl Amb17594842 [0,0,0,0,0,0|3,0,0]=3 357 B12R1.34 OCC(Cl)C(Cl)c1ccccc1 Amb25759065 [0,0,0,0,0,0|4,0,0]=4 358 B12R1.34 OCC(O)C(O)c1cccc[n]1 Amb24550636 [0,0,0,0,0,0|4,0,0]=4 359 B12R1.34 OC[C@@H](O)C(O)c1ccccc1 Amb25332503 [0,0,0,0,0,0|3,0,0]=3 360 B12R1.34 OC[C@@H](O)[C@@H](O)c1cccc[n]1 Amb25200149 [0,0,0,0,0,0|4,0,0]=4 361 B12R1.34 OC[C@@H](O)[C@H](O)c1cccc[n]1 Amb24641998 [0,0,0,0,0,0|4,0,0]=4 362 B12R1.34 OC[C@@H](O)[C@H](O)c1ccccc1 Amb24496901 [0,0,0,0,0,0|3,0,0]=3 363 B12R1.34 OC[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25678650 [0,0,0,0,0,0|4,0,0]=4 364 B12R1.34 OC[C@H](O)[C@@H](O)c1ccccc1 Amb25816355 [0,0,0,0,0,0|3,0,0]=3 365 B12R1.34 OC[C@H](O)[C@H](O)c1ccccc1 Amb24735337 [0,0,0,0,0,0|3,0,0]=3 366 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [0,0,0,0,0,0|3,0,1]=4 367 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [0,0,0,0,0,0|3,0,1]=4 368 B12R1.34 ONC(=O)C(O)c1ccc[n]c1 Amb25279670 [0,0,0,0,0,0|3,0,1]=4 369 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [0,0,0,0,0,0|3,0,1]=4 370 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [0,0,0,0,0,0|2,0,1]=3 371 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [0,0,0,0,0,0|2,0,1]=3 372 B12R1.34 O[C@@H](CO)[C@@H](F)c1ccccc1 Amb25206688 [0,0,0,0,0,0|4,0,0]=4 373 B12R1.34 O[C@@H](CO)[C@H](F)c1ccccc1 Amb25157359 [0,0,0,0,0,0|4,0,0]=4 374 B12R1.34 O[C@@H]([C@@H](Cl)CO)c1ccccc1 Amb25321935 [0,0,0,0,0,0|3,0,0]=3 375 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [0,0,0,0,0,0|3,0,0]=3 376 B12R1.34 O[C@H](c1ccccc1)C(=O)N=O Amb25157813 [0,0,0,0,0,0|2,0,2]=4 377 B12R1.34 O[C@H](c1ccccc1)\C(\F)=C\F Amb25157818 [0,0,0,0,0,0|3,0,1]=4 378 B11R1.16 BrCCC(Br)c1ccccc1 Amb23456167 [1,0,0,0,0,0|3,0,0]=4 379 B11R1.16 C#CCC(Cl)c1ccccc1 Amb25264417 [1,0,0,0,0,0|2,0,1]=4 380 B11R1.16 C#CCC(N)c1ccccc1 Amb18959773 [1,0,0,0,0,0|2,0,1]=4 381 B11R1.16 C#CCC(O)c1c[n]ccc1 Amb22756005 [1,0,0,0,0,0|2,0,1]=4 382 B11R1.16 C#CCC(O)c1cccc[n]1 Amb19373060 [1,0,0,0,0,0|2,0,1]=4 383 B11R1.16 C#CC[C@@H](N)c1ccccc1 Amb24181858 [1,0,0,0,0,0|2,0,1]=4 384 B11R1.16 C#CC[C@H](N)c1ccccc1 Amb25169470 [1,0,0,0,0,0|2,0,1]=4 385 B11R1.16 C#CC[C@H](O)c1c[n]ccc1 Amb25373838 [1,0,0,0,0,0|2,0,1]=4 386 B11R1.16 C=C=CC(O)c1ccccc1 Amb25198813 [1,0,0,0,0,0|1,0,2]=4 387 B11R1.16 C=C=C[C@@H](O)c1ccccc1 Amb25045780 [1,0,0,0,0,0|1,0,2]=4 388 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.16 C=CCC(O)c1cccc[n]1 Amb25735233 [1,0,0,0,0,0|2,0,1]=4 391 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [1,0,0,0,0,0|1,0,1]=3 392 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [1,0,0,0,0,0|2,0,1]=4 393 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [1,0,0,0,0,0|1,0,1]=3 394 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [1,0,0,0,0,0|2,0,1]=4 395 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [1,0,0,0,0,0|2,0,1]=4 396 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [1,0,0,0,0,0|1,0,1]=3 397 B11R1.16 C=CC[C@H](O)c1c[n]ccc1 Amb25724316 [1,0,0,0,0,0|2,0,1]=4 398 B11R1.16 C=CC[C@H](O)c1cc[n]cc1 Amb25854958 [1,0,0,0,0,0|2,0,1]=4 399 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [1,0,0,0,0,0|2,0,1]=4 400 B11R1.16 CC#CC(O)c1cc[n]cc1 Amb24379335 [1,0,0,0,0,0|2,0,1]=4 401 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [1,0,0,0,0,0|1,0,1]=3 402 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [1,0,0,0,0,0|1,0,1]=3 403 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [1,0,0,0,0,0|2,0,1]=4 404 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [1,0,0,0,0,0|2,0,1]=4 405 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [1,0,0,0,0,0|3,0,0]=4 406 B11R1.16 CC(CNN)c1c[n]ccc1 Amb25734660 [1,0,0,0,0,0|3,0,0]=4 407 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [1,0,0,0,0,0|2,0,0]=3 408 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [1,0,0,0,0,0|3,0,0]=4 409 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [1,0,0,0,0,0|3,0,0]=4 410 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [1,0,0,0,0,0|1,0,1]=3 411 B11R1.16 CCCC(=C)c1ccccc1 Amb24669524 [1,0,0,0,0,0|2,0,1]=4 412 B11R1.16 CCCC(Br)c1cccc[n]1 Amb25675709 [1,0,0,0,0,0|3,0,0]=4 413 B11R1.16 CCCC(Cl)c1cc[n]cc1 Amb24102654 [1,0,0,0,0,0|3,0,0]=4 414 B11R1.16 CCCC(N)c1c[n]ccc1 Amb18984960 [1,0,0,0,0,0|3,0,0]=4 415 B11R1.16 CCCC(N)c1cc[n]cc1 Amb18984961 [1,0,0,0,0,0|3,0,0]=4 416 B11R1.16 CCCC(N)c1cccc[n]1 Amb18984959 [1,0,0,0,0,0|3,0,0]=4 417 B11R1.16 CCCC(O)c1[n]ccc[n]1 Amb18179424 [1,0,0,0,0,0|3,0,0]=4 418 B11R1.16 CCCC(O)c1c[n]c[n]c1 Amb18799414 [1,0,0,0,0,0|3,0,0]=4 419 B11R1.16 CCCC(O)c1c[n]cc[n]1 Amb18179423 [1,0,0,0,0,0|3,0,0]=4 420 B11R1.16 CCCC(O)c1cc[n]c[n]1 Amb25145824 [1,0,0,0,0,0|3,0,0]=4 421 B11R1.16 CCCC(O)c1cc[n]cc1 Amb18179398 [1,0,0,0,0,0|2,0,0]=3 422 B11R1.16 CCCC(O)c1cccc[n]1 Amb18179397 [1,0,0,0,0,0|2,0,0]=3 423 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [1,0,0,0,0,0|2,0,0]=3 424 B11R1.16 CCCC(c1cccnc1)O Amb17232090 [1,0,0,0,0,0|2,0,0]=3 425 B11R1.16 CCCN(O)c1ccccc1 Amb25349642 [1,0,0,0,0,0|2,0,0]=3 426 B11R1.16 CCC[C@@H](N)c1c[n]ccc1 Amb24617547 [1,0,0,0,0,0|3,0,0]=4 427 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [1,0,0,0,0,0|2,0,0]=3 428 B11R1.16 CCC[C@@H](O)c1c[n]c[n]c1 Amb24622286 [1,0,0,0,0,0|3,0,0]=4 429 B11R1.16 CCC[C@@H](O)c1cc[n]cc1 Amb24429371 [1,0,0,0,0,0|2,0,0]=3 430 B11R1.16 CCC[C@@H](O)c1cccc[n]1 Amb25795692 [1,0,0,0,0,0|2,0,0]=3 431 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [1,0,0,0,0,0|1,0,0]=2 432 B11R1.16 CCC[C@H](N)c1cccc[n]1 Amb25836783 [1,0,0,0,0,0|3,0,0]=4 433 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [1,0,0,0,0,0|2,0,0]=3 434 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [1,0,0,0,0,0|2,0,0]=3 435 B11R1.16 CCC[C@H](O)c1c[n]ccc1 Amb25845549 [1,0,0,0,0,0|2,0,0]=3 436 B11R1.16 CCC[C@H](O)c1cc[n]cc1 Amb24414462 [1,0,0,0,0,0|2,0,0]=3 437 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [1,0,0,0,0,0|1,0,0]=2 438 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [1,0,0,0,0,0|2,0,0]=3 439 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [1,0,0,0,0,0|3,0,0]=4 440 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [1,0,0,0,0,0|3,0,0]=4 441 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [1,0,0,0,0,0|3,0,0]=4 442 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [1,0,0,0,0,0|3,0,0]=4 443 B11R1.16 CCOC(O)c1c[n]ccc1 Amb24379956 [1,0,0,0,0,0|3,0,0]=4 444 B11R1.16 CCOC(O)c1cccc[n]1 Amb25057798 [1,0,0,0,0,0|3,0,0]=4 445 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [1,0,0,0,0,0|3,0,0]=4 446 B11R1.16 CNCC(=C)c1ccccc1 Amb18124860 [1,0,0,0,0,0|1,0,1]=3 447 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [1,0,0,0,0,0|1,0,0]=2 448 B11R1.16 CNCC(C)c1cccc[n]1 Amb18644449 [1,0,0,0,0,0|2,0,0]=3 449 B11R1.16 CNCC(F)c1cc[n]cc1 Amb25331906 [1,0,0,0,0,0|2,0,0]=3 450 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [1,0,0,0,0,0|1,0,0]=2 451 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [1,0,0,0,0,0|1,0,0]=2 452 B11R1.16 CNCC(O)c1c[n]c[n]c1 Amb25141262 [1,0,0,0,0,0|2,0,0]=3 453 B11R1.16 CNCC(O)c1c[n]ccc1 Amb19515701 [1,0,0,0,0,0|1,0,0]=2 454 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [1,0,0,0,0,0|0,1,0]=2 455 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [1,0,0,0,0,0|1,0,0]=2 456 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [1,0,0,0,0,0|1,0,0]=2 457 B11R1.16 CNCC(c1ccccn1)O Amb17138440 [1,0,0,0,0,0|1,0,0]=2 458 B11R1.16 CNCC(c1cccnc1)O Amb17138441 [1,0,0,0,0,0|1,0,0]=2 459 B11R1.16 CNCC(c1ccncc1)O Amb17138442 [1,0,0,0,0,0|1,0,0]=2 460 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [1,0,0,0,0,0|1,0,0]=2 461 B11R1.16 CNC[C@@H](O)c1c[n]cc[n]1 Amb25719382 [1,0,0,0,0,0|2,0,0]=3 462 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [1,0,0,0,0,0|1,0,0]=2 463 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [1,0,0,0,0,0|1,0,0]=2 464 B11R1.16 CNC[C@H](O)c1c[n]cc[n]1 Amb24692961 [1,0,0,0,0,0|2,0,0]=3 465 B11R1.16 CNC[C@H](O)c1c[n]ccc1 Amb25172815 [1,0,0,0,0,0|1,0,0]=2 466 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [1,0,0,0,0,0|0,0,0]=1 467 B11R1.16 CNN=C(N)c1ccccc1 Amb20623020 [1,0,0,0,0,0|2,0,1]=4 468 B11R1.16 CNNC(=O)c1ccccc1 Amb24096729 [1,0,0,0,0,0|1,0,2]=4 469 B11R1.16 CNNC(=S)c1ccccc1 Amb25084578 [1,0,0,0,0,0|1,1,1]=4 470 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [1,0,0,0,0,0|2,0,0]=3 471 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [1,0,0,0,0,0|1,0,2]=4 472 B11R1.16 COCC(Br)c1cccc[n]1 Amb24469291 [1,0,0,0,0,0|3,0,0]=4 473 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [1,0,0,0,0,0|2,0,0]=3 474 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [1,0,0,0,0,0|2,0,0]=3 475 B11R1.16 COCC(N)c1c[n]ccc1 Amb18292631 [1,0,0,0,0,0|3,0,0]=4 476 B11R1.16 COCC(O)c1[n]ccc[n]1 Amb25070058 [1,0,0,0,0,0|3,0,0]=4 477 B11R1.16 COCC(O)c1c[n]c[n]c1 Amb18182901 [1,0,0,0,0,0|3,0,0]=4 478 B11R1.16 COCC(O)c1c[n]ccc1 Amb18179473 [1,0,0,0,0,0|2,0,0]=3 479 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [1,0,0,0,0,0|1,0,0]=2 480 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [1,0,0,0,0,0|1,1,0]=3 481 B11R1.16 COCC(c1ccccc1)N Amb1134749 [1,0,0,0,0,0|2,0,0]=3 482 B11R1.16 COCC(c1ccccc1)N Amb13952604 [1,0,0,0,0,0|2,0,0]=3 483 B11R1.16 COCC(c1ccccn1)N Amb10607922 [1,0,0,0,0,0|3,0,0]=4 484 B11R1.16 COCC(c1ccccn1)N Amb13949181 [1,0,0,0,0,0|3,0,0]=4 485 B11R1.16 COC[C@@H](N)c1c[n]ccc1 Amb24351094 [1,0,0,0,0,0|3,0,0]=4 486 B11R1.16 COC[C@@H](N)c1cc[n]cc1 Amb24428710 [1,0,0,0,0,0|3,0,0]=4 487 B11R1.16 COC[C@@H](N)c1cccc[n]1 Amb25104762 [1,0,0,0,0,0|3,0,0]=4 488 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [1,0,0,0,0,0|1,0,0]=2 489 B11R1.16 COC[C@H](N)c1c[n]ccc1 Amb24533043 [1,0,0,0,0,0|3,0,0]=4 490 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [1,0,0,0,0,0|2,0,0]=3 491 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [1,0,0,0,0,0|2,0,0]=3 492 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [1,0,0,0,0,0|3,0,0]=4 493 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [1,0,0,0,0,0|2,0,0]=3 494 B11R1.16 CSCC(N)c1c[n]ccc1 Amb18300195 [1,0,0,0,0,0|3,0,0]=4 495 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [1,0,0,0,0,0|2,0,0]=3 496 B11R1.16 CSCC(O)c1c[n]c[n]c1 Amb18183596 [1,0,0,0,0,0|3,0,0]=4 497 B11R1.16 CSCC(O)c1c[n]ccc1 Amb18801395 [1,0,0,0,0,0|2,0,0]=3 498 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [1,0,0,0,0,0|1,0,0]=2 499 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [1,0,0,0,0,0|2,0,0]=3 500 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [1,0,0,0,0,0|3,0,0]=4 501 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [1,0,0,0,0,0|3,0,0]=4 502 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [1,0,0,0,0,0|3,0,0]=4 503 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [1,0,0,0,0,0|3,0,0]=4 504 B11R1.16 C\C(=N\NC)\c1ccccc1 Amb25099332 [1,0,0,0,0,0|2,0,1]=4 505 B11R1.16 C\C=C/C(O)c1c[n]ccc1 Amb25241944 [1,0,0,0,0,0|2,0,1]=4 506 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [1,0,0,0,0,0|2,0,1]=4 507 B11R1.16 C\C=C\C(O)c1cccc[n]1 Amb24431006 [1,0,0,0,0,0|2,0,1]=4 508 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [1,0,0,0,0,0|1,0,1]=3 509 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [1,0,0,0,0,0|1,0,1]=3 510 B11R1.16 ClCCC(Br)c1ccccc1 Amb21856734 [1,0,0,0,0,0|3,0,0]=4 511 B11R1.16 ClCCC(Cl)c1ccccc1 Amb17872667 [1,0,0,0,0,0|3,0,0]=4 512 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [1,0,0,0,0,0|3,0,0]=4 513 B11R1.16 ClCCC(c1ccccc1)O Amb17611064 [1,0,0,0,0,0|2,0,0]=3 514 B11R1.16 ClCC[C@@H](c1ccccc1)O Amb17611058 [1,0,0,0,0,0|2,0,0]=3 515 B11R1.16 N#CCC(Cl)c1ccccc1 Amb25238256 [1,0,0,0,0,0|3,0,0]=4 516 B11R1.16 N#CCC(F)c1ccccc1 Amb25127669 [1,0,0,0,0,0|3,0,0]=4 517 B11R1.16 N#CCC(O)c1c[n]ccc1 Amb24062545 [1,0,0,0,0,0|3,0,0]=4 518 B11R1.16 N#CCC(O)c1cccc[n]1 Amb25149159 [1,0,0,0,0,0|3,0,0]=4 519 B11R1.16 N#CC[C@@H](O)c1c[n]ccc1 Amb24675507 [1,0,0,0,0,0|3,0,0]=4 520 B11R1.16 N#CC[C@@H](O)c1ccccc1 Amb25680039 [1,0,0,0,0,0|2,0,0]=3 521 B11R1.16 N#CC[C@H](O)c1cc[n]cc1 Amb24398008 [1,0,0,0,0,0|3,0,0]=4 522 B11R1.16 N#CC[C@H](O)c1ccccc1 Amb24617537 [1,0,0,0,0,0|2,0,0]=3 523 B11R1.16 NC(CC#N)c1ccccc1 Amb18964887 [1,0,0,0,0,0|3,0,0]=4 524 B11R1.16 NC(CC#N)c1ccccc1 Amb20632783 [1,0,0,0,0,0|3,0,0]=4 525 B11R1.16 NC(CCO)c1ccccc1 Amb22730035 [1,0,0,0,0,0|3,0,0]=4 526 B11R1.16 NCCC(Cl)c1ccccc1 Amb24487859 [1,0,0,0,0,0|3,0,0]=4 527 B11R1.16 NCCC(N)c1ccccc1 Amb18972395 [1,0,0,0,0,0|3,0,0]=4 528 B11R1.16 NCCC(O)c1c[n]ccc1 Amb18639338 [1,0,0,0,0,0|3,0,0]=4 529 B11R1.16 NCCC(O)c1cc[n]cc1 Amb18121042 [1,0,0,0,0,0|3,0,0]=4 530 B11R1.16 NCCC(O)c1cccc[n]1 Amb18121017 [1,0,0,0,0,0|3,0,0]=4 531 B11R1.16 NCCC(O)c1ccccc1 Amb21984527 [1,0,0,0,0,0|2,0,0]=3 532 B11R1.16 NCCC(S)c1ccccc1 Amb18251942 [1,0,0,0,0,0|2,1,0]=4 533 B11R1.16 NCCC(c1ccccc1)O Amb2383139 [1,0,0,0,0,0|2,0,0]=3 534 B11R1.16 NCC[C@@H](N)c1ccccc1 Amb25210474 [1,0,0,0,0,0|3,0,0]=4 535 B11R1.16 NCC[C@@H](O)c1ccccc1 Amb22225304 [1,0,0,0,0,0|2,0,0]=3 536 B11R1.16 NCC[C@H](O)c1ccccc1 Amb22226644 [1,0,0,0,0,0|2,0,0]=3 537 B11R1.16 NNCC(=O)c1ccccc1 Amb18125154 [1,0,0,0,0,0|1,0,2]=4 538 B11R1.16 NNCC(F)c1ccccc1 Amb25061630 [1,0,0,0,0,0|2,0,0]=3 539 B11R1.16 NNCC(O)c1cc[n]cc1 Amb18065401 [1,0,0,0,0,0|2,0,0]=3 540 B11R1.16 NNCC(O)c1cccc[n]1 Amb18065400 [1,0,0,0,0,0|2,0,0]=3 541 B11R1.16 NNCC(c1ccccc1)O Amb17232104 [1,0,0,0,0,0|1,0,0]=2 542 B11R1.16 NNCC(c1cccnc1)O Amb17232118 [1,0,0,0,0,0|2,0,0]=3 543 B11R1.16 NNC[C@@H](O)c1ccccc1 Amb24466315 [1,0,0,0,0,0|1,0,0]=2 544 B11R1.16 NNC[C@H](O)c1ccccc1 Amb25236157 [1,0,0,0,0,0|1,0,0]=2 545 B11R1.16 NOCC(c1ccccc1)O Amb17334342 [1,0,0,0,0,0|2,0,0]=3 546 B11R1.16 NOC[C@@H](O)c1ccccc1 Amb25152160 [1,0,0,0,0,0|2,0,0]=3 547 B11R1.16 N[C@H](CCO)c1ccccc1 Amb22265524 [1,0,0,0,0,0|3,0,0]=4 548 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [1,0,0,0,0,0|3,0,0]=4 549 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [1,0,0,0,0,0|2,1,0]=4 550 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [1,0,0,0,0,0|2,0,1]=4 551 B11R1.16 OC(CC=O)c1cc[n]cc1 Amb24434533 [1,0,0,0,0,0|3,0,0]=4 552 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [1,0,0,0,0,0|2,0,0]=3 553 B11R1.16 OC(CCF)c1ccccc1 Amb24412986 [1,0,0,0,0,0|2,0,0]=3 554 B11R1.16 OC(CCS)c1ccccc1 Amb25837914 [1,0,0,0,0,0|2,0,0]=3 555 B11R1.16 OC(CNO)c1ccccc1 Amb22366087 [1,0,0,0,0,0|1,0,0]=2 556 B11R1.16 OC(c1ccccc1)C#CBr Amb1083115 [1,0,0,0,0,0|2,0,1]=4 557 B11R1.16 OCCC(O)c1cc[n]cc1 Amb25760239 [1,0,0,0,0,0|3,0,0]=4 558 B11R1.16 OCCC(O)c1cccc[n]1 Amb22756156 [1,0,0,0,0,0|3,0,0]=4 559 B11R1.16 OCCC(O)c1ccccc1 Amb17777842 [1,0,0,0,0,0|2,0,0]=3 560 B11R1.16 OCCC(c1ccccc1)N Amb1993953 [1,0,0,0,0,0|3,0,0]=4 561 B11R1.16 OCC[C@H](O)c1cc[n]cc1 Amb24715913 [1,0,0,0,0,0|3,0,0]=4 562 B11R1.16 ONCC(c1ccccn1)O Amb17334345 [1,0,0,0,0,0|2,0,0]=3 563 B11R1.16 ONCC(c1cccnc1)O Amb17334346 [1,0,0,0,0,0|2,0,0]=3 564 B11R1.16 ONCC(c1ccncc1)O Amb17334347 [1,0,0,0,0,0|2,0,0]=3 565 B11R1.16 OSCC(O)c1ccccc1 Amb25686224 [1,0,0,0,0,0|2,0,0]=3 566 B11R1.16 OSC[C@@H](O)c1ccccc1 Amb25787381 [1,0,0,0,0,0|2,0,0]=3 567 B11R1.16 O[C@H](CC=O)c1cc[n]cc1 Amb25142585 [1,0,0,0,0,0|3,0,0]=4 568 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [1,0,0,0,0,0|2,0,0]=3 569 B11R1.16 O\N=C\C(O)c1ccccc1 Amb25149681 [1,0,0,0,0,0|1,0,2]=4 570 B11R1.16 [N-]=[N+]=NC(O)c1ccccc1 Amb24724629 [1,0,0,0,0,0|2,0,1]=4 571 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [1,0,0,0,0,0|3,0,0]=4 572 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [1,0,0,0,0,0|2,0,1]=4 573 B11R1.36 CC(=C)C(Cl)c1ccccc1 Amb25320926 [1,0,0,0,0,0|1,0,2]=4 574 B11R1.36 CC(=C)C(N)c1ccccc1 Amb18124853 [1,0,0,0,0,0|1,0,2]=4 575 B11R1.36 CC(=C)C(O)c1cc[n]cc1 Amb24447288 [1,0,0,0,0,0|1,0,2]=4 576 B11R1.36 CC(=C)C(O)c1ccc[n]c1 Amb25687146 [1,0,0,0,0,0|1,0,2]=4 577 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [1,0,0,0,0,0|2,0,1]=4 578 B11R1.36 CC(=O)C(O)c1ccc[n]c1 Amb24486339 [1,0,0,0,0,0|2,0,1]=4 579 B11R1.36 CC(=O)C(O)c1cccc[n]1 Amb24392468 [1,0,0,0,0,0|2,0,1]=4 580 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [1,0,0,0,0,0|2,0,1]=4 581 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [1,0,0,0,0,0|1,0,1]=3 582 B11R1.36 CC(Br)C(=N)c1ccccc1 Amb25770551 [1,0,0,0,0,0|2,0,1]=4 583 B11R1.36 CC(Br)C(Br)c1ccccc1 Amb25067299 [1,0,0,0,0,0|2,0,0]=3 584 B11R1.36 CC(Br)C(F)c1ccccc1 Amb24375780 [1,0,0,0,0,0|2,0,0]=3 585 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [1,0,0,0,0,0|2,0,0]=3 586 B11R1.36 CC(Br)C(O)c1cc[n]cc1 Amb25325014 [1,0,0,0,0,0|2,0,0]=3 587 B11R1.36 CC(Br)[C@@H](O)c1ccccc1 Amb25218214 [1,0,0,0,0,0|1,0,0]=2 588 B11R1.36 CC(Br)[C@H](O)c1ccccc1 Amb25835623 [1,0,0,0,0,0|1,0,0]=2 589 B11R1.36 CC(C(=O)c1ccccc1)F Amb10603603 [1,0,0,0,0,0|1,0,2]=4 590 B11R1.36 CC(C(=O)c1cccnc1)C Amb10607959 [1,0,0,0,0,0|1,0,2]=4 591 B11R1.36 CC(C(C)Br)c1c[n]ccc1 Amb24594038 [1,0,0,0,0,0|3,0,0]=4 592 B11R1.36 CC(C(C)Br)c1cccc[n]1 Amb24585036 [1,0,0,0,0,0|3,0,0]=4 593 B11R1.36 CC(C(C)Br)c1ccccc1 Amb25191202 [1,0,0,0,0,0|2,0,0]=3 594 B11R1.36 CC(C(C)Cl)c1c[n]ccc1 Amb24660277 [1,0,0,0,0,0|3,0,0]=4 595 B11R1.36 CC(C(C)Cl)c1ccccc1 Amb25832184 [1,0,0,0,0,0|2,0,0]=3 596 B11R1.36 CC(C(C)N)c1c[n]c[n]c1 Amb25303807 [1,0,0,0,0,0|3,0,0]=4 597 B11R1.36 CC(C(C)N)c1c[n]cc[n]1 Amb25314844 [1,0,0,0,0,0|3,0,0]=4 598 B11R1.36 CC(C(C)N)c1c[n]ccc1 Amb18201853 [1,0,0,0,0,0|2,0,0]=3 599 B11R1.36 CC(C(C)N)c1cc[n]cc1 Amb18201858 [1,0,0,0,0,0|2,0,0]=3 600 B11R1.36 CC(C(C)N)c1ccccc1 Amb18125050 [1,0,0,0,0,0|1,0,0]=2 601 B11R1.36 CC(C(C)N)c1ccccc1 Amb22477704 [1,0,0,0,0,0|1,0,0]=2 602 B11R1.36 CC(C(Cl)Cl)c1ccccc1 Amb24390914 [1,0,0,0,0,0|3,0,0]=4 603 B11R1.36 CC(C(F)F)c1ccccc1 Amb20669786 [1,0,0,0,0,0|3,0,0]=4 604 B11R1.36 CC(C(N)=N)c1ccccc1 Amb22886648 [1,0,0,0,0,0|2,0,1]=4 605 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [1,0,0,0,0,0|2,0,1]=4 606 B11R1.36 CC(C(c1ccccn1)C)C Amb10573727 [1,0,0,0,0,0|2,0,0]=3 607 B11R1.36 CC(C(c1ccccn1)N)C Amb10607919 [1,0,0,0,0,0|2,0,0]=3 608 B11R1.36 CC(C(c1ccccn1)N)C Amb13949179 [1,0,0,0,0,0|2,0,0]=3 609 B11R1.36 CC(C(c1ccccn1)O)C Amb13952167 [1,0,0,0,0,0|1,0,0]=2 610 B11R1.36 CC(C(c1cccnc1)N)C Amb10607960 [1,0,0,0,0,0|2,0,0]=3 611 B11R1.36 CC(C(c1cccnc1)N)C Amb13949194 [1,0,0,0,0,0|2,0,0]=3 612 B11R1.36 CC(C(c1cccnc1)N)O Amb17232102 [1,0,0,0,0,0|3,0,0]=4 613 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [1,0,0,0,0,0|1,0,2]=4 614 B11R1.36 CC(C)C(=O)c1cc[n]cc1 Amb19374024 [1,0,0,0,0,0|1,0,2]=4 615 B11R1.36 CC(C)C(Br)c1cccc[n]1 Amb24359282 [1,0,0,0,0,0|2,0,0]=3 616 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [1,0,0,0,0,0|1,0,0]=2 617 B11R1.36 CC(C)C(Cl)c1cccc[n]1 Amb25028120 [1,0,0,0,0,0|2,0,0]=3 618 B11R1.36 CC(C)C(F)c1cc[n]cc1 Amb24102662 [1,0,0,0,0,0|2,0,0]=3 619 B11R1.36 CC(C)C(N)c1[n]ccc[n]1 Amb18281189 [1,0,0,0,0,0|3,0,0]=4 620 B11R1.36 CC(C)C(N)c1c[n]c[n]c1 Amb18286383 [1,0,0,0,0,0|3,0,0]=4 621 B11R1.36 CC(C)C(N)c1c[n]cc[n]1 Amb18281120 [1,0,0,0,0,0|3,0,0]=4 622 B11R1.36 CC(C)C(N)c1cc[n][n]c1 Amb24394069 [1,0,0,0,0,0|3,0,0]=4 623 B11R1.36 CC(C)C(N)c1cc[n]c[n]1 Amb24410788 [1,0,0,0,0,0|3,0,0]=4 624 B11R1.36 CC(C)C(N)c1cc[n]cc1 Amb18949710 [1,0,0,0,0,0|2,0,0]=3 625 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [1,0,0,0,0,0|1,0,0]=2 626 B11R1.36 CC(C)C(O)c1[n]ccc[n]1 Amb18179422 [1,0,0,0,0,0|2,0,0]=3 627 B11R1.36 CC(C)C(O)c1c[n]c[n]c1 Amb18799413 [1,0,0,0,0,0|2,0,0]=3 628 B11R1.36 CC(C)C(O)c1c[n]cc[n]1 Amb18179421 [1,0,0,0,0,0|2,0,0]=3 629 B11R1.36 CC(C)C(O)c1cc[n][n]c1 Amb25061731 [1,0,0,0,0,0|2,0,0]=3 630 B11R1.36 CC(C)C(O)c1cc[n]c[n]1 Amb25145823 [1,0,0,0,0,0|2,0,0]=3 631 B11R1.36 CC(C)C(O)c1cc[n]cc1 Amb18179396 [1,0,0,0,0,0|1,0,0]=2 632 B11R1.36 CC(C)C(O)c1ccc[n]c1 Amb18179395 [1,0,0,0,0,0|1,0,0]=2 633 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [1,0,0,0,0,0|0,1,0]=2 634 B11R1.36 CC(C)N(C)c1ccccc1 Amb24096678 [1,0,0,0,0,0|2,0,0]=3 635 B11R1.36 CC(C)N(N)c1ccccc1 Amb18125185 [1,0,0,0,0,0|2,0,0]=3 636 B11R1.36 CC(C)S(=O)c1ccccc1 Amb24484364 [1,0,0,0,0,0|1,0,1]=3 637 B11R1.36 CC(C)[C@@H](N)c1ccc[n]c1 Amb24538246 [1,0,0,0,0,0|2,0,0]=3 638 B11R1.36 CC(C)[C@@H](N)c1cccc[n]1 Amb24725608 [1,0,0,0,0,0|2,0,0]=3 639 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [1,0,0,0,0,0|1,0,0]=2 640 B11R1.36 CC(C)[C@@H](O)c1ccc[n]c1 Amb25149641 [1,0,0,0,0,0|1,0,0]=2 641 B11R1.36 CC(C)[C@@H](O)c1cccc[n]1 Amb24412454 [1,0,0,0,0,0|1,0,0]=2 642 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [1,0,0,0,0,0|0,0,0]=1 643 B11R1.36 CC(C)[C@H](Cl)c1ccccc1 Amb25028094 [1,0,0,0,0,0|1,0,0]=2 644 B11R1.36 CC(C)[C@H](N)c1c[n]cc[n]1 Amb25844921 [1,0,0,0,0,0|3,0,0]=4 645 B11R1.36 CC(C)[C@H](N)c1cc[n]c[n]1 Amb24514573 [1,0,0,0,0,0|3,0,0]=4 646 B11R1.36 CC(C)[C@H](N)c1ccc[n]c1 Amb24432837 [1,0,0,0,0,0|2,0,0]=3 647 B11R1.36 CC(C)[C@H](N)c1cccc[n]1 Amb25719548 [1,0,0,0,0,0|2,0,0]=3 648 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [1,0,0,0,0,0|1,0,0]=2 649 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [1,0,0,0,0,0|1,0,0]=2 650 B11R1.36 CC(C)[C@H](O)c1ccc[n]c1 Amb25698303 [1,0,0,0,0,0|1,0,0]=2 651 B11R1.36 CC(C)[C@H](O)c1ccccc1 Amb22226521 [1,0,0,0,0,0|0,0,0]=1 652 B11R1.36 CC(Cl)C(F)c1ccccc1 Amb25095827 [1,0,0,0,0,0|2,0,0]=3 653 B11R1.36 CC(Cl)S(=O)c1ccccc1 Amb25273905 [1,0,0,0,0,0|2,0,1]=4 654 B11R1.36 CC(N)C(=C)c1ccccc1 Amb23536391 [1,0,0,0,0,0|1,0,1]=3 655 B11R1.36 CC(N)C(=O)c1cc[n]cc1 Amb18201927 [1,0,0,0,0,0|1,0,2]=4 656 B11R1.36 CC(N)C(=O)c1ccc[n]c1 Amb18201928 [1,0,0,0,0,0|1,0,2]=4 657 B11R1.36 CC(N)C(=O)c1cccc[n]1 Amb18201931 [1,0,0,0,0,0|1,0,2]=4 658 B11R1.36 CC(N)C(Br)c1ccccc1 Amb24542874 [1,0,0,0,0,0|1,0,0]=2 659 B11R1.36 CC(N)C(F)c1ccccc1 Amb25189148 [1,0,0,0,0,0|1,0,0]=2 660 B11R1.36 CC(N)C(N)c1cccc[n]1 Amb24670557 [1,0,0,0,0,0|2,0,0]=3 661 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [1,0,0,0,0,0|1,0,0]=2 662 B11R1.36 CC(N)C(O)c1[n]ccc[n]1 Amb24617599 [1,0,0,0,0,0|2,0,0]=3 663 B11R1.36 CC(N)C(O)c1cc[n]c[n]1 Amb25724791 [1,0,0,0,0,0|2,0,0]=3 664 B11R1.36 CC(N)C(O)c1cc[n]cc1 Amb19373096 [1,0,0,0,0,0|1,0,0]=2 665 B11R1.36 CC(O)C(=C)c1ccccc1 Amb25226435 [1,0,0,0,0,0|2,0,1]=4 666 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [1,0,0,0,0,0|1,0,2]=4 667 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [1,0,0,0,0,0|2,0,0]=3 668 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [1,0,0,0,0,0|2,0,0]=3 669 B11R1.36 CC(O)C(O)c1c[n]cc[n]1 Amb25824755 [1,0,0,0,0,0|3,0,0]=4 670 B11R1.36 CC(O)C(O)c1c[n]ccc1 Amb24643547 [1,0,0,0,0,0|2,0,0]=3 671 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [1,0,0,0,0,0|1,1,0]=3 672 B11R1.36 CC(O)[C@@H](N)c1ccc[n]c1 Amb24659692 [1,0,0,0,0,0|3,0,0]=4 673 B11R1.36 CC(O)[C@@H](N)c1cccc[n]1 Amb24470743 [1,0,0,0,0,0|3,0,0]=4 674 B11R1.36 CC(O)[C@H](N)c1cc[n]cc1 Amb25126570 [1,0,0,0,0,0|3,0,0]=4 675 B11R1.36 CC(O)[C@H](N)c1cccc[n]1 Amb24486964 [1,0,0,0,0,0|3,0,0]=4 676 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [1,0,0,0,0,0|2,0,0]=3 677 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [1,0,0,0,0,0|1,0,2]=4 678 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [1,0,0,0,0,0|2,0,1]=4 679 B11R1.36 CC(c1ccccc1)C(=S)N Amb17465747 [1,0,0,0,0,0|2,0,1]=4 680 B11R1.36 CN(C(=N)c1ccccc1)N Amb10870953 [1,0,0,0,0,0|2,0,1]=4 681 B11R1.36 CN(C)C(=N)c1ccccc1 Amb23447126 [1,0,0,0,0,0|2,0,1]=4 682 B11R1.36 CN(C)C(Cl)c1ccccc1 Amb25690215 [1,0,0,0,0,0|2,0,0]=3 683 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [1,0,0,0,0,0|2,0,0]=3 684 B11R1.36 CN(C)C(O)c1ccccc1 Amb24421296 [1,0,0,0,0,0|1,0,0]=2 685 B11R1.36 CN(C)P(Cl)c1ccccc1 Amb25308341 [1,0,0,0,0,0|3,0,0]=4 686 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [1,0,0,0,0,0|1,0,2]=4 687 B11R1.36 CS(=O)C(Cl)c1ccccc1 Amb25778206 [1,0,0,0,0,0|3,0,0]=4 688 B11R1.36 C[C@@H](C(=O)c1ccccc1)N Amb17610655 [1,0,0,0,0,0|0,0,2]=3 689 B11R1.36 C[C@@H](C(C)N)c1ccccc1 Amb25200252 [1,0,0,0,0,0|1,0,0]=2 690 B11R1.36 C[C@@H](C(N)=S)c1ccccc1 Amb25112155 [1,0,0,0,0,0|2,0,1]=4 691 B11R1.36 C[C@@H](Cl)C(=O)c1ccccc1 Amb24068213 [1,0,0,0,0,0|1,0,2]=4 692 B11R1.36 C[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb24635727 [1,0,0,0,0,0|2,0,0]=3 693 B11R1.36 C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb24602441 [1,0,0,0,0,0|1,0,0]=2 694 B11R1.36 C[C@@H](Cl)[C@H](O)c1ccccc1 Amb24433948 [1,0,0,0,0,0|1,0,0]=2 695 B11R1.36 C[C@@H](F)C(=O)c1ccccc1 Amb24068215 [1,0,0,0,0,0|1,0,2]=4 696 B11R1.36 C[C@@H](F)[C@@H](O)c1ccccc1 Amb25346193 [1,0,0,0,0,0|1,0,0]=2 697 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb19131140 [1,0,0,0,0,0|0,0,2]=3 698 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [1,0,0,0,0,0|0,0,2]=3 699 B11R1.36 C[C@@H](N)[C@@H](O)c1c[n]c[n]c1 Amb24542122 [1,0,0,0,0,0|2,0,0]=3 700 B11R1.36 C[C@@H](N)[C@@H](S)c1ccccc1 Amb25129484 [1,0,0,0,0,0|0,1,0]=2 701 B11R1.36 C[C@@H](N)[C@H](O)c1[n]ccc[n]1 Amb24562332 [1,0,0,0,0,0|2,0,0]=3 702 B11R1.36 C[C@@H](N)[C@H](O)c1ccc[n]c1 Amb24542154 [1,0,0,0,0,0|1,0,0]=2 703 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [1,0,0,0,0,0|2,0,0]=3 704 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [1,0,0,0,0,0|2,0,0]=3 705 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [1,0,0,0,0,0|2,0,0]=3 706 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [1,0,0,0,0,0|1,0,0]=2 707 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [1,0,0,0,0,0|2,0,0]=3 708 B11R1.36 C[C@@H](O)[C@H](N)c1cc[n]cc1 Amb24665797 [1,0,0,0,0,0|3,0,0]=4 709 B11R1.36 C[C@@H](O)[C@H](N)c1cccc[n]1 Amb25794058 [1,0,0,0,0,0|3,0,0]=4 710 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [1,0,0,0,0,0|2,0,0]=3 711 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [1,0,0,0,0,0|1,0,0]=2 712 B11R1.36 C[C@@H]([C@@H](C)N)c1ccccc1 Amb25789348 [1,0,0,0,0,0|1,0,0]=2 713 B11R1.36 C[C@@H](c1cccc[n]1)N(C)C Amb25858370 [1,0,0,0,0,0|3,0,0]=4 714 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [1,0,0,0,0,0|2,0,0]=3 715 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [1,0,0,0,0,0|2,0,0]=3 716 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [1,0,0,0,0,0|1,0,2]=4 717 B11R1.36 C[C@H](Br)[C@@H](F)c1ccccc1 Amb25055861 [1,0,0,0,0,0|2,0,0]=3 718 B11R1.36 C[C@H](Br)[C@@H](O)c1ccccc1 Amb25844405 [1,0,0,0,0,0|1,0,0]=2 719 B11R1.36 C[C@H](Br)[C@H](F)c1ccccc1 Amb25313145 [1,0,0,0,0,0|2,0,0]=3 720 B11R1.36 C[C@H](C(C)N)c1ccccc1 Amb25339523 [1,0,0,0,0,0|1,0,0]=2 721 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [1,0,0,0,0,0|2,0,0]=3 722 B11R1.36 C[C@H](Cl)C(=O)c1ccccc1 Amb24068277 [1,0,0,0,0,0|1,0,2]=4 723 B11R1.36 C[C@H](Cl)S(=O)c1ccccc1 Amb25111210 [1,0,0,0,0,0|2,0,1]=4 724 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [1,0,0,0,0,0|2,0,0]=3 725 B11R1.36 C[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25322171 [1,0,0,0,0,0|2,0,0]=3 726 B11R1.36 C[C@H](Cl)[C@H](O)c1ccccc1 Amb24442982 [1,0,0,0,0,0|1,0,0]=2 727 B11R1.36 C[C@H](N)C(=O)c1ccccc1 Amb25853969 [1,0,0,0,0,0|0,0,2]=3 728 B11R1.36 C[C@H](N)[C@@H](Cl)c1ccccc1 Amb24740855 [1,0,0,0,0,0|1,0,0]=2 729 B11R1.36 C[C@H](N)[C@@H](F)c1ccccc1 Amb25251481 [1,0,0,0,0,0|1,0,0]=2 730 B11R1.36 C[C@H](N)[C@@H](N)c1cccc[n]1 Amb24711884 [1,0,0,0,0,0|2,0,0]=3 731 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [1,0,0,0,0,0|1,0,0]=2 732 B11R1.36 C[C@H](N)[C@@H](O)c1cc[n]cc1 Amb25211095 [1,0,0,0,0,0|1,0,0]=2 733 B11R1.36 C[C@H](N)[C@@H](O)c1ccc[n]c1 Amb24710764 [1,0,0,0,0,0|1,0,0]=2 734 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb22349976 [1,0,0,0,0,0|0,0,0]=1 735 B11R1.36 C[C@H](N)[C@@H](S)c1ccccc1 Amb25241973 [1,0,0,0,0,0|0,1,0]=2 736 B11R1.36 C[C@H](N)[C@H](F)c1ccccc1 Amb25073105 [1,0,0,0,0,0|1,0,0]=2 737 B11R1.36 C[C@H](O)C(=C)c1ccccc1 Amb25188700 [1,0,0,0,0,0|2,0,1]=4 738 B11R1.36 C[C@H](O)C(=O)c1ccccc1 Amb25151480 [1,0,0,0,0,0|1,0,2]=4 739 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [1,0,0,0,0,0|1,0,0]=2 740 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [1,0,0,0,0,0|2,0,0]=3 741 B11R1.36 C[C@H](O)[C@@H](N)c1cc[n]cc1 Amb24485782 [1,0,0,0,0,0|3,0,0]=4 742 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [1,0,0,0,0,0|2,0,0]=3 743 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [1,0,0,0,0,0|1,0,0]=2 744 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [1,0,0,0,0,0|2,0,0]=3 745 B11R1.36 C[C@H](O)[C@H](N)c1ccc[n]c1 Amb24654822 [1,0,0,0,0,0|3,0,0]=4 746 B11R1.36 C[C@H](O)[C@H](N)c1cccc[n]1 Amb25189265 [1,0,0,0,0,0|3,0,0]=4 747 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [1,0,0,0,0,0|1,0,0]=2 748 B11R1.36 C[C@H]([C@@H](C)Cl)c1ccccc1 Amb24652492 [1,0,0,0,0,0|2,0,0]=3 749 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [1,0,0,0,0,0|0,0,2]=3 750 B11R1.36 ClC(Cl)C(Cl)c1ccccc1 Amb17835935 [1,0,0,0,0,0|3,0,0]=4 751 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [1,0,0,0,0,0|2,0,1]=4 752 B11R1.36 ClC(c1ccccc1)C(C)C Amb17138646 [1,0,0,0,0,0|1,0,0]=2 753 B11R1.36 ClC(c1ccccc1)C(N)C Amb17594246 [1,0,0,0,0,0|1,0,0]=2 754 B11R1.36 FC(C(Cl)Cl)c1ccccc1 Amb25362359 [1,0,0,0,0,0|3,0,0]=4 755 B11R1.36 FC(Cl)C(Cl)c1ccccc1 Amb24470147 [1,0,0,0,0,0|3,0,0]=4 756 B11R1.36 FC(F)C(Br)c1ccccc1 Amb24664987 [1,0,0,0,0,0|3,0,0]=4 757 B11R1.36 FC(F)C(Cl)c1ccccc1 Amb24400669 [1,0,0,0,0,0|3,0,0]=4 758 B11R1.36 N=C(Cl)C(O)c1ccccc1 Amb25149713 [1,0,0,0,0,0|1,0,2]=4 759 B11R1.36 NC(=N)C(F)c1ccccc1 Amb25069563 [1,0,0,0,0,0|2,0,1]=4 760 B11R1.36 NC(=N)C(O)c1ccccc1 Amb19890170 [1,0,0,0,0,0|1,0,1]=3 761 B11R1.36 NC(=N)[C@@H](O)c1ccccc1 Amb22587581 [1,0,0,0,0,0|1,0,1]=3 762 B11R1.36 NC(=N)[C@H](O)c1ccccc1 Amb22587530 [1,0,0,0,0,0|1,0,1]=3 763 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [1,0,0,0,0,0|2,0,1]=4 764 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [1,0,0,0,0,0|2,0,1]=4 765 B11R1.36 NC(=O)C(O)c1cc[n]cc1 Amb25783931 [1,0,0,0,0,0|2,0,1]=4 766 B11R1.36 NC(=O)C(O)c1ccc[n]c1 Amb18182774 [1,0,0,0,0,0|2,0,1]=4 767 B11R1.36 NC(=O)C(O)c1cccc[n]1 Amb24396108 [1,0,0,0,0,0|2,0,1]=4 768 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [1,0,0,0,0,0|2,0,1]=4 769 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [1,0,0,0,0,0|2,0,1]=4 770 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [1,0,0,0,0,0|2,0,1]=4 771 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [1,0,0,0,0,0|1,0,1]=3 772 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [1,0,0,0,0,0|2,0,1]=4 773 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [1,0,0,0,0,0|2,0,1]=4 774 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [1,0,0,0,0,0|2,0,1]=4 775 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [1,0,0,0,0,0|1,0,1]=3 776 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [1,0,0,0,0,0|2,0,1]=4 777 B11R1.36 NC(C(Cl)Cl)c1ccccc1 Amb25299414 [1,0,0,0,0,0|3,0,0]=4 778 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [1,0,0,0,0,0|2,0,1]=4 779 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [1,0,0,0,0,0|1,0,0]=2 780 B11R1.36 NC(c1ccncc1)C(N)C Amb13953208 [1,0,0,0,0,0|2,0,0]=3 781 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [1,0,0,0,0,0|2,0,1]=4 782 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [1,0,0,0,0,0|1,0,0]=2 783 B11R1.36 N[C@H](C(F)F)c1ccccc1 Amb24485821 [1,0,0,0,0,0|3,0,0]=4 784 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [1,0,0,0,0,0|2,0,1]=4 785 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [1,0,0,0,0,0|2,0,1]=4 786 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [1,0,0,0,0,0|2,0,1]=4 787 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [1,0,0,0,0,0|2,0,1]=4 788 B11R1.36 OC(C(F)Cl)c1ccccc1 Amb24509297 [1,0,0,0,0,0|2,0,0]=3 789 B11R1.36 OC(C(F)F)c1cc[n]cc1 Amb25840862 [1,0,0,0,0,0|3,0,0]=4 790 B11R1.36 OC(C(F)F)c1cccc[n]1 Amb24441352 [1,0,0,0,0,0|3,0,0]=4 791 B11R1.36 OC(C(F)F)c1ccccc1 Amb19895457 [1,0,0,0,0,0|2,0,0]=3 792 B11R1.36 OC(c1ccccc1)C(=C)C Amb10807411 [1,0,0,0,0,0|0,0,2]=3 793 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [1,0,0,0,0,0|1,0,1]=3 794 B11R1.36 OC(c1ccccc1)C(Br)C Amb17595842 [1,0,0,0,0,0|1,0,0]=2 795 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [1,0,0,0,0,0|3,0,0]=4 796 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [1,0,0,0,0,0|2,0,1]=4 797 B11R1.36 O[C@@H](C(F)Cl)c1ccccc1 Amb25028097 [1,0,0,0,0,0|2,0,0]=3 798 B11R1.36 O[C@@H]([C@H](F)Cl)c1ccccc1 Amb24390849 [1,0,0,0,0,0|2,0,0]=3 799 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [1,0,0,0,0,0|1,0,1]=3 800 B11R1.36 O[C@@H](c1ccccc1)[C@@H](N)C Amb17619646 [1,0,0,0,0,0|0,0,0]=1 801 B11R1.36 O[C@H](C(F)Cl)c1ccccc1 Amb24487906 [1,0,0,0,0,0|2,0,0]=3 802 B11R1.36 O[C@H](C(F)F)c1ccccc1 Amb24623094 [1,0,0,0,0,0|2,0,0]=3 803 B11R1.36 O[C@H](c1ccccc1)[C@H](N)C Amb10071337 [1,0,0,0,0,0|0,0,0]=1 804 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [1,0,0,0,0,0|1,1,1]=4 805 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [1,0,0,0,0,0|2,0,1]=4 806 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [1,0,0,0,0,0|2,0,1]=4 807 B11R1.40 BrC(Cc1ccccc1)C#N Amb1154191 [1,0,0,0,0,0|3,0,0]=4 808 B11R1.40 BrCC(Cc1ccccc1)O Amb17595843 [1,0,0,0,0,0|3,0,0]=4 809 B11R1.40 BrCC(Oc1ccccc1)C Amb17241866 [1,0,0,0,0,0|3,0,0]=4 810 B11R1.40 C#CC(Cl)Cc1ccccc1 Amb24398624 [1,0,0,0,0,0|2,0,1]=4 811 B11R1.40 C#CC(N)Cc1ccccc1 Amb24699229 [1,0,0,0,0,0|2,0,1]=4 812 B11R1.40 C#C[C@@H](O)Cc1ccccc1 Amb25056589 [1,0,0,0,0,0|2,0,1]=4 813 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [1,0,0,0,0,0|2,0,1]=4 814 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,0,0,0,0,0|2,0,1]=4 815 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [1,0,0,0,0,0|2,0,1]=4 816 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [1,0,0,0,0,0|2,0,1]=4 817 B11R1.40 CC(=NC)Oc1ccccc1 Amb24066830 [1,0,0,0,0,0|1,0,2]=4 818 B11R1.40 CC(C#N)Sc1ccccc1 Amb18800724 [1,0,0,0,0,0|3,0,0]=4 819 B11R1.40 CC(C=C)Nc1ccccc1 Amb24122661 [1,0,0,0,0,0|2,0,1]=4 820 B11R1.40 CC(C=C)Oc1ccccc1 Amb25151239 [1,0,0,0,0,0|2,0,1]=4 821 B11R1.40 CC(C=C)Sc1ccccc1 Amb25787941 [1,0,0,0,0,0|2,0,1]=4 822 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [1,0,0,0,0,0|3,0,0]=4 823 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [1,0,0,0,0,0|3,0,0]=4 824 B11R1.40 CC(CBr)Cc1c[n]ccc1 Amb25345425 [1,0,0,0,0,0|3,0,0]=4 825 B11R1.40 CC(CBr)Cc1ccccc1 Amb25151397 [1,0,0,0,0,0|2,0,0]=3 826 B11R1.40 CC(CCl)Sc1ccccc1 Amb25772834 [1,0,0,0,0,0|3,0,0]=4 827 B11R1.40 CC(CN)Cc1ccccc1 Amb18010535 [1,0,0,0,0,0|2,0,0]=3 828 B11R1.40 CC(CN)Nc1ccccc1 Amb18644448 [1,0,0,0,0,0|3,0,0]=4 829 B11R1.40 CC(CO)Cc1cc[n]cc1 Amb25374015 [1,0,0,0,0,0|3,0,0]=4 830 B11R1.40 CC(CO)Nc1ccccc1 Amb18971804 [1,0,0,0,0,0|3,0,0]=4 831 B11R1.40 CC(CO)Sc1ccccc1 Amb23449852 [1,0,0,0,0,0|3,0,0]=4 832 B11R1.40 CC(Cc1c[n]ccc1)NN Amb25341062 [1,0,0,0,0,0|2,0,0]=3 833 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [1,0,0,0,0,0|1,0,2]=4 834 B11R1.40 CC(Cc1ccccc1)C#N Amb24402121 [1,0,0,0,0,0|2,0,0]=3 835 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [1,0,0,0,0,0|1,0,1]=3 836 B11R1.40 CC(Cc1ccccc1)NN Amb22487303 [1,0,0,0,0,0|1,0,0]=2 837 B11R1.40 CC(Cc1ccccc1)[Mg]Br Amb22897350 [1,0,0,0,0,0|2,0,0]=3 838 B11R1.40 CC(Cc1ccccc1)[Zn]Br Amb22897866 [1,0,0,0,0,0|2,0,0]=3 839 B11R1.40 CC(NC)Cc1cnccn1 Amb1995173 [1,0,0,0,0,0|2,0,0]=3 840 B11R1.40 CC(Nc1ccccc1)C#N Amb17399903 [1,0,0,0,0,0|3,0,0]=4 841 B11R1.40 CCC(Br)Cc1cc[n]cc1 Amb24353281 [1,0,0,0,0,0|3,0,0]=4 842 B11R1.40 CCC(Br)Cc1ccccc1 Amb25189250 [1,0,0,0,0,0|2,0,0]=3 843 B11R1.40 CCC(C)Cc1c[n]ccc1 Amb24085206 [1,0,0,0,0,0|2,0,0]=3 844 B11R1.40 CCC(C)Cc1cccc[n]1 Amb24089681 [1,0,0,0,0,0|2,0,0]=3 845 B11R1.40 CCC(C)Oc1ccccc1 Amb24350256 [1,0,0,0,0,0|2,0,0]=3 846 B11R1.40 CCC(C)Sc1cccc[n]1 Amb25822094 [1,0,0,0,0,0|3,0,0]=4 847 B11R1.40 CCC(C)Sc1ccccc1 Amb25698974 [1,0,0,0,0,0|2,0,0]=3 848 B11R1.40 CCC(Cc1ccccn1)Cl Amb17477711 [1,0,0,0,0,0|3,0,0]=4 849 B11R1.40 CCC(Cc1ccccn1)O Amb17477703 [1,0,0,0,0,0|3,0,0]=4 850 B11R1.40 CCC(Cc1cccnc1)Cl Amb17477713 [1,0,0,0,0,0|3,0,0]=4 851 B11R1.40 CCC(Cc1cccnc1)O Amb17477705 [1,0,0,0,0,0|3,0,0]=4 852 B11R1.40 CCC(Cc1ccncc1)Cl Amb17477712 [1,0,0,0,0,0|3,0,0]=4 853 B11R1.40 CCC(Cc1ccncc1)O Amb17477704 [1,0,0,0,0,0|3,0,0]=4 854 B11R1.40 CCC(Cl)Cc1ccccc1 Amb18177890 [1,0,0,0,0,0|2,0,0]=3 855 B11R1.40 CCN(C)Cc1c[n]ccc1 Amb25133981 [1,0,0,0,0,0|3,0,0]=4 856 B11R1.40 CCN(Cc1ccccc1)C Amb10807414 [1,0,0,0,0,0|2,0,0]=3 857 B11R1.40 CCN(Cc1ccccc1)N Amb17232076 [1,0,0,0,0,0|3,0,0]=4 858 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [1,0,0,0,0,0|3,0,0]=4 859 B11R1.40 CC[C@@H](Br)Cc1ccccc1 Amb25770013 [1,0,0,0,0,0|2,0,0]=3 860 B11R1.40 CC[C@@H](Cl)Cc1ccccc1 Amb24710145 [1,0,0,0,0,0|2,0,0]=3 861 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb22748727 [1,0,0,0,0,0|2,0,0]=3 862 B11R1.40 CC[C@@H](N)Cc1ccccc1 Amb25141525 [1,0,0,0,0,0|2,0,0]=3 863 B11R1.40 CC[C@@H](O)Cc1ccccc1 Amb19375372 [1,0,0,0,0,0|2,0,0]=3 864 B11R1.40 CC[C@H](Cl)Cc1ccccc1 Amb25765719 [1,0,0,0,0,0|2,0,0]=3 865 B11R1.40 CC[C@H](N)Cc1cccc[n]1 Amb24432851 [1,0,0,0,0,0|3,0,0]=4 866 B11R1.40 CC[C@H](N)Cc1ccccc1 Amb19929690 [1,0,0,0,0,0|2,0,0]=3 867 B11R1.40 CN(CCl)Cc1ccccc1 Amb25324443 [1,0,0,0,0,0|3,0,0]=4 868 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [1,0,0,0,0,0|3,0,0]=4 869 B11R1.40 CN(Cc1ccccc1)C#N Amb25072835 [1,0,0,0,0,0|3,0,0]=4 870 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [1,0,0,0,0,0|3,0,0]=4 871 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [1,0,0,0,0,0|2,0,1]=4 872 B11R1.40 CNC(=N)Cc1cccc[n]1 Amb25261557 [1,0,0,0,0,0|2,0,1]=4 873 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [1,0,0,0,0,0|2,0,1]=4 874 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [1,0,0,0,0,0|2,0,1]=4 875 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [1,0,0,0,0,0|2,0,1]=4 876 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [1,0,0,0,0,0|1,0,1]=3 877 B11R1.40 CNC(C)Cc1[n][n]cc[n]1 Amb25196098 [1,0,0,0,0,0|3,0,0]=4 878 B11R1.40 CNC(Cc1ccccc1)C Amb17616872 [1,0,0,0,0,0|0,0,0]=1 879 B11R1.40 CNC(Cc1ccccn1)C Amb1995150 [1,0,0,0,0,0|1,0,0]=2 880 B11R1.40 CN[C@H](Cc1ccccc1)C Amb17616868 [1,0,0,0,0,0|0,0,0]=1 881 B11R1.40 CN\C(\Cl)=N\c1ccccc1 Amb24670343 [1,0,0,0,0,0|2,0,1]=4 882 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [1,0,0,0,0,0|2,0,1]=4 883 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [1,0,0,0,0,0|2,0,1]=4 884 B11R1.40 COC(C)Cc1cc[n]cc1 Amb24485830 [1,0,0,0,0,0|2,0,0]=3 885 B11R1.40 COC(Cl)Cc1ccccc1 Amb24711453 [1,0,0,0,0,0|2,0,0]=3 886 B11R1.40 COC(O)Cc1ccccc1 Amb24659514 [1,0,0,0,0,0|2,0,0]=3 887 B11R1.40 CO[SiH](C)Cc1ccccc1 Amb19893555 [1,0,0,0,0,0|1,1,0]=3 888 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [1,0,0,0,0,0|2,0,1]=4 889 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [1,0,0,0,0,0|2,0,1]=4 890 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [1,0,0,0,0,0|3,0,0]=4 891 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [1,0,0,0,0,0|3,0,0]=4 892 B11R1.40 C[C@@H](CN)Cc1ccccc1 Amb24615612 [1,0,0,0,0,0|2,0,0]=3 893 B11R1.40 C[C@@H](CO)Sc1ccccc1 Amb25043604 [1,0,0,0,0,0|3,0,0]=4 894 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [1,0,0,0,0,0|3,0,0]=4 895 B11R1.40 C[C@H](CN)Cc1cc[n]cc1 Amb24745496 [1,0,0,0,0,0|3,0,0]=4 896 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,0,0,0,0,0|2,0,0]=3 897 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [1,0,0,0,0,0|2,0,0]=3 898 B11R1.40 C\C(=C/c1cc[n]cc1)\NC Amb25727273 [1,0,0,0,0,0|1,0,2]=4 899 B11R1.40 C\C(=C/c1ccccc1)\NC Amb25825428 [1,0,0,0,0,0|0,0,2]=3 900 B11R1.40 C\C(\CC)=C\c1ccccc1 Amb22546773 [1,0,0,0,0,0|1,0,2]=4 901 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [1,0,0,0,0,0|2,0,1]=4 902 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [1,0,0,0,0,0|1,0,2]=4 903 B11R1.40 C\C(\NC)=N/c1c[n]ccc1 Amb25145908 [1,0,0,0,0,0|2,0,1]=4 904 B11R1.40 C\C(\NC)=N/c1cccc[n]1 Amb24679597 [1,0,0,0,0,0|2,0,1]=4 905 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [1,0,0,0,0,0|1,0,2]=4 906 B11R1.40 ClC(Cc1ccccc1)C#N Amb1103676 [1,0,0,0,0,0|3,0,0]=4 907 B11R1.40 ClCC(Cc1ccccc1)C Amb17477588 [1,0,0,0,0,0|2,0,0]=3 908 B11R1.40 ClCC(Cl)Cc1ccccc1 Amb25061392 [1,0,0,0,0,0|3,0,0]=4 909 B11R1.40 ClCC(Oc1ccccc1)C Amb17232796 [1,0,0,0,0,0|3,0,0]=4 910 B11R1.40 FCC(Br)Cc1ccccc1 Amb24611243 [1,0,0,0,0,0|3,0,0]=4 911 B11R1.40 FCC(Cc1ccccc1)N Amb17614462 [1,0,0,0,0,0|3,0,0]=4 912 B11R1.40 FCC(F)Cc1ccccc1 Amb22641518 [1,0,0,0,0,0|3,0,0]=4 913 B11R1.40 N#C[C@@H](O)Cc1ccccc1 Amb24715921 [1,0,0,0,0,0|3,0,0]=4 914 B11R1.40 N#C[C@H](O)Cc1ccccc1 Amb25846935 [1,0,0,0,0,0|3,0,0]=4 915 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,0,0,0,0,0|2,0,1]=4 916 B11R1.40 NC(CBr)Cc1ccccc1 Amb22489725 [1,0,0,0,0,0|3,0,0]=4 917 B11R1.40 NC(Cc1ccccc1)C#N Amb1127111 [1,0,0,0,0,0|3,0,0]=4 918 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [1,0,0,0,0,0|2,0,0]=3 919 B11R1.40 NCC(Cl)Cc1ccccc1 Amb24740670 [1,0,0,0,0,0|3,0,0]=4 920 B11R1.40 NCC(F)Cc1ccccc1 Amb24434017 [1,0,0,0,0,0|3,0,0]=4 921 B11R1.40 NCC(S)Cc1ccccc1 Amb18251941 [1,0,0,0,0,0|3,0,0]=4 922 B11R1.40 NCC(Sc1ccccc1)C Amb17485971 [1,0,0,0,0,0|3,0,0]=4 923 B11R1.40 NC[C@@H](Cc1ccccc1)N Amb17619359 [1,0,0,0,0,0|3,0,0]=4 924 B11R1.40 NC[C@@H](O)Cc1ccccc1 Amb22746804 [1,0,0,0,0,0|3,0,0]=4 925 B11R1.40 NC[C@H](Cc1ccccc1)N Amb17619360 [1,0,0,0,0,0|3,0,0]=4 926 B11R1.40 NC[C@H](O)Cc1ccccc1 Amb24538166 [1,0,0,0,0,0|3,0,0]=4 927 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [1,0,0,0,0,0|2,0,1]=4 928 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [1,0,0,0,0,0|2,0,1]=4 929 B11R1.40 N[C@@H](CBr)Cc1ccccc1 Amb22747782 [1,0,0,0,0,0|3,0,0]=4 930 B11R1.40 N[C@@H](CCl)Cc1ccccc1 Amb24758237 [1,0,0,0,0,0|3,0,0]=4 931 B11R1.40 N[C@@H](CF)Cc1ccccc1 Amb24484482 [1,0,0,0,0,0|3,0,0]=4 932 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [1,0,0,0,0,0|3,0,0]=4 933 B11R1.40 N[C@@H](CS)Cc1ccccc1 Amb25073967 [1,0,0,0,0,0|3,0,0]=4 934 B11R1.40 N[C@@H](Cc1ccccc1)C#N Amb17399902 [1,0,0,0,0,0|3,0,0]=4 935 B11R1.40 N[C@H](CCl)Cc1ccccc1 Amb24533056 [1,0,0,0,0,0|3,0,0]=4 936 B11R1.40 N[C@H](CF)Cc1ccccc1 Amb25151303 [1,0,0,0,0,0|3,0,0]=4 937 B11R1.40 N[C@H](CS)Cc1ccccc1 Amb25765677 [1,0,0,0,0,0|3,0,0]=4 938 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [1,0,0,0,0,0|3,0,0]=4 939 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [1,0,0,0,0,0|3,0,0]=4 940 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [1,0,0,0,0,0|3,0,0]=4 941 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [1,0,0,0,0,0|3,0,0]=4 942 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [1,0,0,0,0,0|3,0,0]=4 943 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [1,0,0,0,0,0|3,0,0]=4 944 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [1,0,0,0,0,0|3,0,0]=4 945 B11R1.40 O=NC(Cc1ccccn1)C Amb10549352 [1,0,0,0,0,0|2,0,1]=4 946 B11R1.40 OC(CF)Cc1ccccc1 Amb24733743 [1,0,0,0,0,0|3,0,0]=4 947 B11R1.40 OC(CS)Cc1ccccc1 Amb25740621 [1,0,0,0,0,0|3,0,0]=4 948 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [1,0,0,0,0,0|3,0,0]=4 949 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [1,0,0,0,0,0|2,0,0]=3 950 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [1,0,0,0,0,0|3,0,0]=4 951 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,0,0,0,0,0|3,0,0]=4 952 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [1,0,0,0,0,0|3,0,0]=4 953 B11R1.40 OCC(Oc1ccccc1)C Amb17232100 [1,0,0,0,0,0|3,0,0]=4 954 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [1,0,0,0,0,0|3,0,0]=4 955 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [1,0,0,0,0,0|3,0,0]=4 956 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [1,0,0,0,0,0|3,0,0]=4 957 B11R1.40 O[C@@H](CCl)Cc1ccccc1 Amb19929327 [1,0,0,0,0,0|3,0,0]=4 958 B11R1.40 O[C@H](CBr)Cc1ccccc1 Amb24392488 [1,0,0,0,0,0|3,0,0]=4 959 B11R1.40 O[C@H](CCl)Cc1ccccc1 Amb19929332 [1,0,0,0,0,0|3,0,0]=4 960 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [1,0,0,0,0,0|3,0,0]=4 961 B13R1.21 C=CC(Cl)C(O)c1ccc(Cl)cc1 Amb25735131 [0,1,0,0,0,0|2,0,1]=4 962 B13R1.21 C=C[C@@H](Cl)[C@@H](O)c1ccc(F)cc1 Amb24383084 [0,1,0,0,0,0|2,0,1]=4 963 B13R1.21 C=C[C@@H](Cl)[C@H](O)c1ccc(F)cc1 Amb25756126 [0,1,0,0,0,0|2,0,1]=4 964 B13R1.21 C=C[C@H](Cl)[C@@H](O)c1ccc(F)cc1 Amb24668958 [0,1,0,0,0,0|2,0,1]=4 965 B13R1.21 CC(=C=C)[C@@H](O)c1ccc(Cl)cc1 Amb24495960 [0,1,0,0,0,0|1,0,2]=4 966 B13R1.21 CC(C#C)C(O)c1ccc(Cl)cc1 Amb24748254 [0,1,0,0,0,0|1,0,1]=3 967 B13R1.21 CC(C#N)C(O)c1ccc(Br)c[n]1 Amb24662821 [0,1,0,0,0,0|3,0,0]=4 968 B13R1.21 CC(C#N)C(O)c1ccc(Cl)cc1 Amb25786005 [0,1,0,0,0,0|2,0,0]=3 969 B13R1.21 CC(C#N)C(O)c1ccc(I)cc1 Amb25258467 [0,1,0,0,0,0|2,0,0]=3 970 B13R1.21 CC(C(Br)CC)c1ccc(F)cc1 Amb24489611 [0,1,0,0,0,0|3,0,0]=4 971 B13R1.21 CC(C(Br)CC)c1ccc(I)cc1 Amb24736667 [0,1,0,0,0,0|3,0,0]=4 972 B13R1.21 CC(C(Cl)CC)c1ccc(Cl)cc1 Amb24632690 [0,1,0,0,0,0|3,0,0]=4 973 B13R1.21 CC(C(N)CC)c1ccc(Cl)cc1 Amb24427149 [0,1,0,0,0,0|3,0,0]=4 974 B13R1.21 CC(C(N)CC)c1ccc(F)cc1 Amb25670384 [0,1,0,0,0,0|3,0,0]=4 975 B13R1.21 CC(C(N)CC)c1ccc(I)cc1 Amb24533492 [0,1,0,0,0,0|3,0,0]=4 976 B13R1.21 CC(C(O)CC)c1ccc(Cl)cc1 Amb25743792 [0,1,0,0,0,0|3,0,0]=4 977 B13R1.21 CC(C(O)CC)c1ccc(I)cc1 Amb25859488 [0,1,0,0,0,0|3,0,0]=4 978 B13R1.21 CC(C=C)C(O)c1ccc(Cl)cc1 Amb25099387 [0,1,0,0,0,0|1,0,1]=3 979 B13R1.21 CC(C=C)C(O)c1ccc(F)cc1 Amb24466178 [0,1,0,0,0,0|1,0,1]=3 980 B13R1.21 CC(C=C)C(O)c1ccc(O)cc1 Amb25706921 [0,1,0,0,0,0|1,0,1]=3 981 B13R1.21 CC(C=O)C(O)c1ccc(Cl)cc1 Amb25086674 [0,1,0,0,0,0|2,0,0]=3 982 B13R1.21 CC(CC)C(Br)c1ccc(Br)cc1 Amb24462231 [0,1,0,0,0,0|2,0,0]=3 983 B13R1.21 CC(CC)C(Br)c1ccc(Cl)cc1 Amb24590675 [0,1,0,0,0,0|2,0,0]=3 984 B13R1.21 CC(CC)C(C)c1ccc(O)cc1 Amb25833640 [0,1,0,0,0,0|2,0,0]=3 985 B13R1.21 CC(CC)C(Cl)c1ccc(Br)cc1 Amb24354769 [0,1,0,0,0,0|2,0,0]=3 986 B13R1.21 CC(CC)C(Cl)c1ccc(Cl)cc1 Amb25681629 [0,1,0,0,0,0|2,0,0]=3 987 B13R1.21 CC(CC)C(Cl)c1ccc(F)cc1 Amb18320529 [0,1,0,0,0,0|2,0,0]=3 988 B13R1.21 CC(CC)C(N)c1ccc(Cl)[n]c1 Amb25227937 [0,1,0,0,0,0|3,0,0]=4 989 B13R1.21 CC(CC)C(N)c1ccc(F)c[n]1 Amb25767410 [0,1,0,0,0,0|3,0,0]=4 990 B13R1.21 CC(CC)C(N)c1ccc(I)cc1 Amb24350453 [0,1,0,0,0,0|2,0,0]=3 991 B13R1.21 CC(CC)C(N)c1ccc(O)cc1 Amb24655049 [0,1,0,0,0,0|2,0,0]=3 992 B13R1.21 CC(CC)C(O)c1ccc(Br)c[n]1 Amb24671582 [0,1,0,0,0,0|2,0,0]=3 993 B13R1.21 CC(CC)C(O)c1ccc(Cl)c[n]1 Amb24650571 [0,1,0,0,0,0|2,0,0]=3 994 B13R1.21 CC(CC)C(O)c1ccc(Cl)cc1 Amb19056193 [0,1,0,0,0,0|1,0,0]=2 995 B13R1.21 CC(CC)C(O)c1ccc(F)c[n]1 Amb24463097 [0,1,0,0,0,0|2,0,0]=3 996 B13R1.21 CC(CC)C(O)c1ccc(F)cc1 Amb18796622 [0,1,0,0,0,0|1,0,0]=2 997 B13R1.21 CC(CC)[C@@H](N)c1ccc(F)cc1 Amb24634729 [0,1,0,0,0,0|2,0,0]=3 998 B13R1.21 CC(CC)[C@H](N)c1ccc(Br)c[n]1 Amb25201683 [0,1,0,0,0,0|3,0,0]=4 999 B13R1.21 CC(CN)C(C)c1ccc(Cl)cc1 Amb18188140 [0,1,0,0,0,0|3,0,0]=4 1000 B13R1.21 CC(CN)C(C)c1ccc(F)cc1 Amb18192870 [0,1,0,0,0,0|3,0,0]=4 1001 B13R1.21 CC(CN)C(F)c1ccc(Cl)cc1 Amb25341542 [0,1,0,0,0,0|3,0,0]=4 1002 B13R1.21 CC(CN)C(O)c1ccc(Br)cc1 Amb18155764 [0,1,0,0,0,0|2,0,0]=3 1003 B13R1.21 CC(CN)C(O)c1ccc(Cl)cc1 Amb18187531 [0,1,0,0,0,0|2,0,0]=3 1004 B13R1.21 CC(CN)C(O)c1ccc(F)cc1 Amb18823322 [0,1,0,0,0,0|2,0,0]=3 1005 B13R1.21 CC(CO)C(N)c1ccc(Cl)cc1 Amb24489894 [0,1,0,0,0,0|3,0,0]=4 1006 B13R1.21 CC(NC)C(C)c1ccc(Cl)cc1 Amb20623680 [0,1,0,0,0,0|1,0,0]=2 1007 B13R1.21 CC(NC)C(O)c1ccc(Cl)cc1 Amb18066518 [0,1,0,0,0,0|0,0,0]=1 1008 B13R1.21 CC(NC)C(O)c1ccc(F)cc1 Amb18564246 [0,1,0,0,0,0|0,0,0]=1 1009 B13R1.21 CC(OC)C(N)c1ccc(Br)cc1 Amb18155746 [0,1,0,0,0,0|2,0,0]=3 1010 B13R1.21 CC(OC)C(N)c1ccc(Cl)cc1 Amb18187532 [0,1,0,0,0,0|2,0,0]=3 1011 B13R1.21 CC(SC)C(N)c1ccc(F)cc1 Amb25157777 [0,1,0,0,0,0|2,0,0]=3 1012 B13R1.21 CCC(C)S(=O)c1ccc(N)cc1 Amb18291947 [0,1,0,0,0,0|2,0,1]=4 1013 B13R1.21 CCC(N)C(N)c1ccc(O)cc1 Amb25238424 [0,1,0,0,0,0|3,0,0]=4 1014 B13R1.21 CCC(N)C(O)c1ccc(F)[n]c1 Amb25302235 [0,1,0,0,0,0|3,0,0]=4 1015 B13R1.21 CCC(N)C(O)c1ccc(N)cc1 Amb25211794 [0,1,0,0,0,0|2,0,0]=3 1016 B13R1.21 CCC(N)C(O)c1ccc(O)[n]c1 Amb24540813 [0,1,0,0,0,0|3,0,0]=4 1017 B13R1.21 CCC(O)C(N)c1ccc(Br)cc1 Amb18723288 [0,1,0,0,0,0|3,0,0]=4 1018 B13R1.21 CCC(O)C(N)c1ccc(Cl)cc1 Amb18810921 [0,1,0,0,0,0|3,0,0]=4 1019 B13R1.21 CCC(O)C(N)c1ccc(F)cc1 Amb25206264 [0,1,0,0,0,0|3,0,0]=4 1020 B13R1.21 CCC(O)C(N)c1ccc(I)cc1 Amb25069695 [0,1,0,0,0,0|3,0,0]=4 1021 B13R1.21 CCC(O)C(N)c1ccc(O)cc1 Amb18193108 [0,1,0,0,0,0|3,0,0]=4 1022 B13R1.21 CC[C@@H](C)C(=O)c1ccc(O)cc1 Amb25768472 [0,1,0,0,0,0|1,0,2]=4 1023 B13R1.21 CC[C@@H](N)[C@@H](N)c1ccc(Cl)cc1 Amb25375781 [0,1,0,0,0,0|3,0,0]=4 1024 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(Br)cc1 Amb24672715 [0,1,0,0,0,0|2,0,0]=3 1025 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(Cl)c[n]1 Amb24565955 [0,1,0,0,0,0|3,0,0]=4 1026 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(F)cc1 Amb25291138 [0,1,0,0,0,0|2,0,0]=3 1027 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(N)[n]c1 Amb24629890 [0,1,0,0,0,0|3,0,0]=4 1028 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(N)c[n]1 Amb24617802 [0,1,0,0,0,0|3,0,0]=4 1029 B13R1.21 CC[C@@H](N)[C@@H](O)c1ccc(N)cc1 Amb25200296 [0,1,0,0,0,0|2,0,0]=3 1030 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(Cl)c[n]1 Amb24565934 [0,1,0,0,0,0|3,0,0]=4 1031 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(F)c[n]1 Amb25227997 [0,1,0,0,0,0|3,0,0]=4 1032 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(N)[n]c1 Amb25366509 [0,1,0,0,0,0|3,0,0]=4 1033 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(N)cc1 Amb25200288 [0,1,0,0,0,0|2,0,0]=3 1034 B13R1.21 CC[C@@H](N)[C@H](O)c1ccc(O)[n]c1 Amb24564529 [0,1,0,0,0,0|3,0,0]=4 1035 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(F)cc1 Amb25355068 [0,1,0,0,0,0|3,0,0]=4 1036 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(I)cc1 Amb25083505 [0,1,0,0,0,0|3,0,0]=4 1037 B13R1.21 CC[C@@H](O)[C@@H](N)c1ccc(O)cc1 Amb25214623 [0,1,0,0,0,0|3,0,0]=4 1038 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(Cl)cc1 Amb25804627 [0,1,0,0,0,0|3,0,0]=4 1039 B13R1.21 CC[C@H](N)[C@@H](N)c1ccc(I)cc1 Amb24542794 [0,1,0,0,0,0|3,0,0]=4 1040 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(Cl)c[n]1 Amb25200228 [0,1,0,0,0,0|3,0,0]=4 1041 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(F)[n]c1 Amb24540852 [0,1,0,0,0,0|3,0,0]=4 1042 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(F)c[n]1 Amb24629184 [0,1,0,0,0,0|3,0,0]=4 1043 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(N)c[n]1 Amb24565949 [0,1,0,0,0,0|3,0,0]=4 1044 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(O)[n]c1 Amb24558741 [0,1,0,0,0,0|3,0,0]=4 1045 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(O)c[n]1 Amb25200099 [0,1,0,0,0,0|3,0,0]=4 1046 B13R1.21 CC[C@H](N)[C@@H](O)c1ccc(O)cc1 Amb25249273 [0,1,0,0,0,0|2,0,0]=3 1047 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(F)c[n]1 Amb24587406 [0,1,0,0,0,0|3,0,0]=4 1048 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(N)[n]c1 Amb24561948 [0,1,0,0,0,0|3,0,0]=4 1049 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(O)[n]c1 Amb24542793 [0,1,0,0,0,0|3,0,0]=4 1050 B13R1.21 CC[C@H](N)[C@H](O)c1ccc(O)cc1 Amb24558780 [0,1,0,0,0,0|2,0,0]=3 1051 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(Br)cc1 Amb24423456 [0,1,0,0,0,0|3,0,0]=4 1052 B13R1.21 CC[C@H](O)[C@H](N)c1ccc(Cl)cc1 Amb24645223 [0,1,0,0,0,0|3,0,0]=4 1053 B13R1.21 CN(C(C)CC)c1ccc(F)cc1 Amb24732769 [0,1,0,0,0,0|3,0,0]=4 1054 B13R1.21 CN(CC)C(C)c1ccc(Cl)cc1 Amb24541454 [0,1,0,0,0,0|3,0,0]=4 1055 B13R1.21 CN(CC)C(C)c1ccc(N)cc1 Amb18973999 [0,1,0,0,0,0|3,0,0]=4 1056 B13R1.21 CN(OC)C(C)c1ccc(N)cc1 Amb18974002 [0,1,0,0,0,0|3,0,0]=4 1057 B13R1.21 CNC(=O)C(C)c1ccc(Br)cc1 Amb24677369 [0,1,0,0,0,0|2,0,1]=4 1058 B13R1.21 CNC(=O)C(C)c1ccc(N)cc1 Amb24415382 [0,1,0,0,0,0|2,0,1]=4 1059 B13R1.21 CNC(=O)C(Cl)c1ccc(Br)cc1 Amb25782797 [0,1,0,0,0,0|2,0,1]=4 1060 B13R1.21 CNC(=O)C(Cl)c1ccc(Cl)cc1 Amb24439006 [0,1,0,0,0,0|2,0,1]=4 1061 B13R1.21 CNC(=O)C(Cl)c1ccc(I)cc1 Amb25112892 [0,1,0,0,0,0|2,0,1]=4 1062 B13R1.21 CNC(=O)C(N)c1ccc(Br)cc1 Amb25102382 [0,1,0,0,0,0|2,0,1]=4 1063 B13R1.21 CNC(=O)C(O)c1ccc(O)cc1 Amb25292381 [0,1,0,0,0,0|1,0,1]=3 1064 B13R1.21 CNC(=O)C(c1ccc(cc1)C)O Amb17400709 [0,1,0,0,0,0|1,0,1]=3 1065 B13R1.21 CNC(=O)C(c1ccc(cc1)Cl)O Amb17402319 [0,1,0,0,0,0|1,0,1]=3 1066 B13R1.21 CNC(=O)C(c1ccc(cc1)F)O Amb17400966 [0,1,0,0,0,0|1,0,1]=3 1067 B13R1.21 CNC(=O)N(O)c1ccc(Cl)cc1 Amb22433750 [0,1,0,0,0,0|2,0,1]=4 1068 B13R1.21 CNC(=O)[C@@H](N)c1ccc(F)cc1 Amb25764582 [0,1,0,0,0,0|2,0,1]=4 1069 B13R1.21 CNC(=O)[C@@H](N)c1ccc(O)cc1 Amb25138741 [0,1,0,0,0,0|2,0,1]=4 1070 B13R1.21 CNC(=O)[C@H](N)c1ccc(F)cc1 Amb25049377 [0,1,0,0,0,0|2,0,1]=4 1071 B13R1.21 CNC(=O)[C@H](N)c1ccc(O)cc1 Amb25793593 [0,1,0,0,0,0|2,0,1]=4 1072 B13R1.21 CNC(C(=O)c1ccc(cc1)Br)C Amb17312906 [0,1,0,0,0,0|0,0,2]=3 1073 B13R1.21 CNC(C(=O)c1ccc(cc1)C)C Amb17312656 [0,1,0,0,0,0|0,0,2]=3 1074 B13R1.21 CNC(C(=O)c1ccc(cc1)Cl)C Amb17312952 [0,1,0,0,0,0|0,0,2]=3 1075 B13R1.21 CNC(C(=O)c1ccc(cc1)F)C Amb17313013 [0,1,0,0,0,0|0,0,2]=3 1076 B13R1.21 CNC(C(=O)c1ccc(cc1)F)C Amb17614417 [0,1,0,0,0,0|0,0,2]=3 1077 B13R1.21 CNC(C)C(=O)c1ccc(N)cc1 Amb18051421 [0,1,0,0,0,0|0,0,2]=3 1078 B13R1.21 COC(=O)C(O)c1ccc(Br)cc1 Amb23596562 [0,1,0,0,0,0|2,0,1]=4 1079 B13R1.21 COC(=O)C(O)c1ccc(Cl)cc1 Amb18333892 [0,1,0,0,0,0|2,0,1]=4 1080 B13R1.21 COC(=O)C(O)c1ccc(F)cc1 Amb19068667 [0,1,0,0,0,0|2,0,1]=4 1081 B13R1.21 COC(=O)C(O)c1ccc(O)cc1 Amb18187058 [0,1,0,0,0,0|2,0,1]=4 1082 B13R1.21 COC(=O)[C@@H](O)c1ccc(F)cc1 Amb24182090 [0,1,0,0,0,0|2,0,1]=4 1083 B13R1.21 COC(=O)[C@@H](O)c1ccc(N)cc1 Amb25066970 [0,1,0,0,0,0|2,0,1]=4 1084 B13R1.21 COC(=O)[C@H](O)c1ccc(F)cc1 Amb25308222 [0,1,0,0,0,0|2,0,1]=4 1085 B13R1.21 COC(C(c1ccc(cc1)C)N)C Amb1133669 [0,1,0,0,0,0|2,0,0]=3 1086 B13R1.21 COC(C(c1ccc(cc1)F)N)C Amb1139503 [0,1,0,0,0,0|2,0,0]=3 1087 B13R1.21 CSC(C)C(=O)c1ccc(Br)cc1 Amb24356936 [0,1,0,0,0,0|1,0,2]=4 1088 B13R1.21 CSC(C)C(=O)c1ccc(F)cc1 Amb19055166 [0,1,0,0,0,0|1,0,2]=4 1089 B13R1.21 C[C@@H](C#C)[C@@H](O)c1ccc(Cl)cc1 Amb25285560 [0,1,0,0,0,0|1,0,1]=3 1090 B13R1.21 C[C@@H](C=C)[C@@H](O)c1ccc(F)cc1 Amb25205074 [0,1,0,0,0,0|1,0,1]=3 1091 B13R1.21 C[C@@H](C=C)[C@H](N)c1ccc(F)cc1 Amb24356991 [0,1,0,0,0,0|2,0,1]=4 1092 B13R1.21 C[C@@H](C=C)[C@H](O)c1ccc(F)cc1 Amb25832630 [0,1,0,0,0,0|1,0,1]=3 1093 B13R1.21 C[C@@H](C=O)[C@@H](O)c1ccc(Cl)cc1 Amb24452224 [0,1,0,0,0,0|2,0,0]=3 1094 B13R1.21 C[C@@H](C=O)[C@@H](O)c1ccc(F)cc1 Amb25143463 [0,1,0,0,0,0|2,0,0]=3 1095 B13R1.21 C[C@@H](C=O)[C@H](O)c1ccc(Cl)cc1 Amb24357237 [0,1,0,0,0,0|2,0,0]=3 1096 B13R1.21 C[C@@H](CO)[C@@H](O)c1ccc(F)cc1 Amb25065513 [0,1,0,0,0,0|2,0,0]=3 1097 B13R1.21 C[C@@H](NC)[C@@H](O)c1ccc(N)cc1 Amb25858781 [0,1,0,0,0,0|0,0,0]=1 1098 B13R1.21 C[C@H](C#C)[C@@H](O)c1ccc(Cl)cc1 Amb25753334 [0,1,0,0,0,0|1,0,1]=3 1099 B13R1.21 C[C@H](C=C)[C@@H](O)c1ccc(F)cc1 Amb25806732 [0,1,0,0,0,0|1,0,1]=3 1100 B13R1.21 C[C@H](C=C)[C@H](O)c1ccc(Cl)cc1 Amb24431799 [0,1,0,0,0,0|1,0,1]=3 1101 B13R1.21 C[C@H](C=O)[C@@H](O)c1ccc(F)cc1 Amb25313127 [0,1,0,0,0,0|2,0,0]=3 1102 B13R1.21 C[C@H](C=O)[C@H](O)c1ccc(Cl)cc1 Amb24444877 [0,1,0,0,0,0|2,0,0]=3 1103 B13R1.21 C[C@H](C=O)[C@H](O)c1ccc(F)cc1 Amb24467531 [0,1,0,0,0,0|2,0,0]=3 1104 B13R1.21 C[C@H](CO)[C@H](O)c1ccc(F)cc1 Amb25356299 [0,1,0,0,0,0|2,0,0]=3 1105 B13R1.21 C[C@H](NC)[C@@H](O)c1ccc(N)cc1 Amb25771909 [0,1,0,0,0,0|0,0,0]=1 1106 B13R1.21 C[C@H](NC)[C@H](O)c1ccc(N)cc1 Amb24366029 [0,1,0,0,0,0|0,0,0]=1 1107 B13R1.21 C[C@H](NC)[C@H](O)c1ccc(O)cc1 Amb25069019 [0,1,0,0,0,0|0,0,0]=1 1108 B13R1.21 C\C(=C\C)\C(O)c1ccc(F)cc1 Amb25769390 [0,1,0,0,0,0|1,0,1]=3 1109 B13R1.21 Cc1c[n]c([n]c1)C(O)C(C)CC Amb24408518 [0,1,0,0,0,0|3,0,0]=4 1110 B13R1.21 Cc1c[n]c(c[n]1)C(O)C(C)CC Amb25795794 [0,1,0,0,0,0|3,0,0]=4 1111 B13R1.21 Cc1ccc([n]c1)C(O)C(C)C#N Amb25192054 [0,1,0,0,0,0|3,0,0]=4 1112 B13R1.21 Cc1ccc([n]c1)C(O)C(C)CC Amb24520939 [0,1,0,0,0,0|2,0,0]=3 1113 B13R1.21 Cc1ccc([n]c1)[C@H](O)[C@@H](N)CC Amb24678314 [0,1,0,0,0,0|3,0,0]=4 1114 B13R1.21 Cc1ccc(c[n]1)C(N)C(C)CC Amb24727874 [0,1,0,0,0,0|3,0,0]=4 1115 B13R1.21 Cc1ccc(c[n]1)C(O)C(C)C#N Amb25801412 [0,1,0,0,0,0|3,0,0]=4 1116 B13R1.21 Cc1ccc(c[n]1)C(O)C(C)CC Amb25154809 [0,1,0,0,0,0|2,0,0]=3 1117 B13R1.21 Cc1ccc(c[n]1)C(O)C(N)CC Amb18824369 [0,1,0,0,0,0|3,0,0]=4 1118 B13R1.21 Cc1ccc(c[n]1)[C@@H](O)[C@H](N)CC Amb24558435 [0,1,0,0,0,0|3,0,0]=4 1119 B13R1.21 Cc1ccc(c[n]1)[C@H](O)[C@@H](N)CC Amb25200227 [0,1,0,0,0,0|3,0,0]=4 1120 B13R1.21 Cc1ccc(cc1)C(=O)C(C)NC Amb18540236 [0,1,0,0,0,0|0,0,2]=3 1121 B13R1.21 Cc1ccc(cc1)C(=O)C(C)SC Amb18321261 [0,1,0,0,0,0|1,0,2]=4 1122 B13R1.21 Cc1ccc(cc1)C(Br)C(C)CC Amb24363076 [0,1,0,0,0,0|2,0,0]=3 1123 B13R1.21 Cc1ccc(cc1)C(C)C(=O)NC Amb24440896 [0,1,0,0,0,0|2,0,1]=4 1124 B13R1.21 Cc1ccc(cc1)C(C)C(C)CN Amb18195748 [0,1,0,0,0,0|3,0,0]=4 1125 B13R1.21 Cc1ccc(cc1)C(C)C(C)CO Amb25846204 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.21 Cc1ccc(cc1)C(C)C(C)NC Amb25239920 [0,1,0,0,0,0|1,0,0]=2 1127 B13R1.21 Cc1ccc(cc1)C(C)C(Cl)CC Amb25830099 [0,1,0,0,0,0|3,0,0]=4 1128 B13R1.21 Cc1ccc(cc1)C(C)C(N)CC Amb18195746 [0,1,0,0,0,0|3,0,0]=4 1129 B13R1.21 Cc1ccc(cc1)C(C)C(O)CC Amb24759809 [0,1,0,0,0,0|3,0,0]=4 1130 B13R1.21 Cc1ccc(cc1)C(C)N(C)CC Amb24473662 [0,1,0,0,0,0|3,0,0]=4 1131 B13R1.21 Cc1ccc(cc1)C(Cl)C(=O)NC Amb18330996 [0,1,0,0,0,0|2,0,1]=4 1132 B13R1.21 Cc1ccc(cc1)C(Cl)C(C)CC Amb24412425 [0,1,0,0,0,0|2,0,0]=3 1133 B13R1.21 Cc1ccc(cc1)C(F)C(C)CN Amb25683862 [0,1,0,0,0,0|3,0,0]=4 1134 B13R1.21 Cc1ccc(cc1)C(N)C(C)SC Amb25039654 [0,1,0,0,0,0|2,0,0]=3 1135 B13R1.21 Cc1ccc(cc1)C(O)C(=O)NO Amb24353143 [0,1,0,0,0,0|2,0,1]=4 1136 B13R1.21 Cc1ccc(cc1)C(O)C(=O)OC Amb18809303 [0,1,0,0,0,0|2,0,1]=4 1137 B13R1.21 Cc1ccc(cc1)C(O)C(C)=C=C Amb25753146 [0,1,0,0,0,0|1,0,2]=4 1138 B13R1.21 Cc1ccc(cc1)C(O)C(C)C#C Amb25686288 [0,1,0,0,0,0|1,0,1]=3 1139 B13R1.21 Cc1ccc(cc1)C(O)C(C)C#N Amb25770980 [0,1,0,0,0,0|2,0,0]=3 1140 B13R1.21 Cc1ccc(cc1)C(O)C(C)C=C Amb24544069 [0,1,0,0,0,0|1,0,1]=3 1141 B13R1.21 Cc1ccc(cc1)C(O)C(C)C=O Amb24633576 [0,1,0,0,0,0|2,0,0]=3 1142 B13R1.21 Cc1ccc(cc1)C(O)C(C)CC Amb18796057 [0,1,0,0,0,0|1,0,0]=2 1143 B13R1.21 Cc1ccc(cc1)C(O)C(C)CN Amb18194406 [0,1,0,0,0,0|2,0,0]=3 1144 B13R1.21 Cc1ccc(cc1)C(O)C(C)CO Amb25107653 [0,1,0,0,0,0|2,0,0]=3 1145 B13R1.21 Cc1ccc(cc1)C(O)C(C)NC Amb18065867 [0,1,0,0,0,0|0,0,0]=1 1146 B13R1.21 Cc1ccc(cc1)C(O)C(C)OC Amb18809339 [0,1,0,0,0,0|1,0,0]=2 1147 B13R1.21 Cc1ccc(cc1)C(O)C(Cl)C#N Amb25274069 [0,1,0,0,0,0|3,0,0]=4 1148 B13R1.21 Cc1ccc(cc1)C(O)C(N)CO Amb24458961 [0,1,0,0,0,0|3,0,0]=4 1149 B13R1.21 Cc1ccc(cc1)C(O)C(O)C=C Amb25306574 [0,1,0,0,0,0|2,0,1]=4 1150 B13R1.21 Cc1ccc(cc1)N(C)C(C)CC Amb24502946 [0,1,0,0,0,0|3,0,0]=4 1151 B13R1.21 Cc1ccc(cc1)[C@@H](N)C(C)CC Amb24604868 [0,1,0,0,0,0|2,0,0]=3 1152 B13R1.21 Cc1ccc(cc1)[C@@H](O)[C@H](Cl)C=C Amb25101598 [0,1,0,0,0,0|2,0,1]=4 1153 B13R1.21 Cc1ccc(cc1)[C@H](O)C(=O)OC Amb24403147 [0,1,0,0,0,0|2,0,1]=4 1154 B13R1.21 Cc1ccc(cc1)[C@H](O)C(C)=C=C Amb24495720 [0,1,0,0,0,0|1,0,2]=4 1155 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@@H](C)C=C Amb25037121 [0,1,0,0,0,0|1,0,1]=3 1156 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@@H](Cl)C=C Amb24443038 [0,1,0,0,0,0|2,0,1]=4 1157 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@@H](N)CO Amb25060659 [0,1,0,0,0,0|3,0,0]=4 1158 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@@H](O)C=C Amb25344956 [0,1,0,0,0,0|2,0,1]=4 1159 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@@H](O)CC Amb25725424 [0,1,0,0,0,0|2,0,0]=3 1160 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@H](C)C=O Amb24444898 [0,1,0,0,0,0|2,0,0]=3 1161 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@H](C)CO Amb24458592 [0,1,0,0,0,0|2,0,0]=3 1162 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@H](C)NC Amb24677754 [0,1,0,0,0,0|0,0,0]=1 1163 B13R1.21 Cc1ccc(cc1)[C@H](O)[C@H](N)CC Amb24346984 [0,1,0,0,0,0|2,0,0]=3 1164 B13R1.21 N#CC(O)C(O)c1ccc(Cl)cc1 Amb24355155 [0,1,0,0,0,0|3,0,0]=4 1165 B13R1.21 N#C[C@@H](F)[C@@H](O)c1ccc(Cl)cc1 Amb25687841 [0,1,0,0,0,0|3,0,0]=4 1166 B13R1.21 N#C[C@@H](O)[C@@H](O)c1ccc(Cl)cc1 Amb25058567 [0,1,0,0,0,0|3,0,0]=4 1167 B13R1.21 N#C[C@H](F)[C@@H](O)c1ccc(Cl)cc1 Amb24431825 [0,1,0,0,0,0|3,0,0]=4 1168 B13R1.21 N=C(NO)C(O)c1ccc(Cl)cc1 Amb24351045 [0,1,0,0,0,0|2,0,1]=4 1169 B13R1.21 NC(CO)C(O)c1ccc(Br)cc1 Amb18717857 [0,1,0,0,0,0|3,0,0]=4 1170 B13R1.21 NC(CO)C(O)c1ccc(F)cc1 Amb18822544 [0,1,0,0,0,0|3,0,0]=4 1171 B13R1.21 NC(CO)C(O)c1ccc(O)cc1 Amb18192133 [0,1,0,0,0,0|3,0,0]=4 1172 B13R1.21 NCC(O)C(O)c1ccc(F)cc1 Amb24434696 [0,1,0,0,0,0|3,0,0]=4 1173 B13R1.21 NNC(=O)C(O)c1ccc(F)cc1 Amb24428150 [0,1,0,0,0,0|2,0,1]=4 1174 B13R1.21 N[C@@H](CF)[C@@H](O)c1ccc(I)cc1 Amb22747363 [0,1,0,0,0,0|3,0,0]=4 1175 B13R1.21 N[C@@H](CO)[C@@H](O)c1ccc(Cl)cc1 Amb22751655 [0,1,0,0,0,0|3,0,0]=4 1176 B13R1.21 N[C@@H](CO)[C@@H](O)c1ccc(F)cc1 Amb25774117 [0,1,0,0,0,0|3,0,0]=4 1177 B13R1.21 N[C@@H](CO)[C@@H](O)c1ccc(O)cc1 Amb25760720 [0,1,0,0,0,0|3,0,0]=4 1178 B13R1.21 N[C@H](CF)C(O)c1ccc(I)cc1 Amb25377131 [0,1,0,0,0,0|3,0,0]=4 1179 B13R1.21 N[C@H](CO)[C@H](O)c1ccc(Cl)cc1 Amb25119207 [0,1,0,0,0,0|3,0,0]=4 1180 B13R1.21 N[C@H](CO)[C@H](O)c1ccc(I)cc1 Amb22504553 [0,1,0,0,0,0|3,0,0]=4 1181 B13R1.21 N[C@H](CO)[C@H](O)c1ccc(O)cc1 Amb24558383 [0,1,0,0,0,0|3,0,0]=4 1182 B13R1.21 Nc1ccc(cc1)C(O)[C@@H](N)CO Amb25847887 [0,1,0,0,0,0|3,0,0]=4 1183 B13R1.21 Nc1ccc(cc1)C(O)[C@H](N)CO Amb25369447 [0,1,0,0,0,0|3,0,0]=4 1184 B13R1.21 Nc1ccc(cc1)[C@@H](O)[C@H](N)CO Amb22503784 [0,1,0,0,0,0|3,0,0]=4 1185 B13R1.21 Nc1ccc(cc1)[C@@H](O)[C@H](N)CO Amb22757757 [0,1,0,0,0,0|3,0,0]=4 1186 B13R1.21 OCC(C(c1ccc(cc1)N)O)O Amb1058853 [0,1,0,0,0,0|3,0,0]=4 1187 B13R1.22 CC(C#N)C(O)c1cc(Cl)ccc1 Amb24734453 [0,1,0,0,0,0|2,0,0]=3 1188 B13R1.22 CC(C(Br)CC)c1cc(F)ccc1 Amb25191908 [0,1,0,0,0,0|3,0,0]=4 1189 B13R1.22 CC(C(Cl)CC)c1cc(Br)ccc1 Amb25670385 [0,1,0,0,0,0|3,0,0]=4 1190 B13R1.22 CC(C(Cl)CC)c1cc(Cl)ccc1 Amb25302707 [0,1,0,0,0,0|3,0,0]=4 1191 B13R1.22 CC(C(Cl)CC)c1cc(F)ccc1 Amb24411264 [0,1,0,0,0,0|3,0,0]=4 1192 B13R1.22 CC(C(N)CC)c1cc(Br)ccc1 Amb18156155 [0,1,0,0,0,0|3,0,0]=4 1193 B13R1.22 CC(C(N)CC)c1cc(Cl)ccc1 Amb18812026 [0,1,0,0,0,0|3,0,0]=4 1194 B13R1.22 CC(C=C)C(O)c1cc(O)ccc1 Amb24492753 [0,1,0,0,0,0|1,0,1]=3 1195 B13R1.22 CC(CC)C(Cl)c1c[n]cc(F)c1 Amb25820136 [0,1,0,0,0,0|3,0,0]=4 1196 B13R1.22 CC(CC)C(Cl)c1cccc(F)c1 Amb24413095 [0,1,0,0,0,0|2,0,0]=3 1197 B13R1.22 CC(CC)C(N)c1c[n]cc(Br)c1 Amb25821615 [0,1,0,0,0,0|3,0,0]=4 1198 B13R1.22 CC(CC)C(N)c1c[n]cc(Cl)c1 Amb24651847 [0,1,0,0,0,0|3,0,0]=4 1199 B13R1.22 CC(CC)C(N)c1cccc(Cl)c1 Amb25280336 [0,1,0,0,0,0|2,0,0]=3 1200 B13R1.22 CC(CC)C(N)c1cccc(I)c1 Amb24459640 [0,1,0,0,0,0|2,0,0]=3 1201 B13R1.22 CC(CC)C(O)c1c[n]cc(F)c1 Amb25195254 [0,1,0,0,0,0|2,0,0]=3 1202 B13R1.22 CC(CC)C(O)c1cc[n]c(Cl)c1 Amb25786869 [0,1,0,0,0,0|2,0,0]=3 1203 B13R1.22 CC(CC)C(O)c1cccc(I)c1 Amb25763175 [0,1,0,0,0,0|1,0,0]=2 1204 B13R1.22 CC(CC)C(O)c1cccc(N)c1 Amb25083585 [0,1,0,0,0,0|1,0,0]=2 1205 B13R1.22 CC(CC)[C@@H](N)c1cccc(Cl)c1 Amb25264908 [0,1,0,0,0,0|2,0,0]=3 1206 B13R1.22 CC(CC)[C@H](N)c1cc[n]c(Br)c1 Amb25227946 [0,1,0,0,0,0|3,0,0]=4 1207 B13R1.22 CC(CC)[C@H](N)c1cccc(Br)c1 Amb24694438 [0,1,0,0,0,0|2,0,0]=3 1208 B13R1.22 CC(CC)[C@H](N)c1cccc(Cl)c1 Amb24565914 [0,1,0,0,0,0|2,0,0]=3 1209 B13R1.22 CC(CC)[C@H](N)c1cccc(I)c1 Amb24550215 [0,1,0,0,0,0|2,0,0]=3 1210 B13R1.22 CC(CN)C(C)c1cccc(Cl)c1 Amb25101190 [0,1,0,0,0,0|3,0,0]=4 1211 B13R1.22 CC(CN)C(C)c1cccc(F)c1 Amb25117804 [0,1,0,0,0,0|3,0,0]=4 1212 B13R1.22 CC(CN)C(F)c1cc(Cl)ccc1 Amb24385664 [0,1,0,0,0,0|3,0,0]=4 1213 B13R1.22 CC(CN)C(O)c1cc(Br)ccc1 Amb24685665 [0,1,0,0,0,0|2,0,0]=3 1214 B13R1.22 CC(CN)C(O)c1cc(F)ccc1 Amb25333845 [0,1,0,0,0,0|2,0,0]=3 1215 B13R1.22 CC(CN)C(O)c1cc(I)ccc1 Amb24452359 [0,1,0,0,0,0|2,0,0]=3 1216 B13R1.22 CC(CO)C(N)c1cc(Cl)ccc1 Amb24489956 [0,1,0,0,0,0|3,0,0]=4 1217 B13R1.22 CC(CO)C(N)c1cc(F)ccc1 Amb25677925 [0,1,0,0,0,0|3,0,0]=4 1218 B13R1.22 CC(NC)C(C)c1cccc(F)c1 Amb24695040 [0,1,0,0,0,0|1,0,0]=2 1219 B13R1.22 CC(NC)C(O)c1cccc(N)c1 Amb24663100 [0,1,0,0,0,0|0,0,0]=1 1220 B13R1.22 CCC(C)C(=O)c1cccc(F)c1 Amb25244389 [0,1,0,0,0,0|1,0,2]=4 1221 B13R1.22 CCC(N)C(N)c1cccc(Br)c1 Amb24699715 [0,1,0,0,0,0|3,0,0]=4 1222 B13R1.22 CCC(N)C(O)c1cc(Cl)[n]cc1 Amb24744704 [0,1,0,0,0,0|3,0,0]=4 1223 B13R1.22 CCC(N)C(O)c1cc(Cl)c[n]c1 Amb25349557 [0,1,0,0,0,0|3,0,0]=4 1224 B13R1.22 CCC(N)C(O)c1cc(I)ccc1 Amb25037244 [0,1,0,0,0,0|2,0,0]=3 1225 B13R1.22 CCC(N)C(O)c1cccc(Cl)[n]1 Amb25252176 [0,1,0,0,0,0|3,0,0]=4 1226 B13R1.22 CCC(N)C(O)c1cccc(F)[n]1 Amb24699716 [0,1,0,0,0,0|3,0,0]=4 1227 B13R1.22 CCC(N)C(O)c1cccc(N)[n]1 Amb24699718 [0,1,0,0,0,0|3,0,0]=4 1228 B13R1.22 CCC(O)C(N)c1cccc(Br)c1 Amb25356130 [0,1,0,0,0,0|3,0,0]=4 1229 B13R1.22 CCC(O)C(N)c1cccc(Cl)c1 Amb24576898 [0,1,0,0,0,0|3,0,0]=4 1230 B13R1.22 CCC(O)C(N)c1cccc(I)c1 Amb25686209 [0,1,0,0,0,0|3,0,0]=4 1231 B13R1.22 CCC(O)C(N)c1cccc(O)c1 Amb25072474 [0,1,0,0,0,0|3,0,0]=4 1232 B13R1.22 CCC(O)C(O)c1cccc(Cl)c1 Amb25090781 [0,1,0,0,0,0|2,0,0]=3 1233 B13R1.22 CCC(O)C(O)c1cccc(F)c1 Amb24344685 [0,1,0,0,0,0|2,0,0]=3 1234 B13R1.22 CC[C@@H](N)[C@@H](O)c1cc(Cl)[n]cc1 Amb25200224 [0,1,0,0,0,0|3,0,0]=4 1235 B13R1.22 CC[C@@H](N)[C@@H](O)c1cc(Cl)c[n]c1 Amb24741323 [0,1,0,0,0,0|3,0,0]=4 1236 B13R1.22 CC[C@@H](N)[C@@H](O)c1cc(N)ccc1 Amb24678304 [0,1,0,0,0,0|2,0,0]=3 1237 B13R1.22 CC[C@@H](N)[C@@H](O)c1cccc(N)[n]1 Amb25238466 [0,1,0,0,0,0|3,0,0]=4 1238 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(Br)ccc1 Amb24542963 [0,1,0,0,0,0|2,0,0]=3 1239 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(Cl)[n]cc1 Amb25294349 [0,1,0,0,0,0|3,0,0]=4 1240 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(F)c[n]c1 Amb24562401 [0,1,0,0,0,0|3,0,0]=4 1241 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(N)c[n]c1 Amb24542797 [0,1,0,0,0,0|3,0,0]=4 1242 B13R1.22 CC[C@@H](N)[C@H](O)c1cc(O)ccc1 Amb25327896 [0,1,0,0,0,0|2,0,0]=3 1243 B13R1.22 CC[C@@H](N)[C@H](O)c1cccc(Cl)[n]1 Amb25269655 [0,1,0,0,0,0|3,0,0]=4 1244 B13R1.22 CC[C@@H](O)[C@@H](N)c1cccc(O)c1 Amb24397000 [0,1,0,0,0,0|3,0,0]=4 1245 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(Br)c1 Amb25269654 [0,1,0,0,0,0|3,0,0]=4 1246 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(Cl)c1 Amb25258552 [0,1,0,0,0,0|3,0,0]=4 1247 B13R1.22 CC[C@H](N)[C@@H](N)c1cccc(I)c1 Amb24542639 [0,1,0,0,0,0|3,0,0]=4 1248 B13R1.22 CC[C@H](N)[C@@H](O)c1cc(F)ccc1 Amb25200286 [0,1,0,0,0,0|2,0,0]=3 1249 B13R1.22 CC[C@H](N)[C@@H](O)c1cc(N)cc[n]1 Amb25275543 [0,1,0,0,0,0|3,0,0]=4 1250 B13R1.22 CC[C@H](N)[C@@H](O)c1cc(O)c[n]c1 Amb25222697 [0,1,0,0,0,0|3,0,0]=4 1251 B13R1.22 CC[C@H](N)[C@@H](O)c1cc(O)ccc1 Amb24610155 [0,1,0,0,0,0|2,0,0]=3 1252 B13R1.22 CC[C@H](N)[C@@H](O)c1cccc(F)[n]1 Amb25366493 [0,1,0,0,0,0|3,0,0]=4 1253 B13R1.22 CC[C@H](N)[C@H](O)c1cc(Br)ccc1 Amb24542747 [0,1,0,0,0,0|2,0,0]=3 1254 B13R1.22 CC[C@H](N)[C@H](O)c1cc(Cl)[n]cc1 Amb24598923 [0,1,0,0,0,0|3,0,0]=4 1255 B13R1.22 CC[C@H](N)[C@H](O)c1cc(N)cc[n]1 Amb24542601 [0,1,0,0,0,0|3,0,0]=4 1256 B13R1.22 CC[C@H](N)[C@H](O)c1cc(O)c[n]c1 Amb25255487 [0,1,0,0,0,0|3,0,0]=4 1257 B13R1.22 CC[C@H](N)[C@H](O)c1cc(O)ccc1 Amb25258553 [0,1,0,0,0,0|2,0,0]=3 1258 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(Cl)[n]1 Amb25200293 [0,1,0,0,0,0|3,0,0]=4 1259 B13R1.22 CC[C@H](N)[C@H](O)c1cccc(F)[n]1 Amb24656071 [0,1,0,0,0,0|3,0,0]=4 1260 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(I)c1 Amb25180113 [0,1,0,0,0,0|3,0,0]=4 1261 B13R1.22 CC[C@H](O)[C@H](N)c1cccc(O)c1 Amb25848499 [0,1,0,0,0,0|3,0,0]=4 1262 B13R1.22 CN(C(C)CC)c1cccc(O)c1 Amb25057287 [0,1,0,0,0,0|3,0,0]=4 1263 B13R1.22 CN(CC)C(C)c1cccc(F)c1 Amb25802681 [0,1,0,0,0,0|3,0,0]=4 1264 B13R1.22 CN(CC)C(C)c1cccc(N)c1 Amb18973982 [0,1,0,0,0,0|3,0,0]=4 1265 B13R1.22 CN(OC)C(C)c1cccc(N)c1 Amb18973985 [0,1,0,0,0,0|3,0,0]=4 1266 B13R1.22 CNC(=O)C(C)c1cccc(Cl)c1 Amb25804173 [0,1,0,0,0,0|2,0,1]=4 1267 B13R1.22 CNC(=O)C(C)c1cccc(N)c1 Amb25071108 [0,1,0,0,0,0|2,0,1]=4 1268 B13R1.22 CNC(=O)C(Cl)c1cccc(I)c1 Amb24693230 [0,1,0,0,0,0|2,0,1]=4 1269 B13R1.22 CNC(=O)C(N)c1cccc(Cl)c1 Amb25833191 [0,1,0,0,0,0|2,0,1]=4 1270 B13R1.22 CNC(=O)C(N)c1cccc(F)c1 Amb24459874 [0,1,0,0,0,0|2,0,1]=4 1271 B13R1.22 CNC(=O)C(O)c1cccc(Br)c1 Amb24704267 [0,1,0,0,0,0|1,0,1]=3 1272 B13R1.22 CNC(=O)C(O)c1cccc(F)c1 Amb24439436 [0,1,0,0,0,0|1,0,1]=3 1273 B13R1.22 CNC(=O)[C@@H](N)c1cccc(F)c1 Amb25287035 [0,1,0,0,0,0|2,0,1]=4 1274 B13R1.22 CNC(C(=O)c1cccc(c1)C)C Amb17617552 [0,1,0,0,0,0|0,0,2]=3 1275 B13R1.22 CNC(C)C(=O)c1cccc(Cl)c1 Amb19889606 [0,1,0,0,0,0|0,0,2]=3 1276 B13R1.22 CNC(C)C(=O)c1cccc(F)c1 Amb22055294 [0,1,0,0,0,0|0,0,2]=3 1277 B13R1.22 COC(=N)C(O)c1cccc(F)c1 Amb25256617 [0,1,0,0,0,0|2,0,1]=4 1278 B13R1.22 COC(=O)C(O)c1cc(O)ccc1 Amb18187057 [0,1,0,0,0,0|2,0,1]=4 1279 B13R1.22 COC(=O)C(O)c1cccc(Br)c1 Amb23596560 [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(I)c1 Amb24410672 [0,1,0,0,0,0|2,0,1]=4 1283 B13R1.22 COC(=O)C(O)c1cccc(N)c1 Amb24092718 [0,1,0,0,0,0|2,0,1]=4 1284 B13R1.22 COC(=O)[C@@H](O)c1cccc(Cl)c1 Amb22746478 [0,1,0,0,0,0|2,0,1]=4 1285 B13R1.22 COC(=O)[C@@H](O)c1cccc(F)c1 Amb25343345 [0,1,0,0,0,0|2,0,1]=4 1286 B13R1.22 COC(=O)[C@H](O)c1cccc(F)c1 Amb24534589 [0,1,0,0,0,0|2,0,1]=4 1287 B13R1.22 CSC(C)C(=O)c1cccc(Cl)c1 Amb25110469 [0,1,0,0,0,0|1,0,2]=4 1288 B13R1.22 C[C@@H](C=O)[C@@H](O)c1cc(Cl)ccc1 Amb25725476 [0,1,0,0,0,0|2,0,0]=3 1289 B13R1.22 C[C@@H](CO)[C@@H](O)c1cc(F)ccc1 Amb25215325 [0,1,0,0,0,0|2,0,0]=3 1290 B13R1.22 C[C@@H](NC)[C@@H](O)c1cccc(F)c1 Amb25258576 [0,1,0,0,0,0|0,0,0]=1 1291 B13R1.22 C[C@@H](NC)[C@@H](O)c1cccc(N)c1 Amb24739849 [0,1,0,0,0,0|0,0,0]=1 1292 B13R1.22 C[C@H](C=O)[C@@H](O)c1cc(Cl)ccc1 Amb24448095 [0,1,0,0,0,0|2,0,0]=3 1293 B13R1.22 C[C@H](NC)[C@H](O)c1cc(O)ccc1 Amb24697532 [0,1,0,0,0,0|0,0,0]=1 1294 B13R1.22 C\C(=C\C)\C(O)c1cccc(F)c1 Amb25333516 [0,1,0,0,0,0|1,0,1]=3 1295 B13R1.22 C\C(=N\O)\C(O)c1cc(O)ccc1 Amb25179793 [0,1,0,0,0,0|1,0,2]=4 1296 B13R1.22 Cc1[n]c(cc[n]1)C(O)C(C)CC Amb25190413 [0,1,0,0,0,0|3,0,0]=4 1297 B13R1.22 Cc1c[n]cc(c1)C(O)C(C)CN Amb25854684 [0,1,0,0,0,0|3,0,0]=4 1298 B13R1.22 Cc1c[n]cc(c1)C(O)C(C)OC Amb25848960 [0,1,0,0,0,0|2,0,0]=3 1299 B13R1.22 Cc1c[n]cc(c1)C(O)C(O)CC Amb24442464 [0,1,0,0,0,0|3,0,0]=4 1300 B13R1.22 Cc1cc(cc[n]1)C(N)C(C)CC Amb24619007 [0,1,0,0,0,0|3,0,0]=4 1301 B13R1.22 Cc1cc(cc[n]1)C(O)C(N)CC Amb18193583 [0,1,0,0,0,0|3,0,0]=4 1302 B13R1.22 Cc1cc(cc[n]1)[C@@H](O)[C@H](N)CC Amb25276573 [0,1,0,0,0,0|3,0,0]=4 1303 B13R1.22 Cc1cc(ccc1)C(Cl)C(=O)NC Amb19083266 [0,1,0,0,0,0|2,0,1]=4 1304 B13R1.22 Cc1cc(ccc1)C(O)C(=O)NC Amb25695140 [0,1,0,0,0,0|1,0,1]=3 1305 B13R1.22 Cc1cc(ccc1)C(O)C(=O)OC Amb18186544 [0,1,0,0,0,0|2,0,1]=4 1306 B13R1.22 Cc1cc(ccc1)[C@@H](O)C(=O)OC Amb24533614 [0,1,0,0,0,0|2,0,1]=4 1307 B13R1.22 Cc1cc(ccc1)[C@H](O)C(=O)OC Amb25065474 [0,1,0,0,0,0|2,0,1]=4 1308 B13R1.22 Cc1cc(ccc1)[C@H](O)[C@@H](N)CC Amb24559269 [0,1,0,0,0,0|2,0,0]=3 1309 B13R1.22 Cc1cc(ccc1)[C@H](O)[C@H](N)CC Amb25366508 [0,1,0,0,0,0|2,0,0]=3 1310 B13R1.22 Cc1cc[n]c(c1)C(O)C(N)CC Amb25252231 [0,1,0,0,0,0|3,0,0]=4 1311 B13R1.22 Cc1cc[n]c(c1)[C@@H](O)[C@@H](N)CC Amb24595590 [0,1,0,0,0,0|3,0,0]=4 1312 B13R1.22 Cc1cccc([n]1)C(N)C(C)CC Amb25743827 [0,1,0,0,0,0|3,0,0]=4 1313 B13R1.22 Cc1cccc([n]1)C(O)C(C)CC Amb24419115 [0,1,0,0,0,0|2,0,0]=3 1314 B13R1.22 Cc1cccc([n]1)C(O)C(N)CC Amb24587335 [0,1,0,0,0,0|3,0,0]=4 1315 B13R1.22 Cc1cccc([n]1)[C@@H](O)[C@@H](N)CC Amb25200298 [0,1,0,0,0,0|3,0,0]=4 1316 B13R1.22 Cc1cccc([n]1)[C@@H](O)[C@H](N)CC Amb24610205 [0,1,0,0,0,0|3,0,0]=4 1317 B13R1.22 Cc1cccc(c1)C(C)C(Cl)CC Amb25131795 [0,1,0,0,0,0|3,0,0]=4 1318 B13R1.22 Cc1cccc(c1)C(C)C(N)CC Amb18195745 [0,1,0,0,0,0|3,0,0]=4 1319 B13R1.22 Cc1cccc(c1)C(F)C(C)CN Amb25850612 [0,1,0,0,0,0|3,0,0]=4 1320 B13R1.22 Cc1cccc(c1)C(N)C(C)CC Amb25696275 [0,1,0,0,0,0|2,0,0]=3 1321 B13R1.22 Cc1cccc(c1)C(N)C(N)CC Amb24548687 [0,1,0,0,0,0|3,0,0]=4 1322 B13R1.22 Cc1cccc(c1)C(O)C(C)CN Amb25189856 [0,1,0,0,0,0|2,0,0]=3 1323 B13R1.22 Cc1cccc(c1)C(O)C(C)OC Amb24413096 [0,1,0,0,0,0|1,0,0]=2 1324 B13R1.22 Cc1cccc(c1)[C@H](N)C(C)CC Amb24747056 [0,1,0,0,0,0|2,0,0]=3 1325 B13R1.22 Cc1cccc(c1)[C@H](N)[C@@H](N)CC Amb25202150 [0,1,0,0,0,0|3,0,0]=4 1326 B13R1.22 NC(CO)C(O)c1cc(Cl)ccc1 Amb24388893 [0,1,0,0,0,0|3,0,0]=4 1327 B13R1.22 NC(CO)C(O)c1cc(F)ccc1 Amb25180788 [0,1,0,0,0,0|3,0,0]=4 1328 B13R1.22 NC(CO)C(O)c1cc(I)ccc1 Amb25362724 [0,1,0,0,0,0|3,0,0]=4 1329 B13R1.47 C#CCC(N)C(O)c1ccccc1 Amb24568974 [0,1,0,0,0,0|2,0,1]=4 1330 B13R1.47 C#CC[C@@H](N)[C@@H](O)c1ccccc1 Amb25113992 [0,1,0,0,0,0|2,0,1]=4 1331 B13R1.47 CC#C[C@H](O)[C@@H](O)c1ccccc1 Amb24362838 [0,1,0,0,0,0|2,0,0]=3 1332 B13R1.47 CC(C#CC)C(O)c1ccccc1 Amb25065527 [0,1,0,0,0,0|1,0,0]=2 1333 B13R1.47 CC(C(O)C#CC)c1ccccc1 Amb25769327 [0,1,0,0,0,0|3,0,0]=4 1334 B13R1.47 CC(C(O)\C=C\C)c1ccccc1 Amb24495615 [0,1,0,0,0,0|3,0,0]=4 1335 B13R1.47 CC(CCN)C(O)c1ccccc1 Amb18194408 [0,1,0,0,0,0|1,0,0]=2 1336 B13R1.47 CC(N=C=S)C(Cl)c1ccccc1 Amb24490273 [0,1,0,0,0,0|1,0,2]=4 1337 B13R1.47 CC(N=[N+]=[N-])C(O)c1ccccc1 Amb25255426 [0,1,0,0,0,0|1,0,1]=3 1338 B13R1.47 CC(N=[N+]=[N-])[C@H](O)c1ccccc1 Amb24355964 [0,1,0,0,0,0|1,0,1]=3 1339 B13R1.47 CC(NC=O)C(=O)c1ccccc1 Amb24520919 [0,1,0,0,0,0|0,0,3]=4 1340 B13R1.47 CC(\N=C\O)C(O)c1ccccc1 Amb24615424 [0,1,0,0,0,0|0,0,2]=3 1341 B13R1.47 CC=C=C(C(c1ccccc1)O)C Amb17594415 [0,1,0,0,0,0|1,0,1]=3 1342 B13R1.47 CCNC(=O)C(Br)c1ccccc1 Amb24534740 [0,1,0,0,0,0|2,0,1]=4 1343 B13R1.47 CCNC(=O)C(C)c1ccccc1 Amb24490195 [0,1,0,0,0,0|2,0,1]=4 1344 B13R1.47 CCNC(=O)C(O)c1ccc[n]c1 Amb24347416 [0,1,0,0,0,0|2,0,1]=4 1345 B13R1.47 CCNC(=O)C(c1ccccc1)O Amb17400707 [0,1,0,0,0,0|1,0,1]=3 1346 B13R1.47 CCNC(=O)[C@@H](O)c1ccccc1 Amb24358180 [0,1,0,0,0,0|1,0,1]=3 1347 B13R1.47 CCNC(=O)[C@H](C)c1ccccc1 Amb25780108 [0,1,0,0,0,0|2,0,1]=4 1348 B13R1.47 CCNC(=O)[C@H](O)c1ccccc1 Amb24468904 [0,1,0,0,0,0|1,0,1]=3 1349 B13R1.47 CCNC(=O)[C@H](c1ccccc1)N Amb17233443 [0,1,0,0,0,0|2,0,1]=4 1350 B13R1.47 CCNC(C(=O)c1ccccc1)C Amb17613942 [0,1,0,0,0,0|0,0,2]=3 1351 B13R1.47 CN(CC#C)C(O)c1ccccc1 Amb24495560 [0,1,0,0,0,0|2,0,1]=4 1352 B13R1.47 CONC(=O)C(O)c1ccc[n]c1 Amb24618683 [0,1,0,0,0,0|2,0,1]=4 1353 B13R1.47 CONC(=O)C(O)c1ccccc1 Amb24739076 [0,1,0,0,0,0|1,0,1]=3 1354 B13R1.47 CONC(=O)[C@H](C)c1ccccc1 Amb24660692 [0,1,0,0,0,0|2,0,1]=4 1355 B13R1.47 CONC(=O)[C@H](O)c1ccccc1 Amb24335120 [0,1,0,0,0,0|1,0,1]=3 1356 B13R1.47 C[C@@H](C#CC)[C@H](O)c1ccccc1 Amb25098641 [0,1,0,0,0,0|1,0,0]=2 1357 B13R1.47 C[C@@H](C=C=C)[C@@H](O)c1ccccc1 Amb25357651 [0,1,0,0,0,0|1,0,1]=3 1358 B13R1.47 C[C@@H](C=C=C)[C@H](O)c1ccccc1 Amb25236529 [0,1,0,0,0,0|1,0,1]=3 1359 B13R1.47 C[C@@H](N=[N+]=[N-])[C@@H](F)c1ccccc1 Amb24490107 [0,1,0,0,0,0|2,0,1]=4 1360 B13R1.47 C[C@@H](N=[N+]=[N-])[C@@H](O)c1ccccc1 Amb24374020 [0,1,0,0,0,0|1,0,1]=3 1361 B13R1.47 C[C@@H](NC=O)C(=O)c1ccccc1 Amb25804799 [0,1,0,0,0,0|0,0,3]=4 1362 B13R1.47 C[C@@H](NC=O)[C@@H](O)c1ccccc1 Amb25784603 [0,1,0,0,0,0|0,0,1]=2 1363 B13R1.47 C[C@@H]([C@@H](O)C#CC)c1ccccc1 Amb25739829 [0,1,0,0,0,0|3,0,0]=4 1364 B13R1.47 C[C@@H]([C@H](O)C#CC)c1ccccc1 Amb25317528 [0,1,0,0,0,0|3,0,0]=4 1365 B13R1.47 C[C@@H](\C=C\C)[C@H](O)c1ccccc1 Amb24420791 [0,1,0,0,0,0|1,0,0]=2 1366 B13R1.47 C[C@H](C#CC)[C@@H](O)c1ccccc1 Amb24353039 [0,1,0,0,0,0|1,0,0]=2 1367 B13R1.47 C[C@H](CC#N)[C@@H](O)c1ccccc1 Amb25306456 [0,1,0,0,0,0|1,0,1]=3 1368 B13R1.47 C[C@H](N=[N+]=[N-])[C@H](F)c1ccccc1 Amb24490106 [0,1,0,0,0,0|2,0,1]=4 1369 B13R1.47 C[C@H](NC=O)[C@@H](O)c1ccccc1 Amb24366117 [0,1,0,0,0,0|0,0,1]=2 1370 B13R1.47 C[C@H]([C@@H](C)N=[N+]=[N-])c1ccccc1 Amb24490104 [0,1,0,0,0,0|2,0,1]=4 1371 B13R1.47 C[C@H]([C@@H](O)\C=C\C)c1ccccc1 Amb24412124 [0,1,0,0,0,0|3,0,0]=4 1372 B13R1.47 C[C@H]([C@H](C)N=[N+]=[N-])c1ccccc1 Amb25288317 [0,1,0,0,0,0|2,0,1]=4 1373 B13R1.47 C[C@H]([C@H](O)C#CC)c1ccccc1 Amb24495828 [0,1,0,0,0,0|3,0,0]=4 1374 B13R1.47 C[C@H](\C=C\C)[C@H](O)c1ccccc1 Amb25687816 [0,1,0,0,0,0|1,0,0]=2 1375 B13R1.47 C[C@H](\N=C\O)[C@H](O)c1ccccc1 Amb25769333 [0,1,0,0,0,0|0,0,2]=3 1376 B13R1.47 C\C(=C/CC)\C(O)c1ccccc1 Amb22546638 [0,1,0,0,0,0|1,0,1]=3 1377 B13R1.47 C\C(=C/CO)\C(O)c1ccccc1 Amb22547006 [0,1,0,0,0,0|1,0,1]=3 1378 B13R1.47 C\C(=C/NC)\C(=O)c1ccccc1 Amb25805124 [0,1,0,0,0,0|0,0,3]=4 1379 B13R1.47 C\C(=C\C=O)\C(O)c1ccccc1 Amb24698870 [0,1,0,0,0,0|1,0,2]=4 1380 B13R1.47 C\C(=C\CC)\C(O)c1cccc[n]1 Amb24733307 [0,1,0,0,0,0|2,0,1]=4 1381 B13R1.47 C\C(=C\CO)\C(O)c1ccccc1 Amb22547016 [0,1,0,0,0,0|1,0,1]=3 1382 B13R1.47 C\C(=C\NC)\C(=O)c1ccccc1 Amb25327890 [0,1,0,0,0,0|0,0,3]=4 1383 B13R1.47 C\C(=N\OC)\C(C)c1ccccc1 Amb25822107 [0,1,0,0,0,0|1,0,2]=4 1384 B13R1.47 C\C(=N\OC)\C(O)c1ccccc1 Amb24371301 [0,1,0,0,0,0|0,0,2]=3 1385 B13R1.47 C\C(=N\OC)\[C@H](O)c1ccccc1 Amb25788901 [0,1,0,0,0,0|0,0,2]=3 1386 B13R1.47 C\C=C/C(C)C(=O)c1ccccc1 Amb24448967 [0,1,0,0,0,0|1,0,2]=4 1387 B13R1.47 C\C=C\C(=O)C(O)c1ccccc1 Amb25179529 [0,1,0,0,0,0|2,0,1]=4 1388 B13R1.47 C\C=C\C(=O)[C@@H](O)c1ccccc1 Amb24577753 [0,1,0,0,0,0|2,0,1]=4 1389 B13R1.47 C\C=C\C(C)C(=O)c1ccccc1 Amb24492785 [0,1,0,0,0,0|1,0,2]=4 1390 B13R1.47 C\C=C\C(O)C(O)c1c[n]ccc1 Amb24748571 [0,1,0,0,0,0|3,0,0]=4 1391 B13R1.47 C\C=C\C(O)C(O)c1ccccc1 Amb25180187 [0,1,0,0,0,0|2,0,0]=3 1392 B13R1.47 C\C=C\[C@@H](O)C(N)c1ccccc1 Amb25835244 [0,1,0,0,0,0|3,0,0]=4 1393 B13R1.47 C\C=C\[C@@H](O)[C@@H](N)c1ccccc1 Amb24553109 [0,1,0,0,0,0|3,0,0]=4 1394 B13R1.47 C\C=C\[C@H](O)[C@@H](O)c1ccccc1 Amb24495294 [0,1,0,0,0,0|2,0,0]=3 1395 B13R1.47 ClCCN(C(c1ccccc1)C)C Amb17337267 [0,1,0,0,0,0|3,0,0]=4 1396 B13R1.47 N#CCC(C(c1ccccn1)O)C Amb17335129 [0,1,0,0,0,0|2,0,1]=4 1397 B13R1.47 N#CCC(C(c1cccnc1)O)C Amb17335131 [0,1,0,0,0,0|2,0,1]=4 1398 B13R1.47 N#CNC(=O)C(O)c1ccccc1 Amb24449276 [0,1,0,0,0,0|1,0,2]=4 1399 B13R1.47 NCCC(N(c1ccccc1)C)C Amb17138895 [0,1,0,0,0,0|3,0,0]=4 1400 B13R1.47 NCCN(C(c1ccccc1)C)C Amb17335265 [0,1,0,0,0,0|3,0,0]=4 1401 B13R1.47 OC(c1ccccc1)C(CC#N)C Amb17335051 [0,1,0,0,0,0|1,0,1]=3 1402 B13R1.47 OC(c1ccncc1)C(CC#N)C Amb17335133 [0,1,0,0,0,0|2,0,1]=4 1403 B13R1.47 OCCN(C(c1ccccc1)C)C Amb17335355 [0,1,0,0,0,0|3,0,0]=4 1404 B13R1.86 CC(C(C#N)NC)c1ccccc1 Amb18975499 [0,1,0,0,0,0|1,0,1]=3 1405 B13R1.86 CC(C(C#N)OC)c1ccccc1 Amb24534007 [0,1,0,0,0,0|2,0,1]=4 1406 B13R1.86 CC(C(OC)OC)c1ccccc1 Amb22336595 [0,1,0,0,0,0|2,0,0]=3 1407 B13R1.86 CCC(=C=C)C(O)c1ccccc1 Amb25806685 [0,1,0,0,0,0|1,0,2]=4 1408 B13R1.86 CCC(=C=C)[C@@H](O)c1ccccc1 Amb25058563 [0,1,0,0,0,0|1,0,2]=4 1409 B13R1.86 CCC(=C=C)[C@H](O)c1ccccc1 Amb24495402 [0,1,0,0,0,0|1,0,2]=4 1410 B13R1.86 CCC(C#N)C(O)c1ccccc1 Amb25083808 [0,1,0,0,0,0|1,0,1]=3 1411 B13R1.86 CCC(C(=O)c1ccccc1)NC Amb17621424 [0,1,0,0,0,0|0,0,2]=3 1412 B13R1.86 CCC(NC)C(O)c1ccccc1 Amb18604539 [0,1,0,0,0,0|0,0,0]=1 1413 B13R1.86 CC[C@@H](NC)[C@H](O)c1ccccc1 Amb19133210 [0,1,0,0,0,0|0,0,0]=1 1414 B13R1.86 CC[C@H](C#N)[C@@H](O)c1ccccc1 Amb25069704 [0,1,0,0,0,0|1,0,1]=3 1415 B13R1.86 CC\C(=N\O)\C(O)c1ccccc1 Amb25345110 [0,1,0,0,0,0|1,0,2]=4 1416 B13R1.86 CNC(C#N)C(O)c1ccccc1 Amb25752020 [0,1,0,0,0,0|0,0,1]=2 1417 B13R1.86 CNC(C#N)[C@H](O)c1ccccc1 Amb24558381 [0,1,0,0,0,0|0,0,1]=2 1418 B13R1.86 CN[C@@H](C#N)[C@@H](O)c1ccccc1 Amb24310254 [0,1,0,0,0,0|0,0,1]=2 1419 B13R1.86 CN\C(=N\N)\C(C)c1ccccc1 Amb24427117 [0,1,0,0,0,0|2,0,1]=4 1420 B13R1.86 COC(C(=O)c1ccccc1)OC Amb10559989 [0,1,0,0,0,0|1,0,2]=4 1421 B13R1.86 CSC(SC)C(=O)c1ccccc1 Amb22470038 [0,1,0,0,0,0|1,0,2]=4 1422 B13R1.86 C\C=C(\C=C)/C(O)c1ccccc1 Amb24576578 [0,1,0,0,0,0|1,0,2]=4 1423 B13R1.86 N#CC(CCl)C(O)c1ccccc1 Amb24490082 [0,1,0,0,0,0|2,0,0]=3 1424 B13R1.86 N#C[C@H](CCl)[C@@H](O)c1ccccc1 Amb25124135 [0,1,0,0,0,0|2,0,0]=3 1425 B13R1.86 N#C[C@H](CO)[C@@H](O)c1ccccc1 Amb25369387 [0,1,0,0,0,0|2,0,0]=3 1426 B13R1.152 CC(=C)C(=C)C(O)c1ccccc1 Amb25781853 [0,1,0,0,0,0|1,0,2]=4 1427 B13R1.152 CC(=C)C(=O)C(O)c1ccccc1 Amb25807562 [0,1,0,0,0,0|2,0,1]=4 1428 B13R1.152 CC(=C)C(C)C(=O)c1ccccc1 Amb24492636 [0,1,0,0,0,0|1,0,2]=4 1429 B13R1.152 CC(=C)C(C)C(O)c1ccccc1 Amb24495101 [0,1,0,0,0,0|1,0,0]=2 1430 B13R1.152 CC(=C)C(N)C(C)c1ccccc1 Amb25180112 [0,1,0,0,0,0|3,0,0]=4 1431 B13R1.152 CC(=C)[C@@H](O)[C@@H](C)c1ccccc1 Amb25092087 [0,1,0,0,0,0|3,0,0]=4 1432 B13R1.152 CC(=N)N(C)C(C)c1ccccc1 Amb25258088 [0,1,0,0,0,0|3,0,0]=4 1433 B13R1.152 CC(=O)C(=C)[C@@H](O)c1ccccc1 Amb24370174 [0,1,0,0,0,0|1,0,2]=4 1434 B13R1.152 CC(=O)C(C)C(=C)c1ccccc1 Amb24492728 [0,1,0,0,0,0|2,0,1]=4 1435 B13R1.152 CC(=O)C(C)C(C)c1ccccc1 Amb25087204 [0,1,0,0,0,0|2,0,0]=3 1436 B13R1.152 CC(=O)C(C)C(N)c1ccccc1 Amb25041504 [0,1,0,0,0,0|2,0,0]=3 1437 B13R1.152 CC(=O)C(C)C(O)c1c[n]ccc1 Amb25729242 [0,1,0,0,0,0|2,0,0]=3 1438 B13R1.152 CC(=O)C(C)N(O)c1ccccc1 Amb25838746 [0,1,0,0,0,0|2,0,0]=3 1439 B13R1.152 CC(=O)C(Cl)C(N)c1ccccc1 Amb25300345 [0,1,0,0,0,0|3,0,0]=4 1440 B13R1.152 CC(=O)C(N)C(O)c1ccccc1 Amb25066908 [0,1,0,0,0,0|2,0,0]=3 1441 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 Amb25731265 [0,1,0,0,0,0|3,0,0]=4 1442 B13R1.152 CC(=O)N(C)C(Cl)c1ccccc1 Amb25772765 [0,1,0,0,0,0|3,0,0]=4 1443 B13R1.152 CC(=O)[C@@H](C)C(=O)c1ccccc1 Amb25729157 [0,1,0,0,0,0|1,0,2]=4 1444 B13R1.152 CC(=O)[C@@H](C)[C@@H](C)c1ccccc1 Amb25086639 [0,1,0,0,0,0|2,0,0]=3 1445 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1cccc[n]1 Amb24432173 [0,1,0,0,0,0|2,0,0]=3 1446 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24467544 [0,1,0,0,0,0|1,0,0]=2 1447 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb25290208 [0,1,0,0,0,0|3,0,0]=4 1448 B13R1.152 CC(=O)[C@@H](O)[C@@H](O)c1ccccc1 Amb24704823 [0,1,0,0,0,0|2,0,0]=3 1449 B13R1.152 CC(=O)[C@H](C)[C@H](O)c1ccccc1 Amb24492637 [0,1,0,0,0,0|1,0,0]=2 1450 B13R1.152 CC(=O)[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb24574713 [0,1,0,0,0,0|3,0,0]=4 1451 B13R1.152 CC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb24652637 [0,1,0,0,0,0|2,0,0]=3 1452 B13R1.152 CC(=O)[C@H](O)[C@H](O)c1ccccc1 Amb24752230 [0,1,0,0,0,0|2,0,0]=3 1453 B13R1.152 CC(C(=O)c1ccccc1)C(Cl)C Amb17595208 [0,1,0,0,0,0|1,0,2]=4 1454 B13R1.152 CC(C(=O)c1ccccc1)N(C)C Amb17613282 [0,1,0,0,0,0|0,0,2]=3 1455 B13R1.152 CC(C(=O)c1ccccc1)S(C)=O Amb24468966 [0,1,0,0,0,0|1,0,2]=4 1456 B13R1.152 CC(C(C)N)C(=O)c1ccccc1 Amb25155668 [0,1,0,0,0,0|1,0,2]=4 1457 B13R1.152 CC(C(C)O)C(=O)c1ccccc1 Amb24645443 [0,1,0,0,0,0|1,0,2]=4 1458 B13R1.152 CC(C(C)O)S(=O)c1ccccc1 Amb24672634 [0,1,0,0,0,0|2,0,1]=4 1459 B13R1.152 CC(C(C)c1ccccc1)C(=O)Cl Amb25197974 [0,1,0,0,0,0|3,0,0]=4 1460 B13R1.152 CC(C(Cl)c1ccccc1)C(=O)Cl Amb24418080 [0,1,0,0,0,0|3,0,0]=4 1461 B13R1.152 CC(C(Cl)c1ccccc1)C(O)=O Amb18130574 [0,1,0,0,0,0|3,0,0]=4 1462 B13R1.152 CC(C(N)c1ccccc1)C(O)=O Amb19375481 [0,1,0,0,0,0|3,0,0]=4 1463 B13R1.152 CC(C(N)c1ccccc1)[N+]([O-])=O Amb22487244 [0,1,0,0,0,0|2,0,1]=4 1464 B13R1.152 CC(C(O)C(C)N)c1ccccc1 Amb25311051 [0,1,0,0,0,0|3,0,0]=4 1465 B13R1.152 CC(C(O)N(C)N)c1ccccc1 Amb25296272 [0,1,0,0,0,0|2,0,0]=3 1466 B13R1.152 CC(C(O)c1cc[n]cc1)N(C)C Amb24466284 [0,1,0,0,0,0|1,0,0]=2 1467 B13R1.152 CC(C(O)c1cc[n]cc1)[N+]([O-])=O Amb24084897 [0,1,0,0,0,0|2,0,1]=4 1468 B13R1.152 CC(C(O)c1ccccc1)N(C)C Amb22731613 [0,1,0,0,0,0|0,0,0]=1 1469 B13R1.152 CC(C(O)c1ccccc1)N(C)N Amb18648407 [0,1,0,0,0,0|0,0,0]=1 1470 B13R1.152 CC(C(O)c1ccccc1)N(F)F Amb24719791 [0,1,0,0,0,0|1,0,0]=2 1471 B13R1.152 CC(C)=C(C)C(O)c1ccccc1 Amb24495409 [0,1,0,0,0,0|1,0,1]=3 1472 B13R1.152 CC(C)C(=O)[C@H](O)c1ccccc1 Amb24690697 [0,1,0,0,0,0|2,0,1]=4 1473 B13R1.152 CC(C)C(=S)C(O)c1ccccc1 Amb25092034 [0,1,0,0,0,0|2,0,1]=4 1474 B13R1.152 CC(C)C(C)C(=O)c1ccccc1 Amb25100222 [0,1,0,0,0,0|1,0,2]=4 1475 B13R1.152 CC(C)C(C)C(Br)c1ccccc1 Amb25734752 [0,1,0,0,0,0|2,0,0]=3 1476 B13R1.152 CC(C)C(C)C(N)c1c[n]ccc1 Amb25191446 [0,1,0,0,0,0|3,0,0]=4 1477 B13R1.152 CC(C)C(C)C(N)c1cccc[n]1 Amb24501695 [0,1,0,0,0,0|3,0,0]=4 1478 B13R1.152 CC(C)C(C)C(O)c1[n]ccc[n]1 Amb25375095 [0,1,0,0,0,0|3,0,0]=4 1479 B13R1.152 CC(C)C(C)C(O)c1c[n]cc[n]1 Amb25159026 [0,1,0,0,0,0|3,0,0]=4 1480 B13R1.152 CC(C)C(C)C(O)c1cccc[n]1 Amb24501576 [0,1,0,0,0,0|2,0,0]=3 1481 B13R1.152 CC(C)C(C)C(O)c1ccccc1 Amb25252696 [0,1,0,0,0,0|1,0,0]=2 1482 B13R1.152 CC(C)C(N)C(C)c1ccccc1 Amb23536663 [0,1,0,0,0,0|3,0,0]=4 1483 B13R1.152 CC(C)C(N)C(F)c1ccccc1 Amb24459748 [0,1,0,0,0,0|3,0,0]=4 1484 B13R1.152 CC(C)C(N)C(O)c1cc[n]cc1 Amb18564136 [0,1,0,0,0,0|3,0,0]=4 1485 B13R1.152 CC(C)C(N)C(O)c1ccc[n]c1 Amb18065937 [0,1,0,0,0,0|3,0,0]=4 1486 B13R1.152 CC(C)C(N)C(O)c1cccc[n]1 Amb18564134 [0,1,0,0,0,0|3,0,0]=4 1487 B13R1.152 CC(C)C(O)C(C)c1ccccc1 Amb24704769 [0,1,0,0,0,0|3,0,0]=4 1488 B13R1.152 CC(C)[C@@H](C)[C@H](O)c1ccccc1 Amb25334712 [0,1,0,0,0,0|1,0,0]=2 1489 B13R1.152 CC(C)[C@@H](N)[C@@H](O)c1cc[n]cc1 Amb25222726 [0,1,0,0,0,0|3,0,0]=4 1490 B13R1.152 CC(C)[C@@H](N)[C@H](N)c1ccccc1 Amb24491912 [0,1,0,0,0,0|3,0,0]=4 1491 B13R1.152 CC(C)[C@@H](O)[C@@H](N)c1ccccc1 Amb25100965 [0,1,0,0,0,0|3,0,0]=4 1492 B13R1.152 CC(C)[C@H](C)C(=O)c1ccccc1 Amb24492540 [0,1,0,0,0,0|1,0,2]=4 1493 B13R1.152 CC(C)[C@H](N)[C@@H](N)c1ccccc1 Amb25142135 [0,1,0,0,0,0|3,0,0]=4 1494 B13R1.152 CC(C)[C@H](N)[C@@H](O)c1cc[n]cc1 Amb25200040 [0,1,0,0,0,0|3,0,0]=4 1495 B13R1.152 CC(C)[C@H](N)[C@@H](O)c1ccc[n]c1 Amb25291122 [0,1,0,0,0,0|3,0,0]=4 1496 B13R1.152 CC(C)[C@H](N)[C@H](O)c1cc[n]cc1 Amb24567923 [0,1,0,0,0,0|3,0,0]=4 1497 B13R1.152 CC(C)[C@H](O)[C@@H](C)c1ccccc1 Amb24495041 [0,1,0,0,0,0|3,0,0]=4 1498 B13R1.152 CC(C)[C@H](O)[C@H](N)c1ccccc1 Amb25132995 [0,1,0,0,0,0|3,0,0]=4 1499 B13R1.152 CC(Cl)C(Cl)C(O)c1ccccc1 Amb24587114 [0,1,0,0,0,0|2,0,0]=3 1500 B13R1.152 CC(Cl)C(O)C(O)c1ccccc1 Amb25798339 [0,1,0,0,0,0|2,0,0]=3 1501 B13R1.152 CC(N)C(N)C(O)c1ccccc1 Amb25189862 [0,1,0,0,0,0|2,0,0]=3 1502 B13R1.152 CC(O)C(C)C(C)c1ccccc1 Amb25332510 [0,1,0,0,0,0|2,0,0]=3 1503 B13R1.152 CC(O)C(C)C(O)c1ccccc1 Amb25741415 [0,1,0,0,0,0|1,0,0]=2 1504 B13R1.152 CC(O)C(N)C(O)c1ccccc1 Amb25276453 [0,1,0,0,0,0|2,0,0]=3 1505 B13R1.152 CC(O)C(O)C(N)c1ccccc1 Amb25264393 [0,1,0,0,0,0|3,0,0]=4 1506 B13R1.152 CC(O)[C@H](N)[C@@H](O)c1ccccc1 Amb24431996 [0,1,0,0,0,0|2,0,0]=3 1507 B13R1.152 CC(S(=O)c1ccccc1)C(=O)C Amb17595198 [0,1,0,0,0,0|2,0,1]=4 1508 B13R1.152 CC([C@H](C)O)C(=O)c1ccccc1 Amb25767065 [0,1,0,0,0,0|1,0,2]=4 1509 B13R1.152 CC([C@H](O)[C@H](C)N)c1ccccc1 Amb24697327 [0,1,0,0,0,0|3,0,0]=4 1510 B13R1.152 CC([C@H](O)c1ccccc1)C(O)=O Amb25258355 [0,1,0,0,0,0|2,0,0]=3 1511 B13R1.152 CN(C)C(=O)[C@@H](C)c1ccccc1 Amb25370071 [0,1,0,0,0,0|2,0,1]=4 1512 B13R1.152 CN(C)C(=O)[C@@H](N)c1ccccc1 Amb24056498 [0,1,0,0,0,0|2,0,1]=4 1513 B13R1.152 CN(C)C(=O)[C@@H](O)c1ccccc1 Amb25795435 [0,1,0,0,0,0|1,0,1]=3 1514 B13R1.152 CN(C)C(=O)[C@H](C)c1ccccc1 Amb25093411 [0,1,0,0,0,0|2,0,1]=4 1515 B13R1.152 CN(C)C(=O)[C@H](N)c1ccccc1 Amb25291302 [0,1,0,0,0,0|2,0,1]=4 1516 B13R1.152 CN(C)C(=S)C(Cl)c1ccccc1 Amb25733493 [0,1,0,0,0,0|2,0,1]=4 1517 B13R1.152 CN(C)C(=S)C(O)c1ccccc1 Amb24533590 [0,1,0,0,0,0|1,0,1]=3 1518 B13R1.152 CN(C)C(C)C(C)c1ccccc1 Amb24653657 [0,1,0,0,0,0|1,0,0]=2 1519 B13R1.152 CN(C)C(N)C(O)c1ccccc1 Amb25266702 [0,1,0,0,0,0|1,0,0]=2 1520 B13R1.152 CN(C)[C@@H](N)[C@H](O)c1ccccc1 Amb25769450 [0,1,0,0,0,0|1,0,0]=2 1521 B13R1.152 CN(C)[C@H](C)C(=O)c1ccccc1 Amb24690735 [0,1,0,0,0,0|0,0,2]=3 1522 B13R1.152 C[C@@H](C(N)c1ccccc1)[C@H](C)O Amb25374921 [0,1,0,0,0,0|2,0,0]=3 1523 B13R1.152 C[C@@H]([C@@H](C)c1ccccc1)C(N)=O Amb25765701 [0,1,0,0,0,0|3,0,0]=4 1524 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(N)=O Amb24590220 [0,1,0,0,0,0|3,0,0]=4 1525 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(O)=O Amb19929625 [0,1,0,0,0,0|3,0,0]=4 1526 B13R1.152 C[C@@H]([C@@H](O)[C@H](C)N)c1ccccc1 Amb25040764 [0,1,0,0,0,0|3,0,0]=4 1527 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)C(O)=O Amb24429060 [0,1,0,0,0,0|2,0,0]=3 1528 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)N(C)N Amb25320408 [0,1,0,0,0,0|0,0,0]=1 1529 B13R1.152 C[C@@H]([C@H](C)O)C(=O)c1ccccc1 Amb24686493 [0,1,0,0,0,0|1,0,2]=4 1530 B13R1.152 C[C@@H]([C@H](N)c1ccccc1)C(O)=O Amb19929623 [0,1,0,0,0,0|3,0,0]=4 1531 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)C(O)=O Amb25689703 [0,1,0,0,0,0|2,0,0]=3 1532 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)N(C)C Amb19133124 [0,1,0,0,0,0|0,0,0]=1 1533 B13R1.152 C[C@H](C(N)c1ccccc1)[C@H](C)O Amb24428937 [0,1,0,0,0,0|2,0,0]=3 1534 B13R1.152 C[C@H](O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24420803 [0,1,0,0,0,0|1,0,0]=2 1535 B13R1.152 C[C@H](O)[C@H](Br)[C@H](O)c1ccccc1 Amb25722160 [0,1,0,0,0,0|2,0,0]=3 1536 B13R1.152 C[C@H](O)[C@H](C)[C@H](O)c1ccccc1 Amb25058514 [0,1,0,0,0,0|1,0,0]=2 1537 B13R1.152 C[C@H]([C@@H](C(=O)O)C)c1ccccc1 Amb10844123 [0,1,0,0,0,0|3,0,0]=4 1538 B13R1.152 C[C@H]([C@@H](C)O)N(C)c1ccccc1 Amb24379882 [0,1,0,0,0,0|3,0,0]=4 1539 B13R1.152 C[C@H]([C@@H](C)O)S(=O)c1ccccc1 Amb24456968 [0,1,0,0,0,0|2,0,1]=4 1540 B13R1.152 C[C@H]([C@@H](N)c1ccccc1)C(O)=O Amb25111224 [0,1,0,0,0,0|3,0,0]=4 1541 B13R1.152 C[C@H]([C@@H](N)c1ccccc1)[C@@H](C)O Amb24366647 [0,1,0,0,0,0|2,0,0]=3 1542 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)C(N)=O Amb25708390 [0,1,0,0,0,0|2,0,0]=3 1543 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)N(C)N Amb25043845 [0,1,0,0,0,0|0,0,0]=1 1544 B13R1.152 C[C@H]([C@H](C)O)C(=O)c1ccccc1 Amb25050240 [0,1,0,0,0,0|1,0,2]=4 1545 B13R1.152 C[C@H]([C@H](C)O)S(=O)c1ccccc1 Amb25670538 [0,1,0,0,0,0|2,0,1]=4 1546 B13R1.152 C[C@H]([C@H](Cl)c1ccccc1)N(C)C Amb25347759 [0,1,0,0,0,0|1,0,0]=2 1547 B13R1.152 C[C@H]([C@H](N)c1ccccc1)C(O)=O Amb24552403 [0,1,0,0,0,0|3,0,0]=4 1548 B13R1.152 C\C(\F)=C(\F)/C(O)c1ccccc1 Amb25847030 [0,1,0,0,0,0|2,0,1]=4 1549 B13R1.152 ClC(C(=O)N(C)C)c1ccccc1 Amb1106097 [0,1,0,0,0,0|2,0,1]=4 1550 B13R1.152 NC(=O)C(Cl)C(O)c1ccccc1 Amb25772867 [0,1,0,0,0,0|3,0,0]=4 1551 B13R1.152 NC(=O)[C@@H](N)[C@@H](O)c1ccccc1 Amb25138644 [0,1,0,0,0,0|3,0,0]=4 1552 B13R1.152 NC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb25363147 [0,1,0,0,0,0|3,0,0]=4 1553 B13R1.152 NC(=O)[C@H](F)[C@@H](O)c1ccccc1 Amb24429111 [0,1,0,0,0,0|3,0,0]=4 1554 B13R1.152 NC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb24741670 [0,1,0,0,0,0|3,0,0]=4 1555 B13R1.152 NC(C(=O)N(C)C)c1ccccc1 Amb10609379 [0,1,0,0,0,0|2,0,1]=4 1556 B13R1.152 NC(C(C(=O)O)C)c1ccccc1 Amb17470593 [0,1,0,0,0,0|3,0,0]=4 1557 B13R1.152 NC(C(N(C)C)C)c1ccccc1 Amb1138452 [0,1,0,0,0,0|1,0,0]=2 1558 B13R1.152 NC([C@H](O)c1ccccc1)C(O)=O Amb25848582 [0,1,0,0,0,0|3,0,0]=4 1559 B13R1.152 N[C@@H]([C@@H](O)c1ccccc1)C(F)F Amb25137940 [0,1,0,0,0,0|3,0,0]=4 1560 B13R1.152 N[C@H](C(=O)N(C)C)c1ccccc1 Amb17233442 [0,1,0,0,0,0|2,0,1]=4 1561 B13R1.152 N[C@H]([C@@H](O)c1ccccc1)C(F)F Amb24647183 [0,1,0,0,0,0|3,0,0]=4 1562 B13R1.152 OC(=O)C(Cl)C(O)c1ccccc1 Amb25366171 [0,1,0,0,0,0|3,0,0]=4 1563 B13R1.152 OC(=O)[C@H](Cl)[C@H](O)c1ccccc1 Amb24640317 [0,1,0,0,0,0|3,0,0]=4 1564 B13R1.152 OC(C(=O)N(C)C)c1ccccc1 Amb17400708 [0,1,0,0,0,0|1,0,1]=3 1565 B13R1.152 OC(C(C(=O)C)C)c1ccccc1 Amb17594547 [0,1,0,0,0,0|1,0,0]=2 1566 B13R1.152 OC(C(C(=O)O)N)c1ccccc1 Amb2228459 [0,1,0,0,0,0|3,0,0]=4 1567 B13R1.152 OC(C(C(=O)[O-])N)c1ccccc1 Amb15772286 [0,1,0,0,0,0|3,0,0]=4 1568 B13R1.152 OC(C(N(C)C)C)c1ccccc1 Amb2099658 [0,1,0,0,0,0|0,0,0]=1 1569 B13R1.152 OC(c1ccccc1)C(C(C)C)N Amb17138913 [0,1,0,0,0,0|2,0,0]=3 1570 B13R1.152 O[C@@H]([C@@H]([NH+](C)C)C)c1ccccc1 Amb2388354 [0,1,0,0,0,0|0,0,1]=2 1571 B13R1.152 O[C@H]([C@@H](N(C)C)C)c1ccccc1 Amb10844736 [0,1,0,0,0,0|0,0,0]=1 1572 B13R1.152 O[C@H]([C@H](C(=O)O)C)c1ccccc1 Amb10844122 [0,1,0,0,0,0|2,0,0]=3 1573 B13R1.152 O\C(=C(/C(=O)C)\C)\c1ccccc1 Amb17594481 [0,1,0,0,0,0|1,0,2]=4 1574 B13R1.152 [O-][N+](=O)C(F)C(O)c1ccccc1 Amb24084162 [0,1,0,0,0,0|2,0,1]=4 1575 B13R1.263 C#CC(F)(F)C(O)c1ccccc1 Amb25144457 [0,1,0,0,0,0|2,0,1]=4 1576 B13R1.263 C=CC(F)(F)[C@H](O)c1ccccc1 Amb25316221 [0,1,0,0,0,0|2,0,1]=4 1577 B13R1.263 CC(C(C#N)(C)C)c1ccccc1 Amb17333812 [0,1,0,0,0,0|3,0,0]=4 1578 B13R1.263 CC(C)(C#C)C(O)c1ccccc1 Amb24344309 [0,1,0,0,0,0|1,0,1]=3 1579 B13R1.263 CC(C)(C#N)C(N)c1ccccc1 Amb18127313 [0,1,0,0,0,0|3,0,0]=4 1580 B13R1.263 CC(C)(C#N)C(O)c1c[n]ccc1 Amb24343996 [0,1,0,0,0,0|3,0,0]=4 1581 B13R1.263 CC(C)(C=C)[C@@H](O)c1ccccc1 Amb24704327 [0,1,0,0,0,0|1,0,1]=3 1582 B13R1.263 CC(C)(C=C)[C@H](N)c1ccccc1 Amb25118723 [0,1,0,0,0,0|2,0,1]=4 1583 B13R1.263 CC(C)(C=C)[C@H](O)c1ccccc1 Amb24495507 [0,1,0,0,0,0|1,0,1]=3 1584 B13R1.263 CC(C)(C=O)C(O)c1ccccc1 Amb18128220 [0,1,0,0,0,0|2,0,0]=3 1585 B13R1.263 CC(C)(CCl)C(O)c1ccccc1 Amb24739518 [0,1,0,0,0,0|2,0,0]=3 1586 B13R1.263 CC(C)(CCl)[C@H](O)c1ccccc1 Amb25321895 [0,1,0,0,0,0|2,0,0]=3 1587 B13R1.263 CC(C)(CN)C(N)c1ccccc1 Amb25752199 [0,1,0,0,0,0|3,0,0]=4 1588 B13R1.263 CC(C)(CN)C(O)c1c[n]ccc1 Amb18909171 [0,1,0,0,0,0|3,0,0]=4 1589 B13R1.263 CC(C)(CN)C(O)c1cc[n]cc1 Amb24715184 [0,1,0,0,0,0|3,0,0]=4 1590 B13R1.263 CC(C)(CN)C(O)c1ccccc1 Amb18252491 [0,1,0,0,0,0|2,0,0]=3 1591 B13R1.263 CC(C)(CO)C(Cl)c1ccccc1 Amb25351477 [0,1,0,0,0,0|3,0,0]=4 1592 B13R1.263 CC(C)(CO)[C@@H](N)c1ccccc1 Amb22736693 [0,1,0,0,0,0|3,0,0]=4 1593 B13R1.263 CC(C)(CO)[C@@H](O)c1ccccc1 Amb22737277 [0,1,0,0,0,0|2,0,0]=3 1594 B13R1.263 CC(C)(CO)[C@H](N)c1ccccc1 Amb22736692 [0,1,0,0,0,0|3,0,0]=4 1595 B13R1.263 CC(C)(NC)C(=O)c1ccc[n]c1 Amb24610410 [0,1,0,0,0,0|1,0,2]=4 1596 B13R1.263 CC(C)(NO)C(O)c1ccccc1 Amb24376632 [0,1,0,0,0,0|1,0,0]=2 1597 B13R1.263 CC(C)(SC)C(=O)c1ccccc1 Amb24465677 [0,1,0,0,0,0|1,0,2]=4 1598 B13R1.263 CC(N)(CC)C(=O)c1ccccc1 Amb25298608 [0,1,0,0,0,0|1,0,2]=4 1599 B13R1.263 CC(O)(CC)C(=O)c1ccccc1 Amb24577783 [0,1,0,0,0,0|1,0,2]=4 1600 B13R1.263 CC(O)(CO)C(Cl)c1ccccc1 Amb24380862 [0,1,0,0,0,0|3,0,0]=4 1601 B13R1.263 CC(c1ccccc1)C(C)(C)C=C Amb25674649 [0,1,0,0,0,0|2,0,1]=4 1602 B13R1.263 CC(c1ccccc1)C(C)(C)C=O Amb25125280 [0,1,0,0,0,0|3,0,0]=4 1603 B13R1.263 CCC(C)(C)C(Br)c1ccccc1 Amb25357975 [0,1,0,0,0,0|2,0,0]=3 1604 B13R1.263 CCC(C)(C)C(N)c1ccccc1 Amb18994907 [0,1,0,0,0,0|2,0,0]=3 1605 B13R1.263 CCC(C)(C)C(O)c1c[n]ccc1 Amb24643463 [0,1,0,0,0,0|2,0,0]=3 1606 B13R1.263 CCC(C)(C)C(O)c1ccccc1 Amb18184437 [0,1,0,0,0,0|1,0,0]=2 1607 B13R1.263 CCC(C)(C)[C@@H](N)c1ccccc1 Amb25376903 [0,1,0,0,0,0|2,0,0]=3 1608 B13R1.263 CCC(C)(O)C(N)c1ccccc1 Amb25336525 [0,1,0,0,0,0|2,0,0]=3 1609 B13R1.263 CCC(C)(O)C(O)c1c[n]ccc1 Amb25731375 [0,1,0,0,0,0|2,0,0]=3 1610 B13R1.263 CC[C@@](C)(N)[C@H](F)c1ccccc1 Amb25732708 [0,1,0,0,0,0|2,0,0]=3 1611 B13R1.263 CC[C@](C)(N)[C@H](F)c1ccccc1 Amb25309168 [0,1,0,0,0,0|2,0,0]=3 1612 B13R1.263 CC[C@](C)(O)[C@@H](O)c1ccccc1 Amb25226363 [0,1,0,0,0,0|1,0,0]=2 1613 B13R1.263 CNC(C)(C)C(Cl)c1ccccc1 Amb25708479 [0,1,0,0,0,0|1,0,0]=2 1614 B13R1.263 CNC(C)(C)C(F)c1c[n]c[n]c1 Amb25782358 [0,1,0,0,0,0|3,0,0]=4 1615 B13R1.263 CNC(C)(C)C(F)c1c[n]cc[n]1 Amb24726716 [0,1,0,0,0,0|3,0,0]=4 1616 B13R1.263 CNC(C)(C)C(F)c1c[n]ccc1 Amb25138844 [0,1,0,0,0,0|2,0,0]=3 1617 B13R1.263 CNC(C)(C)C(O)c1c[n]cc[n]1 Amb25088669 [0,1,0,0,0,0|2,0,0]=3 1618 B13R1.263 CNC(C)(C)[C@@H](O)c1ccccc1 Amb24589661 [0,1,0,0,0,0|0,0,0]=1 1619 B13R1.263 COC(C)(N)C(O)c1ccccc1 Amb24606141 [0,1,0,0,0,0|1,0,0]=2 1620 B13R1.263 COC(F)(F)C(Cl)c1ccccc1 Amb25756211 [0,1,0,0,0,0|3,0,0]=4 1621 B13R1.263 COP(O)(=O)C(O)c1ccccc1 Amb22466458 [0,1,0,0,0,0|3,0,0]=4 1622 B13R1.263 COP([O-])(=O)C(O)c1ccccc1 Amb22454980 [0,1,0,0,0,0|3,0,0]=4 1623 B13R1.263 CO[C@](C)(N)[C@@H](O)c1ccccc1 Amb24382550 [0,1,0,0,0,0|1,0,0]=2 1624 B13R1.263 CSC(C)(C)C(O)c1c[n]cc[n]1 Amb25172538 [0,1,0,0,0,0|3,0,0]=4 1625 B13R1.263 CSC(C)(C)C(O)c1ccccc1 Amb24430919 [0,1,0,0,0,0|1,0,0]=2 1626 B13R1.263 CSC(C)(C)[C@@H](O)c1ccccc1 Amb25837895 [0,1,0,0,0,0|1,0,0]=2 1627 B13R1.263 C[C@@](O)(C=C)[C@@H](O)c1ccccc1 Amb24630751 [0,1,0,0,0,0|1,0,1]=3 1628 B13R1.263 C[C@@](O)(CO)[C@H](Cl)c1ccccc1 Amb25309615 [0,1,0,0,0,0|3,0,0]=4 1629 B13R1.263 C[C@](O)(C=C)[C@@H](O)c1ccccc1 Amb25092072 [0,1,0,0,0,0|1,0,1]=3 1630 B13R1.263 N#CC(F)(F)C(O)c1ccccc1 Amb25823069 [0,1,0,0,0,0|3,0,0]=4 1631 B13R1.263 NCC(C(c1ccccc1)C)(C)C Amb17333855 [0,1,0,0,0,0|3,0,0]=4 1632 B13R1.263 OCC(C(c1ccccc1)N)(C)C Amb17605527 [0,1,0,0,0,0|3,0,0]=4 1633 B13R1.263 OCC(F)(F)C(O)c1ccccc1 Amb24344376 [0,1,0,0,0,0|3,0,0]=4 1634 B13R1.263 OCC(F)(F)[C@H](O)c1ccccc1 Amb25308131 [0,1,0,0,0,0|3,0,0]=4 1635 B13R1.263 ONC(C(=O)c1ccccc1)(C)C Amb2226850 [0,1,0,0,0,0|1,0,2]=4 1636 B13R1.532 CC(C#N)C(C#N)c1ccccc1 Amb18647403 [0,1,0,0,0,0|3,0,0]=4 1637 B13R1.532 CC(CC)C(C#N)c1cc[n]cc1 Amb25324839 [0,1,0,0,0,0|3,0,0]=4 1638 B13R1.532 CC(CC)C(C#N)c1cccc[n]1 Amb18127310 [0,1,0,0,0,0|3,0,0]=4 1639 B13R1.532 CC(NC)C(OC)c1ccccc1 Amb22733802 [0,1,0,0,0,0|0,0,0]=1 1640 B13R1.532 CCC(C(=S)NC)c1ccccc1 Amb25690915 [0,1,0,0,0,0|2,0,1]=4 1641 B13R1.532 CC[C@@H](C(=O)NC)c1ccccc1 Amb25685863 [0,1,0,0,0,0|2,0,1]=4 1642 B13R1.532 CC[C@H](O)[C@@H](C#N)c1ccccc1 Amb24386945 [0,1,0,0,0,0|3,0,0]=4 1643 B13R1.532 CNC(=N)C(OC)c1ccccc1 Amb25132391 [0,1,0,0,0,0|1,0,1]=3 1644 B13R1.532 CNC(=O)C(C#N)c1ccccc1 Amb18790298 [0,1,0,0,0,0|2,0,1]=4 1645 B13R1.532 CNC(=O)C(CN)c1ccccc1 Amb18999518 [0,1,0,0,0,0|2,0,1]=4 1646 B13R1.532 CNC(=O)C(CO)c1ccccc1 Amb25685879 [0,1,0,0,0,0|1,0,1]=3 1647 B13R1.532 CNC(=O)C(NC)c1ccccc1 Amb18128254 [0,1,0,0,0,0|2,0,1]=4 1648 B13R1.532 CNC(=O)C(OC)c1ccccc1 Amb24390519 [0,1,0,0,0,0|1,0,1]=3 1649 B13R1.532 CNC(=O)[C@@H](NO)c1ccccc1 Amb25803643 [0,1,0,0,0,0|1,0,1]=3 1650 B13R1.532 CNC(=O)\C(=N/O)\c1ccccc1 Amb1951205 [0,1,0,0,0,0|1,0,2]=4 1651 B13R1.532 CNC(=O)\C(=N\O)\c1ccccc1 Amb24605318 [0,1,0,0,0,0|1,0,2]=4 1652 B13R1.532 CNC(=S)C(OC)c1cccc[n]1 Amb25731942 [0,1,0,0,0,0|2,0,1]=4 1653 B13R1.532 CNC(C)\C(=N\O)\c1ccccc1 Amb24563841 [0,1,0,0,0,0|0,0,1]=2 1654 B13R1.532 COC(=O)[C@@H](OC)c1ccccc1 Amb22746502 [0,1,0,0,0,0|2,0,1]=4 1655 B13R1.532 COC(=O)[C@H](OC)c1ccccc1 Amb22274921 [0,1,0,0,0,0|2,0,1]=4 1656 B13R1.532 COC(C(=O)NO)c1ccccc1 Amb18184979 [0,1,0,0,0,0|2,0,1]=4 1657 B13R1.532 COC(c1ccccc1)C(=O)OC Amb10783162 [0,1,0,0,0,0|2,0,1]=4 1658 B13R1.532 CO[C@H]([C@@H](O)C#N)c1ccccc1 Amb25792480 [0,1,0,0,0,0|3,0,0]=4 1659 B13R1.532 CO[C@H]([C@H](O)C#N)c1ccccc1 Amb24355254 [0,1,0,0,0,0|3,0,0]=4 1660 B13R1.532 C\C(=C/C)\C(C=O)c1ccccc1 Amb25128277 [0,1,0,0,0,0|1,0,2]=4 1661 B13R1.532 C\C(=N/N)\C(OC)c1ccccc1 Amb25345695 [0,1,0,0,0,0|1,0,2]=4 1662 B13R1.532 C\C=C(\C(C)NC)/c1ccccc1 Amb24451964 [0,1,0,0,0,0|1,0,1]=3 1663 B13R1.532 NNC(=O)C(CO)c1ccccc1 Amb24747140 [0,1,0,0,0,0|2,0,1]=4 1664 B13R1.696 C=CC(Cl)C(O)c1ccccc1Cl Amb24723902 [0,1,0,0,0,0|2,0,1]=4 1665 B13R1.696 C=C[C@@H](Cl)[C@@H](O)c1ccccc1F Amb25733455 [0,1,0,0,0,0|2,0,1]=4 1666 B13R1.696 C=C[C@@H](Cl)[C@H](O)c1ccccc1F Amb25041093 [0,1,0,0,0,0|2,0,1]=4 1667 B13R1.696 C=C[C@H](Cl)[C@@H](O)c1ccccc1Cl Amb24490425 [0,1,0,0,0,0|2,0,1]=4 1668 B13R1.696 CC(=C=C)C(O)c1ccccc1O Amb25205739 [0,1,0,0,0,0|1,0,2]=4 1669 B13R1.696 CC(C#N)C(O)c1ccccc1Br Amb25684021 [0,1,0,0,0,0|2,0,0]=3 1670 B13R1.696 CC(C#N)C(O)c1ccccc1F Amb25835922 [0,1,0,0,0,0|2,0,0]=3 1671 B13R1.696 CC(C(Br)CC)c1ccccc1Cl Amb25217479 [0,1,0,0,0,0|3,0,0]=4 1672 B13R1.696 CC(C(Cl)CC)c1ccccc1Cl Amb24520767 [0,1,0,0,0,0|3,0,0]=4 1673 B13R1.696 CC(C(Cl)CC)c1ccccc1F Amb24599346 [0,1,0,0,0,0|3,0,0]=4 1674 B13R1.696 CC(C(N)CC)c1ccccc1Br Amb25351380 [0,1,0,0,0,0|3,0,0]=4 1675 B13R1.696 CC(C(N)CC)c1ccccc1F Amb18824068 [0,1,0,0,0,0|3,0,0]=4 1676 B13R1.696 CC(C(O)CC)c1ccccc1Br Amb25180904 [0,1,0,0,0,0|3,0,0]=4 1677 B13R1.696 CC(C(O)CC)c1ccccc1Cl Amb24454174 [0,1,0,0,0,0|3,0,0]=4 1678 B13R1.696 CC(C(O)CC)c1ccccc1F Amb25229801 [0,1,0,0,0,0|3,0,0]=4 1679 B13R1.696 CC(C=C)C(O)c1ccccc1Cl Amb24632494 [0,1,0,0,0,0|1,0,1]=3 1680 B13R1.696 CC(C=C)C(O)c1ccccc1N Amb24679983 [0,1,0,0,0,0|1,0,1]=3 1681 B13R1.696 CC(C=C)C(O)c1ccccc1O Amb24620145 [0,1,0,0,0,0|1,0,1]=3 1682 B13R1.696 CC(CC)C(C)c1c[n]ccc1N Amb25061605 [0,1,0,0,0,0|3,0,0]=4 1683 B13R1.696 CC(CC)C(C)c1ccc[n]c1N Amb25765991 [0,1,0,0,0,0|3,0,0]=4 1684 B13R1.696 CC(CC)C(Cl)c1c[n]ccc1N Amb25820478 [0,1,0,0,0,0|3,0,0]=4 1685 B13R1.696 CC(CC)C(Cl)c1ccc[n]c1N Amb25215951 [0,1,0,0,0,0|3,0,0]=4 1686 B13R1.696 CC(CC)C(N)c1[n]cccc1Cl Amb25302720 [0,1,0,0,0,0|3,0,0]=4 1687 B13R1.696 CC(CC)C(N)c1[n]cccc1F Amb24638612 [0,1,0,0,0,0|3,0,0]=4 1688 B13R1.696 CC(CC)C(N)c1cc[n]cc1Cl Amb24617376 [0,1,0,0,0,0|3,0,0]=4 1689 B13R1.696 CC(CC)C(N)c1ccc[n]c1F Amb24617325 [0,1,0,0,0,0|3,0,0]=4 1690 B13R1.696 CC(CC)C(N)c1ccccc1F Amb25801292 [0,1,0,0,0,0|2,0,0]=3 1691 B13R1.696 CC(CC)C(N)c1ccccc1I Amb25726724 [0,1,0,0,0,0|2,0,0]=3 1692 B13R1.696 CC(CC)C(O)c1[n]cccc1Cl Amb24496540 [0,1,0,0,0,0|2,0,0]=3 1693 B13R1.696 CC(CC)C(O)c1cc[n]cc1Cl Amb24462083 [0,1,0,0,0,0|2,0,0]=3 1694 B13R1.696 CC(CC)C(O)c1cc[n]cc1F Amb24747735 [0,1,0,0,0,0|2,0,0]=3 1695 B13R1.696 CC(CC)C(O)c1ccccc1Br Amb25739229 [0,1,0,0,0,0|1,0,0]=2 1696 B13R1.696 CC(CC)C(O)c1ccccc1Cl Amb25772042 [0,1,0,0,0,0|1,0,0]=2 1697 B13R1.696 CC(CC)C(O)c1ccccc1F Amb25732205 [0,1,0,0,0,0|1,0,0]=2 1698 B13R1.696 CC(CC)C(O)c1ccccc1I Amb25787566 [0,1,0,0,0,0|1,0,0]=2 1699 B13R1.696 CC(CC)C(O)c1ccccc1N Amb24669631 [0,1,0,0,0,0|1,0,0]=2 1700 B13R1.696 CC(CC)[C@H](N)c1ccc[n]c1Cl Amb24604867 [0,1,0,0,0,0|3,0,0]=4 1701 B13R1.696 CC(CC)[C@H](N)c1ccc[n]c1N Amb24681283 [0,1,0,0,0,0|3,0,0]=4 1702 B13R1.696 CC(CC)[C@H](N)c1ccccc1Br Amb24610185 [0,1,0,0,0,0|2,0,0]=3 1703 B13R1.696 CC(CN)C(F)c1ccccc1Cl Amb24625404 [0,1,0,0,0,0|3,0,0]=4 1704 B13R1.696 CC(CN)C(O)c1c[n]ccc1N Amb24411858 [0,1,0,0,0,0|3,0,0]=4 1705 B13R1.696 CC(CN)C(O)c1ccc[n]c1N Amb25823991 [0,1,0,0,0,0|3,0,0]=4 1706 B13R1.696 CC(CN)C(O)c1ccccc1Cl Amb25674619 [0,1,0,0,0,0|2,0,0]=3 1707 B13R1.696 CC(CN)C(O)c1ccccc1O Amb25677589 [0,1,0,0,0,0|2,0,0]=3 1708 B13R1.696 CC(CO)C(N)c1ccccc1Cl Amb25084551 [0,1,0,0,0,0|3,0,0]=4 1709 B13R1.696 CC(NC)C(C)c1ccccc1F Amb24639929 [0,1,0,0,0,0|1,0,0]=2 1710 B13R1.696 CC(NC)C(O)c1ccccc1Cl Amb24488847 [0,1,0,0,0,0|0,0,0]=1 1711 B13R1.696 CC(OC)C(N)c1c[n]ccc1N Amb25253365 [0,1,0,0,0,0|3,0,0]=4 1712 B13R1.696 CC(OC)C(N)c1cc[n]cc1F Amb25334188 [0,1,0,0,0,0|3,0,0]=4 1713 B13R1.696 CC(OC)C(O)c1cc[n]cc1F Amb25293665 [0,1,0,0,0,0|2,0,0]=3 1714 B13R1.696 CC(OC)C(O)c1ccc[n]c1N Amb24704840 [0,1,0,0,0,0|2,0,0]=3 1715 B13R1.696 CCC(=O)[C@@H](O)c1ccccc1F Amb24495717 [0,1,0,0,0,0|2,0,1]=4 1716 B13R1.696 CCC(C)C(=O)c1ccccc1Cl Amb25315925 [0,1,0,0,0,0|1,0,2]=4 1717 B13R1.696 CCC(C)C(=O)c1ccccc1I Amb25354373 [0,1,0,0,0,0|1,0,2]=4 1718 B13R1.696 CCC(C)C(=O)c1ccccc1N Amb18127955 [0,1,0,0,0,0|1,0,2]=4 1719 B13R1.696 CCC(C)C(=O)c1ccccc1O Amb18128176 [0,1,0,0,0,0|1,0,2]=4 1720 B13R1.696 CCC(C)S(=O)c1ccccc1N Amb18977317 [0,1,0,0,0,0|2,0,1]=4 1721 B13R1.696 CCC(N)C(N)c1ccccc1Cl Amb25200306 [0,1,0,0,0,0|3,0,0]=4 1722 B13R1.696 CCC(N)C(O)c1[n]cccc1Cl Amb25255462 [0,1,0,0,0,0|3,0,0]=4 1723 B13R1.696 CCC(N)C(O)c1[n]cccc1O Amb25222671 [0,1,0,0,0,0|3,0,0]=4 1724 B13R1.696 CCC(N)C(O)c1ccc[n]c1O Amb24580677 [0,1,0,0,0,0|3,0,0]=4 1725 B13R1.696 CCC(N)C(O)c1ccccc1F Amb19149127 [0,1,0,0,0,0|2,0,0]=3 1726 B13R1.696 CCC(N)C(O)c1ccccc1O Amb18824101 [0,1,0,0,0,0|2,0,0]=3 1727 B13R1.696 CCC(O)C(N)c1ccccc1O Amb25739716 [0,1,0,0,0,0|3,0,0]=4 1728 B13R1.696 CCC(O)C(O)c1c[n]ccc1N Amb25191500 [0,1,0,0,0,0|3,0,0]=4 1729 B13R1.696 CCC(O)C(O)c1cc[n]cc1F Amb24469482 [0,1,0,0,0,0|3,0,0]=4 1730 B13R1.696 CCC(O)C(O)c1ccccc1Cl Amb25225440 [0,1,0,0,0,0|2,0,0]=3 1731 B13R1.696 CCC(O)C(O)c1ccccc1F Amb24496070 [0,1,0,0,0,0|2,0,0]=3 1732 B13R1.696 CC[C@@H](N)[C@@H](O)c1[n]cccc1Cl Amb25326707 [0,1,0,0,0,0|3,0,0]=4 1733 B13R1.696 CC[C@@H](N)[C@@H](O)c1[n]cccc1F Amb24542915 [0,1,0,0,0,0|3,0,0]=4 1734 B13R1.696 CC[C@@H](N)[C@@H](O)c1c[n]ccc1Cl Amb24565944 [0,1,0,0,0,0|3,0,0]=4 1735 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccc[n]c1Cl Amb25366549 [0,1,0,0,0,0|3,0,0]=4 1736 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1N Amb25258564 [0,1,0,0,0,0|2,0,0]=3 1737 B13R1.696 CC[C@@H](N)[C@@H](O)c1ccccc1O Amb24566282 [0,1,0,0,0,0|2,0,0]=3 1738 B13R1.696 CC[C@@H](N)[C@H](O)c1[n]cccc1Cl Amb25377822 [0,1,0,0,0,0|3,0,0]=4 1739 B13R1.696 CC[C@@H](N)[C@H](O)c1[n]cccc1N Amb24715937 [0,1,0,0,0,0|3,0,0]=4 1740 B13R1.696 CC[C@@H](N)[C@H](O)c1[n]cccc1O Amb24540369 [0,1,0,0,0,0|3,0,0]=4 1741 B13R1.696 CC[C@@H](N)[C@H](O)c1ccc[n]c1Cl Amb24542913 [0,1,0,0,0,0|3,0,0]=4 1742 B13R1.696 CC[C@@H](N)[C@H](O)c1ccc[n]c1N Amb24558418 [0,1,0,0,0,0|3,0,0]=4 1743 B13R1.696 CC[C@@H](N)[C@H](O)c1ccccc1Cl Amb24742405 [0,1,0,0,0,0|2,0,0]=3 1744 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1Cl Amb25739636 [0,1,0,0,0,0|3,0,0]=4 1745 B13R1.696 CC[C@@H](O)[C@@H](N)c1ccccc1I Amb25826260 [0,1,0,0,0,0|3,0,0]=4 1746 B13R1.696 CC[C@H](N)[C@@H](N)c1ccccc1Br Amb24694474 [0,1,0,0,0,0|3,0,0]=4 1747 B13R1.696 CC[C@H](N)[C@@H](O)c1[n]cccc1F Amb25275544 [0,1,0,0,0,0|3,0,0]=4 1748 B13R1.696 CC[C@H](N)[C@@H](O)c1[n]cccc1N Amb25302314 [0,1,0,0,0,0|3,0,0]=4 1749 B13R1.696 CC[C@H](N)[C@@H](O)c1c[n]ccc1Cl Amb24542641 [0,1,0,0,0,0|3,0,0]=4 1750 B13R1.696 CC[C@H](N)[C@@H](O)c1ccccc1N Amb25326716 [0,1,0,0,0,0|2,0,0]=3 1751 B13R1.696 CC[C@H](N)[C@H](O)c1ccc[n]c1Cl Amb24742406 [0,1,0,0,0,0|3,0,0]=4 1752 B13R1.696 CC[C@H](N)[C@H](O)c1ccccc1F Amb24652764 [0,1,0,0,0,0|2,0,0]=3 1753 B13R1.696 CC[C@H](N)[C@H](O)c1ccccc1N Amb24542906 [0,1,0,0,0,0|2,0,0]=3 1754 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1Br Amb24662628 [0,1,0,0,0,0|3,0,0]=4 1755 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1Cl Amb24463839 [0,1,0,0,0,0|3,0,0]=4 1756 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1F Amb25191591 [0,1,0,0,0,0|3,0,0]=4 1757 B13R1.696 CC[C@H](O)[C@H](N)c1ccccc1I Amb25158280 [0,1,0,0,0,0|3,0,0]=4 1758 B13R1.696 CN(CC)C(C)c1ccccc1Br Amb25681092 [0,1,0,0,0,0|3,0,0]=4 1759 B13R1.696 CN(CC)C(C)c1ccccc1Cl Amb25663458 [0,1,0,0,0,0|3,0,0]=4 1760 B13R1.696 CN(CC)C(C)c1ccccc1O Amb24491373 [0,1,0,0,0,0|3,0,0]=4 1761 B13R1.696 CNC(=O)C(Cl)c1ccccc1Br Amb24449759 [0,1,0,0,0,0|2,0,1]=4 1762 B13R1.696 CNC(=O)C(Cl)c1ccccc1Cl Amb25198433 [0,1,0,0,0,0|2,0,1]=4 1763 B13R1.696 CNC(=O)C(N)c1ccccc1Cl Amb24733869 [0,1,0,0,0,0|2,0,1]=4 1764 B13R1.696 CNC(=O)C(c1ccccc1Cl)C Amb2444727 [0,1,0,0,0,0|2,0,1]=4 1765 B13R1.696 CNC(=O)N(O)c1ccccc1Cl Amb22433830 [0,1,0,0,0,0|2,0,1]=4 1766 B13R1.696 CNC(C(=O)c1ccccc1C)C Amb17617550 [0,1,0,0,0,0|0,0,2]=3 1767 B13R1.696 CNC(C)C(=O)c1c[n]ccc1N Amb25153533 [0,1,0,0,0,0|1,0,2]=4 1768 B13R1.696 CNC(C)C(=O)c1cc[n]cc1F Amb24400898 [0,1,0,0,0,0|1,0,2]=4 1769 B13R1.696 CNC(C)C(=O)c1ccccc1Cl Amb25731975 [0,1,0,0,0,0|0,0,2]=3 1770 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb22055293 [0,1,0,0,0,0|0,0,2]=3 1771 B13R1.696 CNC(C)C(=O)c1ccccc1F Amb25228402 [0,1,0,0,0,0|0,0,2]=3 1772 B13R1.696 COC(=O)C(O)c1ccccc1Br Amb23596557 [0,1,0,0,0,0|2,0,1]=4 1773 B13R1.696 COC(=O)C(O)c1ccccc1F Amb19074670 [0,1,0,0,0,0|2,0,1]=4 1774 B13R1.696 COC(=O)C(O)c1ccccc1O Amb24408426 [0,1,0,0,0,0|2,0,1]=4 1775 B13R1.696 COC(=O)[C@@H](O)c1ccccc1Br Amb25704319 [0,1,0,0,0,0|2,0,1]=4 1776 B13R1.696 COC(=O)[C@@H](O)c1ccccc1Cl Amb19131235 [0,1,0,0,0,0|2,0,1]=4 1777 B13R1.696 COC(=O)[C@@H](c1ccccc1Cl)O Amb17610948 [0,1,0,0,0,0|2,0,1]=4 1778 B13R1.696 COC(=O)[C@H](O)c1ccccc1Br Amb25789173 [0,1,0,0,0,0|2,0,1]=4 1779 B13R1.696 COC(=O)[C@H](O)c1ccccc1F Amb25819798 [0,1,0,0,0,0|2,0,1]=4 1780 B13R1.696 C[C@@H](C=C)[C@@H](N)c1ccccc1F Amb24742944 [0,1,0,0,0,0|2,0,1]=4 1781 B13R1.696 C[C@@H](C=C)[C@@H](O)c1ccccc1O Amb24492568 [0,1,0,0,0,0|1,0,1]=3 1782 B13R1.696 C[C@@H](C=C)[C@H](N)c1ccccc1F Amb25685770 [0,1,0,0,0,0|2,0,1]=4 1783 B13R1.696 C[C@@H](C=O)[C@@H](O)c1ccccc1Cl Amb24666659 [0,1,0,0,0,0|2,0,0]=3 1784 B13R1.696 C[C@@H](NC)[C@@H](O)c1ccccc1O Amb24664354 [0,1,0,0,0,0|0,0,0]=1 1785 B13R1.696 C[C@@H](OC)[C@@H](C)c1ccccc1N Amb25794161 [0,1,0,0,0,0|2,0,0]=3 1786 B13R1.696 C[C@@H](OC)[C@H](C)c1ccccc1N Amb24433240 [0,1,0,0,0,0|2,0,0]=3 1787 B13R1.696 C[C@H](C=C)[C@H](N)c1ccccc1F Amb25834868 [0,1,0,0,0,0|2,0,1]=4 1788 B13R1.696 C[C@H](C=O)[C@@H](O)c1ccccc1Cl Amb24668938 [0,1,0,0,0,0|2,0,0]=3 1789 B13R1.696 Cc1[n]cccc1C(N)C(C)CC Amb25842798 [0,1,0,0,0,0|3,0,0]=4 1790 B13R1.696 Cc1[n]cccc1[C@@H](O)[C@@H](N)CC Amb25241693 [0,1,0,0,0,0|3,0,0]=4 1791 B13R1.696 Cc1[n]cccc1[C@H](O)[C@@H](N)CC Amb25300573 [0,1,0,0,0,0|3,0,0]=4 1792 B13R1.696 Cc1c[n]ccc1C(N)C(C)CC Amb25793029 [0,1,0,0,0,0|3,0,0]=4 1793 B13R1.696 Cc1c[n]ccc1C(O)C(C)CC Amb25718946 [0,1,0,0,0,0|2,0,0]=3 1794 B13R1.696 Cc1c[n]ccc1C(O)C(C)CN Amb24646274 [0,1,0,0,0,0|3,0,0]=4 1795 B13R1.696 Cc1cc[n]cc1C(=O)C(C)NC Amb25789372 [0,1,0,0,0,0|1,0,2]=4 1796 B13R1.696 Cc1cc[n]cc1C(N)C(C)CC Amb18195066 [0,1,0,0,0,0|3,0,0]=4 1797 B13R1.696 Cc1cc[n]cc1C(O)C(C)C#N Amb25731574 [0,1,0,0,0,0|3,0,0]=4 1798 B13R1.696 Cc1cc[n]cc1C(O)C(C)CC Amb24459427 [0,1,0,0,0,0|2,0,0]=3 1799 B13R1.696 Cc1cc[n]cc1C(O)C(O)CC Amb25785361 [0,1,0,0,0,0|3,0,0]=4 1800 B13R1.696 Cc1cc[n]cc1[C@H](O)[C@H](N)CC Amb24567964 [0,1,0,0,0,0|3,0,0]=4 1801 B13R1.696 Cc1ccc[n]c1C(N)C(C)CC Amb24457227 [0,1,0,0,0,0|3,0,0]=4 1802 B13R1.696 Cc1ccc[n]c1C(O)C(C)CC Amb25081875 [0,1,0,0,0,0|2,0,0]=3 1803 B13R1.696 Cc1ccccc1C(=O)C(C)NC Amb25836669 [0,1,0,0,0,0|0,0,2]=3 1804 B13R1.696 Cc1ccccc1C(=O)C(C)OC Amb25139867 [0,1,0,0,0,0|1,0,2]=4 1805 B13R1.696 Cc1ccccc1C(C)C(Br)CC Amb24409402 [0,1,0,0,0,0|3,0,0]=4 1806 B13R1.696 Cc1ccccc1C(C)C(C)CN Amb25068214 [0,1,0,0,0,0|3,0,0]=4 1807 B13R1.696 Cc1ccccc1C(C)C(C)NC Amb25118909 [0,1,0,0,0,0|1,0,0]=2 1808 B13R1.696 Cc1ccccc1C(C)N(C)CC Amb24430722 [0,1,0,0,0,0|3,0,0]=4 1809 B13R1.696 Cc1ccccc1C(Cl)C(=O)NC Amb18330995 [0,1,0,0,0,0|2,0,1]=4 1810 B13R1.696 Cc1ccccc1C(N)C(=O)NC Amb25127837 [0,1,0,0,0,0|2,0,1]=4 1811 B13R1.696 Cc1ccccc1C(N)C(C)CC Amb25682854 [0,1,0,0,0,0|2,0,0]=3 1812 B13R1.696 Cc1ccccc1C(N)C(C)OC Amb25306982 [0,1,0,0,0,0|2,0,0]=3 1813 B13R1.696 Cc1ccccc1C(N)C(O)CC Amb25787351 [0,1,0,0,0,0|3,0,0]=4 1814 B13R1.696 Cc1ccccc1C(O)C(=C)CC Amb24354384 [0,1,0,0,0,0|1,0,2]=4 1815 B13R1.696 Cc1ccccc1C(O)C(=O)OC Amb18809302 [0,1,0,0,0,0|2,0,1]=4 1816 B13R1.696 Cc1ccccc1C(O)C(C)C#C Amb24704516 [0,1,0,0,0,0|1,0,1]=3 1817 B13R1.696 Cc1ccccc1C(O)C(C)C=C Amb25741348 [0,1,0,0,0,0|1,0,1]=3 1818 B13R1.696 Cc1ccccc1C(O)C(C)CC Amb25137663 [0,1,0,0,0,0|1,0,0]=2 1819 B13R1.696 Cc1ccccc1C(O)C(O)CC Amb25277907 [0,1,0,0,0,0|2,0,0]=3 1820 B13R1.696 Cc1ccccc1[C@@H](N)C(C)CC Amb25227944 [0,1,0,0,0,0|2,0,0]=3 1821 B13R1.696 Cc1ccccc1[C@@H](O)C(C)CC Amb25846942 [0,1,0,0,0,0|1,0,0]=2 1822 B13R1.696 Cc1ccccc1[C@@H](O)[C@@H](N)CC Amb25201744 [0,1,0,0,0,0|2,0,0]=3 1823 B13R1.696 Cc1ccccc1[C@H](N)C(C)CC Amb24598947 [0,1,0,0,0,0|2,0,0]=3 1824 B13R1.696 Cc1ccccc1[C@H](O)C(=O)OC Amb25706095 [0,1,0,0,0,0|2,0,1]=4 1825 B13R1.696 Cc1ccccc1[C@H](O)[C@@H](N)CC Amb25242663 [0,1,0,0,0,0|2,0,0]=3 1826 B13R1.696 Cc1ccccc1[C@H](O)[C@H](C)C#C Amb25346285 [0,1,0,0,0,0|1,0,1]=3 1827 B13R1.696 Cc1ccccc1[C@H](O)[C@H](C)CC Amb25741360 [0,1,0,0,0,0|1,0,0]=2 1828 B13R1.696 N#C[C@@H](O)[C@@H](O)c1ccccc1Cl Amb25741399 [0,1,0,0,0,0|3,0,0]=4 1829 B13R1.696 N#C[C@H](O)[C@@H](O)c1ccccc1Cl Amb24495577 [0,1,0,0,0,0|3,0,0]=4 1830 B13R1.696 NC(CO)C(O)c1ccccc1Br Amb18717858 [0,1,0,0,0,0|3,0,0]=4 1831 B13R1.696 NC(CO)C(O)c1ccccc1Cl Amb24342238 [0,1,0,0,0,0|3,0,0]=4 1832 B13R1.708 CC(C=C)C(C)(N)c1ccccc1 Amb25695897 [0,1,0,0,0,0|2,0,1]=4 1833 B13R1.708 CC(Cl)(C(=O)NC)c1ccccc1 Amb24492676 [0,1,0,0,0,0|2,0,1]=4 1834 B13R1.708 CC(N)(C(=O)NC)c1ccccc1 Amb18961972 [0,1,0,0,0,0|2,0,1]=4 1835 B13R1.708 CC(NN)C(C)(C)c1ccccc1 Amb24618175 [0,1,0,0,0,0|2,0,0]=3 1836 B13R1.708 CC(O)(C(=O)NC)c1cccc[n]1 Amb25369257 [0,1,0,0,0,0|2,0,1]=4 1837 B13R1.708 CC(O)(C(=O)OC)c1ccccc1 Amb18186543 [0,1,0,0,0,0|2,0,1]=4 1838 B13R1.708 CC(O)(C(O)C#C)c1ccccc1 Amb24495708 [0,1,0,0,0,0|2,0,1]=4 1839 B13R1.708 CC(O)(C(O)C=C)c1ccccc1 Amb24379798 [0,1,0,0,0,0|2,0,1]=4 1840 B13R1.708 CCC(C)C(C)(N)c1c[n]ccc1 Amb18970012 [0,1,0,0,0,0|3,0,0]=4 1841 B13R1.708 CCC(C)C(C)(N)c1ccccc1 Amb18969892 [0,1,0,0,0,0|2,0,0]=3 1842 B13R1.708 CCC(C)C(C)(O)c1c[n]c[n]c1 Amb18186682 [0,1,0,0,0,0|3,0,0]=4 1843 B13R1.708 CCC(C)C(C)(O)c1c[n]ccc1 Amb18796159 [0,1,0,0,0,0|2,0,0]=3 1844 B13R1.708 CCC(C)C(C)(O)c1ccccc1 Amb18180852 [0,1,0,0,0,0|1,0,0]=2 1845 B13R1.708 CCC(N)C(C)(C)c1ccccc1 Amb18303249 [0,1,0,0,0,0|3,0,0]=4 1846 B13R1.708 CCC(O)C(C)(C)c1ccccc1 Amb18178607 [0,1,0,0,0,0|3,0,0]=4 1847 B13R1.708 CCC(O)C(C)(O)c1cc[n]cc1 Amb24495107 [0,1,0,0,0,0|3,0,0]=4 1848 B13R1.708 CCC(O)C(C)(O)c1cccc[n]1 Amb24475807 [0,1,0,0,0,0|3,0,0]=4 1849 B13R1.708 CCC(O)C(C)(O)c1ccccc1 Amb25332126 [0,1,0,0,0,0|2,0,0]=3 1850 B13R1.708 CCN(C)C(C)(C)c1ccccc1 Amb25856258 [0,1,0,0,0,0|3,0,0]=4 1851 B13R1.708 CC[C@@H](N)C(C)(C)c1ccccc1 Amb25772208 [0,1,0,0,0,0|3,0,0]=4 1852 B13R1.708 CC[C@H](N)C(C)(C)c1ccccc1 Amb24451438 [0,1,0,0,0,0|3,0,0]=4 1853 B13R1.708 CC[C@H](O)C(C)(C)c1ccccc1 Amb25859042 [0,1,0,0,0,0|3,0,0]=4 1854 B13R1.708 CNC(=O)C(F)(Cl)c1ccccc1 Amb25307221 [0,1,0,0,0,0|2,0,1]=4 1855 B13R1.708 CNC(C)C(C)(C)c1ccccc1 Amb19002601 [0,1,0,0,0,0|1,0,0]=2 1856 B13R1.708 CN[C@@H](C)C(C)(O)c1ccccc1 Amb25377136 [0,1,0,0,0,0|0,0,0]=1 1857 B13R1.708 CN[C@@H](C)[C@](C)(O)c1ccccc1 Amb24542841 [0,1,0,0,0,0|0,0,0]=1 1858 B13R1.708 COC(C)C(C)(O)c1c[n]c[n]c1 Amb24389907 [0,1,0,0,0,0|3,0,0]=4 1859 B13R1.708 COC(C)C(C)(O)c1c[n]cc[n]1 Amb24724231 [0,1,0,0,0,0|3,0,0]=4 1860 B13R1.708 COC(C)C(C)(O)c1ccccc1 Amb25834742 [0,1,0,0,0,0|1,0,0]=2 1861 B13R1.708 C[C@@](O)(C(=O)CC)c1ccccc1 Amb24633433 [0,1,0,0,0,0|2,0,1]=4 1862 B13R1.708 C[C@@](O)([C@@H](O)C#C)c1ccccc1 Amb25334731 [0,1,0,0,0,0|2,0,1]=4 1863 B13R1.708 C[C@H](CO)[C@@](C)(O)c1ccccc1 Amb24495489 [0,1,0,0,0,0|2,0,0]=3 1864 B13R1.708 C[C@H](CO)[C@](C)(O)c1ccccc1 Amb24370043 [0,1,0,0,0,0|2,0,0]=3 1865 B13R1.708 C[C@](O)(C(=O)CC)c1ccccc1 Amb24534294 [0,1,0,0,0,0|2,0,1]=4 1866 B13R2.15 CC1CNCC1c2ccccc2 Amb24312553 [0,0,0,1,0,0|3,0,0]=4 1867 B13R2.15 CC1NBOC1c2ccccc2 Amb24540810 [0,0,0,1,0,0|1,0,0]=2 1868 B13R2.15 CC1NCCC1c2c[n]ccc2 Amb18947151 [0,0,0,1,0,0|2,0,0]=3 1869 B13R2.15 CC1NCCC1c2cc[n]c[n]2 Amb24545781 [0,0,0,1,0,0|3,0,0]=4 1870 B13R2.15 CC1NCCC1c2cc[n]cc2 Amb18947173 [0,0,0,1,0,0|2,0,0]=3 1871 B13R2.15 CC1NCCC1c2cccc[n]2 Amb18947135 [0,0,0,1,0,0|2,0,0]=3 1872 B13R2.15 CC1NCCC1c2ccccc2 Amb18279882 [0,0,0,1,0,0|1,0,0]=2 1873 B13R2.15 CC1NCCP1c2ccccc2 Amb25075554 [0,0,0,1,0,0|2,0,0]=3 1874 B13R2.15 CC1NCOC1c2ccccc2 Amb18645894 [0,0,0,1,0,0|0,0,0]=1 1875 B13R2.15 CN1CCC[C@@H]1c2ccccc2 Amb25817229 [0,0,0,1,0,0|3,0,0]=4 1876 B13R2.15 CN1CCOC1c2ccccn2 Amb17334611 [0,0,0,1,0,0|3,0,0]=4 1877 B13R2.15 CN1CCOC1c2cccnc2 Amb17334613 [0,0,0,1,0,0|3,0,0]=4 1878 B13R2.15 CN1CCOC1c2ccncc2 Amb17334615 [0,0,0,1,0,0|3,0,0]=4 1879 B13R2.15 C[C@@H]1CCN[C@H]1c2cc[n]cc2 Amb18829582 [0,0,0,1,0,0|3,0,0]=4 1880 B13R2.15 C[C@@H]1CCN[C@H]1c2ccc[n]c2 Amb18829583 [0,0,0,1,0,0|3,0,0]=4 1881 B13R2.15 C[C@@H]1CCN[C@H]1c2cccc[n]2 Amb18829584 [0,0,0,1,0,0|3,0,0]=4 1882 B13R2.15 C[C@@H]1CCN[C@H]1c2ccccc2 Amb18829884 [0,0,0,1,0,0|2,0,0]=3 1883 B13R2.15 C[C@@H]1NCO[C@@H]1c2ccccc2 Amb24550531 [0,0,0,1,0,0|0,0,0]=1 1884 B13R2.15 C[C@H]1CCN[C@@H]1c2cc[n]cc2 Amb25224917 [0,0,0,1,0,0|3,0,0]=4 1885 B13R2.15 C[C@H]1CCN[C@H]1c2ccc[n]c2 Amb25261345 [0,0,0,1,0,0|3,0,0]=4 1886 B13R2.15 C[C@H]1CCN[C@H]1c2ccccc2 Amb24741661 [0,0,0,1,0,0|2,0,0]=3 1887 B13R2.15 C[C@H]1CNC[C@@H]1c2ccccc2 Amb25238338 [0,0,0,1,0,0|3,0,0]=4 1888 B13R2.15 C[C@H]1NCC[C@H]1c2ccccc2 Amb24607383 [0,0,0,1,0,0|1,0,0]=2 1889 B13R2.15 C[C@H]1NCS[C@@H]1c2ccccc2 Amb24512258 [0,0,0,1,0,0|0,1,0]=2 1890 B13R2.15 C[C@H]1NCS[C@H]1c2ccccc2 Amb24664122 [0,0,0,1,0,0|0,1,0]=2 1891 B13R2.15 C[C@H]1OCN[C@@H]1c2cccc[n]2 Amb25366543 [0,0,0,1,0,0|3,0,0]=4 1892 B13R2.15 ClC1CCCC1c2ccccc2 Amb18184968 [0,0,0,1,0,0|3,0,0]=4 1893 B13R2.15 Cl[C@@H]1CCO[C@@H]1c2ccccc2 Amb25242498 [0,0,0,1,0,0|2,0,0]=3 1894 B13R2.15 Cl[C@@H]1CCO[C@H]1c2ccccc2 Amb25210898 [0,0,0,1,0,0|2,0,0]=3 1895 B13R2.15 FC1CCNC1c2ccccc2 Amb25160023 [0,0,0,1,0,0|3,0,0]=4 1896 B13R2.15 NC1CCCC1c2ccccc2 Amb17506307 [0,0,0,1,0,0|3,0,0]=4 1897 B13R2.15 NC1CCNC1c2ccccc2 Amb18829599 [0,0,0,1,0,0|3,0,0]=4 1898 B13R2.15 NC1CCOC1c2ccc[n]c2 Amb24407840 [0,0,0,1,0,0|3,0,0]=4 1899 B13R2.15 NC1CCOC1c2ccccc2 Amb20623662 [0,0,0,1,0,0|2,0,0]=3 1900 B13R2.15 N[C@@H]1CCC[C@@H]1c2ccccc2 Amb22745600 [0,0,0,1,0,0|3,0,0]=4 1901 B13R2.15 N[C@@H]1CCC[C@H]1c2ccccc2 Amb25168925 [0,0,0,1,0,0|3,0,0]=4 1902 B13R2.15 N[C@@H]1CCO[C@H]1c2ccccc2 Amb25289028 [0,0,0,1,0,0|2,0,0]=3 1903 B13R2.15 O=C1NCCC1c2ccccc2 Amb17400090 [0,0,0,1,0,0|2,0,1]=4 1904 B13R2.15 O=C1NCSC1c2ccccc2 Amb24600018 [0,0,0,1,0,0|1,1,1]=4 1905 B13R2.15 O=C1OCOC1c2ccccc2 Amb24497607 [0,0,0,1,0,0|2,0,1]=4 1906 B13R2.15 OC1CCCC1c2ccccc2 Amb18798120 [0,0,0,1,0,0|3,0,0]=4 1907 B13R2.15 OC1CCNC1c2ccccc2 Amb18829239 [0,0,0,1,0,0|3,0,0]=4 1908 B13R2.15 OC1CCOC1c2ccccc2 Amb25722147 [0,0,0,1,0,0|2,0,0]=3 1909 B13R2.15 OC1OCCC1c2ccccc2 Amb22752503 [0,0,0,1,0,0|3,0,0]=4 1910 B13R2.15 O[C@@H]1CCCC1c2ccccc2 Amb25788104 [0,0,0,1,0,0|3,0,0]=4 1911 B13R2.15 O[C@@H]1CCC[C@H]1c2ccccc2 Amb24678146 [0,0,0,1,0,0|3,0,0]=4 1912 B13R2.15 O[C@@H]1CCO[C@H]1c2ccccc2 Amb24515365 [0,0,0,1,0,0|2,0,0]=3 1913 B13R2.15 O[C@H]1CCC[C@@H]1c2ccccc2 Amb25236019 [0,0,0,1,0,0|3,0,0]=4 1914 B13R2.15 O[C@H]1CCO[C@@H]1c2ccccc2 Amb25207791 [0,0,0,1,0,0|2,0,0]=3 1915 B13R2.15 S=C1NCCC1c2ccccc2 Amb25194723 [0,0,0,1,0,0|2,0,1]=4 1916 B13R2.32 C=C1CCc2ccccc2C1O Amb25271992 [0,0,0,1,0,0|1,0,2]=4 1917 B13R2.32 CC1=CCc2ccccc2C1N Amb18645215 [0,0,0,1,0,0|2,0,1]=4 1918 B13R2.32 CC1C(C)CNc2ccccc21 Amb25751543 [0,0,0,1,0,0|3,0,0]=4 1919 B13R2.32 CC1C=Cc2ccccc2C1O Amb25098603 [0,0,0,1,0,0|1,0,1]=3 1920 B13R2.32 CC1CC[13c]2[13cH][13cH][13cH][13cH][13c]2C1=O Amb22055858 [0,0,0,1,0,0|1,0,2]=4 1921 B13R2.32 CC1CCc2c(N1C)cccc2 Amb10563332 [0,0,0,1,0,0|3,0,0]=4 1922 B13R2.32 CC1CCc2ccc[n]c2C1N Amb24656514 [0,0,0,1,0,0|3,0,0]=4 1923 B13R2.32 CC1CCc2ccccc2C1Br Amb25106373 [0,0,0,1,0,0|2,0,0]=3 1924 B13R2.32 CC1CCc2ccccc2C1Cl Amb18186761 [0,0,0,1,0,0|2,0,0]=3 1925 B13R2.32 CC1CCc2ccccc2C1O Amb18800659 [0,0,0,1,0,0|1,0,0]=2 1926 B13R2.32 CC1CCc2ccccc2N1N Amb18829618 [0,0,0,1,0,0|3,0,0]=4 1927 B13R2.32 CC1COc2ccccc2C1Br Amb25833707 [0,0,0,1,0,0|3,0,0]=4 1928 B13R2.32 CC1COc2ccccc2C1Cl Amb24388780 [0,0,0,1,0,0|3,0,0]=4 1929 B13R2.32 CC1COc2ccccc2C1O Amb25074476 [0,0,0,1,0,0|2,0,0]=3 1930 B13R2.32 CC1COc2ccccc2[C@@H]1N Amb24653800 [0,0,0,1,0,0|3,0,0]=4 1931 B13R2.32 CC1CSc2ccccc2C1O Amb25792456 [0,0,0,1,0,0|2,0,0]=3 1932 B13R2.32 CC1NCc2ccccc2C1C Amb25808011 [0,0,0,1,0,0|1,0,0]=2 1933 B13R2.32 CC1NCc2ccccc2C1O Amb25817106 [0,0,0,1,0,0|0,0,0]=1 1934 B13R2.32 CC1OCc2ccccc2C1=O Amb25713025 [0,0,0,1,0,0|1,0,2]=4 1935 B13R2.32 CC1SCc2ccccc2C1=O Amb25767812 [0,0,0,1,0,0|1,0,2]=4 1936 B13R2.32 CC1SCc2ccccc2C1O Amb25836129 [0,0,0,1,0,0|1,0,0]=2 1937 B13R2.32 CN1C=Cc2ccccc2C1O Amb24632116 [0,0,0,1,0,0|2,0,1]=4 1938 B13R2.32 CN1C=Nc2ccccc2C1O Amb25036256 [0,0,0,1,0,0|3,0,0]=4 1939 B13R2.32 CN1N=Nc2ccccc2C1O Amb25284417 [0,0,0,1,0,0|2,0,1]=4 1940 B13R2.32 CN1NCc2ccccc2C1=O Amb24556524 [0,0,0,1,0,0|1,0,2]=4 1941 B13R2.32 C[C@@H]1CCc2ccccc2C1=O Amb25320131 [0,0,0,1,0,0|1,0,2]=4 1942 B13R2.32 C[C@@H]1CCc2ccccc2[C@@H]1O Amb24555476 [0,0,0,1,0,0|1,0,0]=2 1943 B13R2.32 C[C@@H]1COc2ccccc2[C@@H]1O Amb24608063 [0,0,0,1,0,0|2,0,0]=3 1944 B13R2.32 C[C@@H]1COc2ccccc2[C@H]1O Amb25343810 [0,0,0,1,0,0|2,0,0]=3 1945 B13R2.32 C[C@@H]1NCc2ccccc2[C@@H]1C Amb24724526 [0,0,0,1,0,0|1,0,0]=2 1946 B13R2.32 C[C@H]1C=Cc2ccccc2[C@@H]1O Amb25266379 [0,0,0,1,0,0|1,0,1]=3 1947 B13R2.32 C[C@H]1CCc2ccccc2C1=O Amb24378466 [0,0,0,1,0,0|1,0,2]=4 1948 B13R2.32 C[C@H]1NCc2ccccc2[C@H]1C Amb24513026 [0,0,0,1,0,0|1,0,0]=2 1949 B13R2.32 FC1C(Cl)CCc2ccccc21 Amb25685830 [0,0,0,1,0,0|3,0,0]=4 1950 B13R2.32 F[C@@H]1[C@H](Cl)CCc2ccccc21 Amb25179064 [0,0,0,1,0,0|3,0,0]=4 1951 B13R2.32 NC1C(=O)NCc2ccccc21 Amb21857372 [0,0,0,1,0,0|2,0,1]=4 1952 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22436817 [0,0,0,1,0,0|2,0,1]=4 1953 B13R2.32 NC1C(=O)NCc2ccccc21 Amb22491803 [0,0,0,1,0,0|2,0,1]=4 1954 B13R2.32 NC1C(F)CCc2ccccc21 Amb25117934 [0,0,0,1,0,0|3,0,0]=4 1955 B13R2.32 NC1C(I)CCc2ccccc21 Amb25136183 [0,0,0,1,0,0|3,0,0]=4 1956 B13R2.32 NC1C(N)CCc2ccccc21 Amb18645719 [0,0,0,1,0,0|3,0,0]=4 1957 B13R2.32 NC1C(O)CCc2ccccc21 Amb18645888 [0,0,0,1,0,0|3,0,0]=4 1958 B13R2.32 NC1C(O)CCc2ccccc21 Amb22275991 [0,0,0,1,0,0|3,0,0]=4 1959 B13R2.32 NC1C=Cc2ccccc2C1O Amb25751527 [0,0,0,1,0,0|2,0,1]=4 1960 B13R2.32 NC1CCc2[n]cccc2C1O Amb24664115 [0,0,0,1,0,0|3,0,0]=4 1961 B13R2.32 NC1CCc2c(C1O)cccc2 Amb2383071 [0,0,0,1,0,0|2,0,0]=3 1962 B13R2.32 NC1CCc2ccccc2C1O Amb21964517 [0,0,0,1,0,0|2,0,0]=3 1963 B13R2.32 NC1OCc2ccccc2C1O Amb25674826 [0,0,0,1,0,0|2,0,0]=3 1964 B13R2.32 N[C@@H]1CCc2ccccc2[C@H]1O Amb25249079 [0,0,0,1,0,0|2,0,0]=3 1965 B13R2.32 N[C@@H]1[C@@H](O)CCc2ccccc21 Amb22744930 [0,0,0,1,0,0|3,0,0]=4 1966 B13R2.32 N[C@@H]1[C@H](O)CCc2ccccc21 Amb22748703 [0,0,0,1,0,0|3,0,0]=4 1967 B13R2.32 N[C@H]1CCc2ccccc2[C@@H]1O Amb24652537 [0,0,0,1,0,0|2,0,0]=3 1968 B13R2.32 N[C@H]1CCc2ccccc2[C@H]1O Amb25210520 [0,0,0,1,0,0|2,0,0]=3 1969 B13R2.32 N[C@H]1COc2ccccc2[C@H]1O Amb25232002 [0,0,0,1,0,0|3,0,0]=4 1970 B13R2.32 N[C@H]1[C@H](F)CCc2ccccc21 Amb25294343 [0,0,0,1,0,0|3,0,0]=4 1971 B13R2.32 OC1C(=O)OCc2ccccc21 Amb24371200 [0,0,0,1,0,0|2,0,1]=4 1972 B13R2.32 OC1C(Br)COc2ccccc21 Amb25816221 [0,0,0,1,0,0|3,0,0]=4 1973 B13R2.32 OC1C(O)C=Cc2ccccc21 Amb22227709 [0,0,0,1,0,0|2,0,1]=4 1974 B13R2.32 OC1C(O)CCc2[n]cccc21 Amb24362765 [0,0,0,1,0,0|3,0,0]=4 1975 B13R2.32 OC1C(O)CCc2cc[n]cc21 Amb25220531 [0,0,0,1,0,0|3,0,0]=4 1976 B13R2.32 OC1C(S)C=Cc2ccccc21 Amb24419784 [0,0,0,1,0,0|2,0,1]=4 1977 B13R2.32 OC1OCc2ccccc2C1Cl Amb25279566 [0,0,0,1,0,0|3,0,0]=4 1978 B13R2.32 OC1[C@@H](O)CCc2ccccc21 Amb25741467 [0,0,0,1,0,0|2,0,0]=3 1979 B13R2.32 ON1C(=O)NCc2ccccc12 Amb25124767 [0,0,0,1,0,0|2,0,1]=4 1980 B13R2.32 O[C@@H]1CCc2ccccc2[C@@H]1Cl Amb24512123 [0,0,0,1,0,0|3,0,0]=4 1981 B13R2.32 O[C@@H]1CCc2ccccc2[C@@H]1F Amb25346461 [0,0,0,1,0,0|3,0,0]=4 1982 B13R2.32 O[C@@H]1[C@@H](Cl)CCc2ccccc21 Amb24739627 [0,0,0,1,0,0|2,0,0]=3 1983 B13R2.32 O[C@@H]1[C@@H](O)CCc2[n]cccc21 Amb25176723 [0,0,0,1,0,0|3,0,0]=4 1984 B13R2.32 O[C@H]1C=Cc2c([C@@H]1O)cccc2 Amb17613051 [0,0,0,1,0,0|2,0,1]=4 1985 B13R2.32 O[C@H]1CCc2ccccc2[C@@H]1F Amb24520445 [0,0,0,1,0,0|3,0,0]=4 1986 B13R2.32 O[C@H]1[C@@H](Cl)COc2ccccc21 Amb25179042 [0,0,0,1,0,0|3,0,0]=4 1987 B13R2.32 O[C@H]1[C@@H](O)C=Cc2ccccc21 Amb22353072 [0,0,0,1,0,0|2,0,1]=4 1988 B13R2.32 O[C@H]1[C@@H](O)CCc2ccc[n]c21 Amb25345144 [0,0,0,1,0,0|3,0,0]=4 1989 B13R2.32 O[C@H]1[C@@H](O)CCc2ccccc21 Amb22224796 [0,0,0,1,0,0|2,0,0]=3 1990 B13R2.32 O[C@H]1[C@H](O)C=Cc2ccccc21 Amb24501437 [0,0,0,1,0,0|2,0,1]=4 1991 B13R2.32 O[C@H]1[C@H](O)CCc2ccc[n]c21 Amb25101895 [0,0,0,1,0,0|3,0,0]=4 1992 B13R2.32 O[C@H]1[C@H](O)CCc2ccccc21 Amb25250666 [0,0,0,1,0,0|2,0,0]=3 1993 B13R2.32 O[C@H]1[C@H](O)COc2ccccc21 Amb24632117 [0,0,0,1,0,0|3,0,0]=4 1994 B13R2.45 CC1C(CCl)Cc2ccccc21 Amb24634202 [0,0,0,1,0,0|3,0,0]=4 1995 B13R2.45 CC1C(CO)Cc2ccccc21 Amb25832766 [0,0,0,1,0,0|3,0,0]=4 1996 B13R2.45 CCC1Cc2ccc[n]c2C1N Amb24091663 [0,0,0,1,0,0|3,0,0]=4 1997 B13R2.45 CCC1Cc2ccccc2C1Cl Amb18186760 [0,0,0,1,0,0|2,0,0]=3 1998 B13R2.45 CCC1Cc2ccccc2C1N Amb18279401 [0,0,0,1,0,0|2,0,0]=3 1999 B13R2.45 CCC1Cc2ccccc2C1O Amb18800660 [0,0,0,1,0,0|1,0,0]=2 2000 B13R2.45 CCC1Oc2ccccc2C1O Amb24449068 [0,0,0,1,0,0|2,0,0]=3 2001 B13R2.45 CCC1Sc2ccccc2C1N Amb25151112 [0,0,0,1,0,0|3,0,0]=4 2002 B13R2.45 CCN1Cc2ccccc2C1N Amb25073222 [0,0,0,1,0,0|3,0,0]=4 2003 B13R2.45 CC[C@@H]1Cc2ccccc2[C@@H]1O Amb24520334 [0,0,0,1,0,0|1,0,0]=2 2004 B13R2.45 CC[C@@H]1Cc2ccccc2[C@H]1O Amb24544415 [0,0,0,1,0,0|1,0,0]=2 2005 B13R2.45 CC[C@H]1Cc2c(C1=O)cccc2 Amb16232572 [0,0,0,1,0,0|1,0,2]=4 2006 B13R2.45 CC[C@H]1Cc2ccccc2[C@@H]1O Amb24520335 [0,0,0,1,0,0|1,0,0]=2 2007 B13R2.45 CC[C@H]1Cc2ccccc2[C@H]1O Amb24576483 [0,0,0,1,0,0|1,0,0]=2 2008 B13R2.45 CNC1Cc2ccccc2C1Cl Amb25731818 [0,0,0,1,0,0|1,0,0]=2 2009 B13R2.45 CNC1Cc2ccccc2C1N Amb25680007 [0,0,0,1,0,0|1,0,0]=2 2010 B13R2.45 CNC1Cc2ccccc2C1O Amb18645898 [0,0,0,1,0,0|0,0,0]=1 2011 B13R2.45 CN[C@@H]1Cc2ccccc2[C@@H]1Cl Amb25173003 [0,0,0,1,0,0|1,0,0]=2 2012 B13R2.45 CN[C@@H]1Cc2ccccc2[C@H]1O Amb24056611 [0,0,0,1,0,0|0,0,0]=1 2013 B13R2.45 CN[C@H]1Cc2ccccc2[C@@H]1N Amb24680132 [0,0,0,1,0,0|1,0,0]=2 2014 B13R2.45 CN[C@H]1Cc2ccccc2[C@H]1O Amb24540763 [0,0,0,1,0,0|0,0,0]=1 2015 B13R2.45 COC1Cc2c(C1N)cccc2 Amb1140146 [0,0,0,1,0,0|2,0,0]=3 2016 B13R2.45 COC1Cc2ccccc2C1=O Amb24532698 [0,0,0,1,0,0|1,0,2]=4 2017 B13R2.45 COC1Cc2ccccc2C1O Amb18800787 [0,0,0,1,0,0|1,0,0]=2 2018 B13R2.45 CO[C@@H]1Cc2ccccc2[C@@H]1N Amb24519372 [0,0,0,1,0,0|2,0,0]=3 2019 B13R2.45 CO[C@H]1Cc2ccccc2[C@@H]1O Amb24515517 [0,0,0,1,0,0|1,0,0]=2 2020 B13R2.45 CO[C@H]1Cc2ccccc2[C@H]1N Amb24567956 [0,0,0,1,0,0|2,0,0]=3 2021 B13R2.45 CSC1Cc2ccccc2C1Cl Amb25275259 [0,0,0,1,0,0|2,0,0]=3 2022 B13R2.45 CSC1Cc2ccccc2C1N Amb25150959 [0,0,0,1,0,0|2,0,0]=3 2023 B13R2.45 CS[C@H]1Cc2ccccc2[C@@H]1Cl Amb24656132 [0,0,0,1,0,0|2,0,0]=3 2024 B13R2.45 NC1C(CO)Cc2ccccc21 Amb18645892 [0,0,0,1,0,0|3,0,0]=4 2025 B13R2.45 NCC1Oc2ccccc2C1O Amb18828430 [0,0,0,1,0,0|3,0,0]=4 2026 B13R2.45 NNC1Cc2ccccc2C1O Amb24488639 [0,0,0,1,0,0|1,0,0]=2 2027 B13R2.45 N[C@@H]1[C@@H](CO)Cc2ccccc21 Amb24638866 [0,0,0,1,0,0|3,0,0]=4 2028 B13R2.45 OC[C@@H]1Cc2c([C@@H]1N)cccc2 Amb1993948 [0,0,0,1,0,0|3,0,0]=4 2029 B13R2.45 O[C@@H]1[C@H](Cc2ccccc21)CO Amb24574667 [0,0,0,1,0,0|2,0,0]=3 2030 B13R2.45 O\N=C/1\Cc2ccccc2C1O Amb25836020 [0,0,0,1,0,0|1,0,2]=4 2031 B13R2.56 BrCC1CCC1c2ccccc2 Amb23453481 [0,0,0,1,0,0|3,0,0]=4 2032 B13R2.56 CN[C@@H]1CC[C@H]1c2ccccc2 Amb25339675 [0,0,0,1,0,0|1,0,0]=2 2033 B13R2.56 ClCC1CCC1c2ccccc2 Amb25765680 [0,0,0,1,0,0|3,0,0]=4 2034 B13R2.56 NC[C@@H]1CC[C@H]1c2ccccc2 Amb24624474 [0,0,0,1,0,0|3,0,0]=4 2035 B13R2.56 OCC1CCC1c2ccccc2 Amb23453480 [0,0,0,1,0,0|3,0,0]=4 2036 B13R2.56 OC[C@H]1CC[C@H]1c2ccccc2 Amb25271469 [0,0,0,1,0,0|3,0,0]=4 2037 B13R2.98 CC1(C=O)OC1c2ccccc2 Amb25159513 [0,0,0,1,0,0|2,0,0]=3 2038 B13R2.98 CC1(CC1c2ccccc2)C=O Amb25674437 [0,0,0,1,0,0|3,0,0]=4 2039 B13R2.98 CC1(CCl)CC1c2ccccc2 Amb25758625 [0,0,0,1,0,0|3,0,0]=4 2040 B13R2.98 CCC1(N)CC1c2ccccc2 Amb25228204 [0,0,0,1,0,0|3,0,0]=4 2041 B13R2.98 C[C@@]1(CN)C[C@H]1c2ccccc2 Amb24523691 [0,0,0,1,0,0|3,0,0]=4 2042 B13R2.98 C[C@@]1(CO)C[C@@H]1c2ccccc2 Amb24604913 [0,0,0,1,0,0|3,0,0]=4 2043 B13R2.98 C[C@@]1(CO)O[C@H]1c2ccccc2 Amb22388561 [0,0,0,1,0,0|2,0,0]=3 2044 B13R2.98 C[C@@]1(C[C@@H]1c2ccccc2)C=O Amb24460888 [0,0,0,1,0,0|3,0,0]=4 2045 B13R2.98 C[C@@]1(C[C@H]1c2ccccc2)C=O Amb24678176 [0,0,0,1,0,0|3,0,0]=4 2046 B13R2.98 C[C@]1(C=O)O[C@@H]1c2ccccc2 Amb25326822 [0,0,0,1,0,0|2,0,0]=3 2047 B13R2.98 C[C@]1(C=O)O[C@H]1c2ccccc2 Amb24549796 [0,0,0,1,0,0|2,0,0]=3 2048 B13R2.98 C[C@]1(CO)C[C@@H]1c2ccccc2 Amb25206362 [0,0,0,1,0,0|3,0,0]=4 2049 B13R2.98 C[C@]1(CO)C[C@H]1c2ccccc2 Amb24675437 [0,0,0,1,0,0|3,0,0]=4 2050 B13R2.98 C[C@]1(CO)O[C@@H]1c2ccccc2 Amb24607331 [0,0,0,1,0,0|2,0,0]=3 2051 B13R2.98 C[C@]1(CO)O[C@H]1c2ccccc2 Amb24719610 [0,0,0,1,0,0|2,0,0]=3 2052 B13R2.98 C[C@]1(C[C@@H]1c2ccccc2)C=O Amb24589199 [0,0,0,1,0,0|3,0,0]=4 2053 B13R2.98 C[C@]1(C[C@H]1c2ccccc2)C=O Amb24545890 [0,0,0,1,0,0|3,0,0]=4 2054 B13R2.373 CC1C(CC1=O)c2ccccc2 Amb20668234 [0,0,0,1,0,0|3,0,0]=4 2055 B13R2.373 CC1C(N)CC1c2ccccc2 Amb20669477 [0,0,0,1,0,0|3,0,0]=4 2056 B13R2.373 CC1C(N)CC1c2ccccc2 Amb22157239 [0,0,0,1,0,0|3,0,0]=4 2057 B13R2.373 CC1C(NC1=O)c2ccccc2 Amb19149073 [0,0,0,1,0,0|3,0,0]=4 2058 B13R2.373 CC1SC(C1O)c2ccccc2 Amb25317360 [0,0,0,1,0,0|2,1,0]=4 2059 B13R2.373 C[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25206665 [0,0,0,1,0,0|3,0,0]=4 2060 B13R2.373 C[C@H]1[C@@H](CC1=O)c2ccccc2 Amb25263638 [0,0,0,1,0,0|3,0,0]=4 2061 B13R2.382 C=C1CC1C(O)c2ccccc2 Amb22363901 [0,0,0,1,0,0|1,0,1]=3 2062 B13R2.382 C=C1C[C@@H]1C(O)c2ccccc2 Amb25725445 [0,0,0,1,0,0|1,0,1]=3 2063 B13R2.382 CC1CC1C(Br)c2ccccc2 Amb25711666 [0,0,0,1,0,0|2,0,0]=3 2064 B13R2.382 CC1CC1C(Cl)c2ccccc2 Amb18181271 [0,0,0,1,0,0|2,0,0]=3 2065 B13R2.382 CC1CC1C(N)c2ccc[n]c2 Amb24350844 [0,0,0,1,0,0|3,0,0]=4 2066 B13R2.382 CC1CC1C(N)c2ccccc2 Amb19515274 [0,0,0,1,0,0|2,0,0]=3 2067 B13R2.382 CC1CC1C(O)c2ccc[n]c2 Amb25255194 [0,0,0,1,0,0|2,0,0]=3 2068 B13R2.382 CC1CC1C(O)c2ccccc2 Amb18792431 [0,0,0,1,0,0|1,0,0]=2 2069 B13R2.382 CC=1CC1C(O)c2ccccc2 Amb24465590 [0,0,0,1,0,0|1,0,1]=3 2070 B13R2.382 C[C@@H]1C[C@H]1C(=O)c2ccccc2 Amb25273102 [0,0,0,1,0,0|1,0,2]=4 2071 B13R2.382 C[C@H]1O[C@@H]1[C@H](O)c2ccccc2 Amb24580699 [0,0,0,1,0,0|2,0,0]=3 2072 B13R2.413 CC1(CCC1Cl)c2ccccc2 Amb25684847 [0,0,0,1,0,0|3,0,0]=4 2073 B13R2.413 CC1CCC1(N)c2cc[n]cc2 Amb24540374 [0,0,0,1,0,0|3,0,0]=4 2074 B13R2.413 CC1CCC1(O)c2c[n]c[n]c2 Amb25699333 [0,0,0,1,0,0|3,0,0]=4 2075 B13R2.413 CC1CCC1(O)c2c[n]cc[n]2 Amb25759969 [0,0,0,1,0,0|3,0,0]=4 2076 B13R2.413 CC1CCC1(O)c2c[n]ccc2 Amb25721337 [0,0,0,1,0,0|2,0,0]=3 2077 B13R2.413 CC1CCC1(O)c2ccccc2 Amb25073632 [0,0,0,1,0,0|1,0,0]=2 2078 B13R2.413 C[C@H]1NC[C@@]1(O)c2ccccc2 Amb24519309 [0,0,0,1,0,0|0,0,0]=1 2079 B13R2.413 C[C@]1(CC[C@H]1O)c2ccccc2 Amb24558241 [0,0,0,1,0,0|3,0,0]=4 2080 B13R2.413 NC1CCC1(O)c2ccccc2 Amb25674413 [0,0,0,1,0,0|2,0,0]=3 2081 B13R2.413 O=C1NC[C@]1(Cl)c2ccccc2 Amb25159108 [0,0,0,1,0,0|2,0,1]=4 2082 B13R2.413 OC1(CCC1=O)c2ccccc2 Amb25717703 [0,0,0,1,0,0|2,0,1]=4 2083 B13R2.413 OC1(CNC1=O)c2ccccc2 Amb24682843 [0,0,0,1,0,0|1,0,1]=3 2084 B13R2.413 OC1CCC1(O)c2ccccc2 Amb25188176 [0,0,0,1,0,0|2,0,0]=3 2085 B13R2.413 O[C@@]1(CNC1=O)c2ccccc2 Amb24419956 [0,0,0,1,0,0|1,0,1]=3 2086 B13R2.413 O[C@]1(CNC1=O)c2ccccc2 Amb24680220 [0,0,0,1,0,0|1,0,1]=3 2087 B13R2.633 CC1(CC1CBr)c2ccccc2 Amb25141302 [0,0,0,1,0,0|3,0,0]=4 2088 B13R2.633 CC1(CC1CCl)c2ccccc2 Amb24676060 [0,0,0,1,0,0|3,0,0]=4 2089 B13R2.633 CC1(CC1CN)c2ccccc2 Amb18963638 [0,0,0,1,0,0|3,0,0]=4 2090 B13R2.633 CC1(CC1CO)c2ccccc2 Amb23555669 [0,0,0,1,0,0|3,0,0]=4 2091 B13R2.633 CCC1CC1(N)c2ccccc2 Amb24663143 [0,0,0,1,0,0|2,0,0]=3 2092 B13R2.633 CCC1CC1(O)c2c[n]c[n]c2 Amb25759996 [0,0,0,1,0,0|3,0,0]=4 2093 B13R2.633 CCC1CC1(O)c2c[n]cc[n]2 Amb25103836 [0,0,0,1,0,0|3,0,0]=4 2094 B13R2.633 CCC1CC1(O)c2cc[n]c[n]2 Amb25203844 [0,0,0,1,0,0|3,0,0]=4 2095 B13R2.633 CCC1CC1(O)c2cccc[n]2 Amb24406540 [0,0,0,1,0,0|2,0,0]=3 2096 B13R2.633 CCC1CC1(O)c2ccccc2 Amb25720459 [0,0,0,1,0,0|1,0,0]=2 2097 B13R2.633 C[C@@]1(C[C@@H]1CO)c2ccccc2 Amb25227888 [0,0,0,1,0,0|3,0,0]=4 2098 B13R2.633 C[C@@]1(C[C@H]1C=O)c2ccccc2 Amb24573493 [0,0,0,1,0,0|3,0,0]=4 2099 B13R2.633 C[C@@]1(C[C@H]1CO)c2ccccc2 Amb24579436 [0,0,0,1,0,0|3,0,0]=4 2100 B13R2.633 C[C@]1(C[C@@H]1CO)c2ccccc2 Amb25277277 [0,0,0,1,0,0|3,0,0]=4 2101 B13R2.633 C[C@]1(C[C@H]1C=O)c2ccccc2 Amb24744714 [0,0,0,1,0,0|3,0,0]=4 2102 B13R2.633 NC[C@@H]1C[C@]1(F)c2ccccc2 Amb24519147 [0,0,0,1,0,0|3,0,0]=4 2103 B13R2.633 NC[C@H]1C[C@]1(F)c2ccccc2 Amb24519148 [0,0,0,1,0,0|3,0,0]=4 2104 B13R2.633 OC[C@H]1C[C@]1(F)c2ccccc2 Amb25272015 [0,0,0,1,0,0|3,0,0]=4 2105 B13R2.3085 CC1C(=N)N(C)c2ccccc21 Amb22536459 [0,0,0,1,0,0|2,0,1]=4 2106 B13R2.3085 CC1C(=O)N(C)c2ccccc21 Amb24273383 [0,0,0,1,0,0|2,0,1]=4 2107 B13R2.3085 CC1C(Br)c2ccccc2C1C Amb24702860 [0,0,0,1,0,0|2,0,0]=3 2108 B13R2.3085 CC1C(N)C(C)c2ccccc21 Amb18645544 [0,0,0,1,0,0|3,0,0]=4 2109 B13R2.3085 CC1C(N)c2ccccc2C1C Amb24677093 [0,0,0,1,0,0|2,0,0]=3 2110 B13R2.3085 CC1C(N)c2ccccc2S1=O Amb18805328 [0,0,0,1,0,0|3,0,0]=4 2111 B13R2.3085 CC1C(O)c2ccccc2N1C Amb24362737 [0,0,0,1,0,0|0,0,0]=1 2112 B13R2.3085 CN1C(=O)C(Br)c2ccccc12 Amb22749190 [0,0,0,1,0,0|2,0,1]=4 2113 B13R2.3085 CN1C(=O)C(N)c2ccccc12 Amb22586861 [0,0,0,1,0,0|2,0,1]=4 2114 B13R2.3085 CN1C(=O)N(O)c2ccccc12 Amb25174132 [0,0,0,1,0,0|2,0,1]=4 2115 B13R2.3085 CN1C(C)C(C)c2ccccc12 Amb24593827 [0,0,0,1,0,0|1,0,0]=2 2116 B13R2.3085 CN1C(N)C(=O)c2ccccc12 Amb24078928 [0,0,0,1,0,0|1,0,2]=4 2117 B13R2.3085 CN1C(O)N(C)c2ccccc12 Amb25071653 [0,0,0,1,0,0|3,0,0]=4 2118 B13R2.3085 CN1[C@H](C)[C@H](C)c2ccccc12 Amb24433476 [0,0,0,1,0,0|1,0,0]=2 2119 B13R2.3085 C[C@@H]1C(O)[C@@H](C)c2ccccc21 Amb24748340 [0,0,0,1,0,0|3,0,0]=4 2120 B13R2.3085 C[C@@H]1[C@@H](C)c2ccccc2C1=O Amb24736164 [0,0,0,1,0,0|1,0,2]=4 2121 B13R2.3085 C[C@@H]1[C@@H](N)[C@H](C)c2ccccc21 Amb24443864 [0,0,0,1,0,0|3,0,0]=4 2122 B13R2.3085 C[C@@H]1[C@@H](O)[C@H](C)c2ccccc21 Amb24748619 [0,0,0,1,0,0|3,0,0]=4 2123 B13R2.3085 C[C@@H]1[C@@H](O)c2ccccc2C1=O Amb25179777 [0,0,0,1,0,0|2,0,0]=3 2124 B13R2.3085 C[C@H]1[C@@H](O)c2ccccc2C1=O Amb25285739 [0,0,0,1,0,0|2,0,0]=3 2125 B13R2.3085 Cc1c(N)c2ccccc2[n]1C Amb18563503 [0,0,0,1,0,0|1,0,2]=4 2126 B13R2.3085 Cc1c(S)c2ccccc2[n]1C Amb24361774 [0,0,0,1,0,0|0,1,2]=4 2127 B13R2.3085 Cn1c2ccccc2c(c1C)Br Amb17133648 [0,0,0,1,0,0|1,0,2]=4 2128 B13R2.3085 Cn1c2ccccc2c(c1C)I Amb17134454 [0,0,0,1,0,0|1,0,2]=4 2129 B13R2.3085 N=C1N(C)c2c(C1C)cccc2 Amb16210593 [0,0,0,1,0,0|2,0,1]=4 2130 B13R2.3085 NC1C(O)c2ccccc2C1=O Amb25700423 [0,0,0,1,0,0|3,0,0]=4 2131 B13R2.3085 N[n+]1c(C)n(c2c1cccc2)C Amb1032750 [0,0,0,1,0,0|2,0,1]=4 2132 B13R2.3085 O=C1c2ccccc2C(N1C)O Amb1155091 [0,0,0,1,0,0|3,0,0]=4 2133 B13R2.3085 OC1C(Cl)C(=O)c2ccccc21 Amb25101579 [0,0,0,1,0,0|3,0,0]=4 2134 B13R2.3085 OC1C(Cl)C(O)c2ccccc21 Amb25211753 [0,0,0,1,0,0|3,0,0]=4 2135 B13R2.3085 OC1C(O)c2ccccc2C1=O Amb24625369 [0,0,0,1,0,0|3,0,0]=4 2136 B13R2.3085 OC1C(O)c2ccccc2C1O Amb24407560 [0,0,0,1,0,0|3,0,0]=4 2137 B13R2.3085 O[C@@H]1C(=O)N(O)c2ccccc21 Amb24748466 [0,0,0,1,0,0|2,0,1]=4 2138 B13R2.3085 O[C@H]1C(=O)N(O)c2ccccc21 Amb24524815 [0,0,0,1,0,0|2,0,1]=4 2139 B13R2.7350 CCC1(O)C(C)c2ccccc12 Amb17778669 [0,0,0,1,0,0|3,0,0]=4 2140 B13R2.8137 BrC(C1CCC1)c2ccccc2 Amb23590207 [0,0,0,1,0,0|2,0,0]=3 2141 B13R2.8137 ClC(C1CCC1)c2ccccc2 Amb18181272 [0,0,0,1,0,0|2,0,0]=3 2142 B13R2.8137 NC(C1CCC1)c2c[n]ccc2 Amb22642958 [0,0,0,1,0,0|3,0,0]=4 2143 B13R2.8137 NC(C1CCC1)c2cc[n]cc2 Amb22642964 [0,0,0,1,0,0|3,0,0]=4 2144 B13R2.8137 NC(C1CCC1)c2cccc[n]2 Amb22642966 [0,0,0,1,0,0|3,0,0]=4 2145 B13R2.8137 NC(C1CCC1)c2ccccc2 Amb23438851 [0,0,0,1,0,0|2,0,0]=3 2146 B13R2.8137 N[C@@H](C1CCC1)c2ccccc2 Amb23438857 [0,0,0,1,0,0|2,0,0]=3 2147 B13R2.8137 N[C@H](C1CCC1)c2c[n]ccc2 Amb24702315 [0,0,0,1,0,0|3,0,0]=4 2148 B13R2.8137 N[C@H](C1CCC1)c2cccc[n]2 Amb25775975 [0,0,0,1,0,0|3,0,0]=4 2149 B13R2.8137 N[C@H](C1CCC1)c2ccccc2 Amb25824594 [0,0,0,1,0,0|2,0,0]=3 2150 B13R2.8137 OC(C1CCC1)c2[n]ccc[n]2 Amb25154312 [0,0,0,1,0,0|3,0,0]=4 2151 B13R2.8137 OC(C1CCC1)c2c[n]c[n]c2 Amb25751378 [0,0,0,1,0,0|3,0,0]=4 2152 B13R2.8137 OC(C1CCC1)c2cc[n]c[n]2 Amb25777876 [0,0,0,1,0,0|3,0,0]=4 2153 B13R2.8137 OC(C1CCC1)c2cc[n]cc2 Amb25194583 [0,0,0,1,0,0|2,0,0]=3 2154 B13R2.8137 OC(C1CCC1)c2cccc[n]2 Amb25834806 [0,0,0,1,0,0|2,0,0]=3 2155 B13R2.8137 OC(C1CNC1)c2cc[n]cc2 Amb23598812 [0,0,0,1,0,0|3,0,0]=4 2156 B13R2.8137 OC(C1CNC1)c2ccc[n]c2 Amb23598813 [0,0,0,1,0,0|3,0,0]=4 2157 B13R2.8137 OC(C1CNC1)c2cccc[n]2 Amb23598814 [0,0,0,1,0,0|3,0,0]=4 2158 B13R2.8137 OC(c1ccccc1)C2CCC2 Amb17194467 [0,0,0,1,0,0|1,0,0]=2 2159 B13R2.8138 CC(c1ccccc1)C2(O)CC2 Amb24684522 [0,0,0,1,0,0|3,0,0]=4 2160 B13R2.8138 CC1(CC1)C(=O)c2ccccc2 Amb18563491 [0,0,0,1,0,0|1,0,2]=4 2161 B13R2.8138 CC1(CC1)C(N)c2ccccc2 Amb18563532 [0,0,0,1,0,0|2,0,0]=3 2162 B13R2.8138 CC1(CC1)C(O)c2ccccc2 Amb25197789 [0,0,0,1,0,0|1,0,0]=2 2163 B13R2.8138 CC1(CC1)[C@@H](O)c2ccccc2 Amb25734393 [0,0,0,1,0,0|1,0,0]=2 2164 B13R2.8138 CN(c1ccccc1)C2(C)CC2 Amb24096732 [0,0,0,1,0,0|3,0,0]=4 2165 B13R2.8138 C[C@]1(CO1)[C@H](O)c2ccccc2 Amb24520202 [0,0,0,1,0,0|1,0,0]=2 2166 B13R2.8138 NC(c1ccccc1)C2(O)CC2 Amb22236255 [0,0,0,1,0,0|3,0,0]=4 2167 B13R2.8138 NC1(CC1)C(F)c2ccccc2 Amb25270207 [0,0,0,1,0,0|3,0,0]=4 2168 B13R2.8138 NC1(CC1)C(O)c2cccc[n]2 Amb25152596 [0,0,0,1,0,0|3,0,0]=4 2169 B13R2.8138 NC1(CC1)C(O)c2ccccc2 Amb24095286 [0,0,0,1,0,0|2,0,0]=3 2170 B13R2.8138 N[C@@H](c1ccccc1)C2(O)CC2 Amb22225452 [0,0,0,1,0,0|3,0,0]=4 2171 B13R2.8138 N[C@H](c1ccccc1)C2(O)CC2 Amb25682407 [0,0,0,1,0,0|3,0,0]=4 2172 B13R2.8138 OC(c1ccccc1)C2(O)CC2 Amb25847841 [0,0,0,1,0,0|2,0,0]=3 2173 B13R2.15272 CC(NN)C1Cc2ccccc21 Amb24643619 [0,0,0,1,0,0|2,0,0]=3 2174 B13R2.15272 CCC(N)C1Cc2ccccc21 Amb25724412 [0,0,0,1,0,0|3,0,0]=4 2175 B13R2.15272 CC[C@@H](N)C1Cc2ccccc21 Amb24758536 [0,0,0,1,0,0|3,0,0]=4 2176 B13R2.15272 CC[C@H](O)C1Cc2ccccc21 Amb25726263 [0,0,0,1,0,0|3,0,0]=4 2177 B13R2.15272 CNC(=O)[n]1oc2ccccc12 Amb24398815 [0,0,0,1,0,0|2,0,1]=4 2178 B11R1.31 CC(C#N)C(O)c1cc[s]c1 Amb25708810 [0,0,0,0,1,0|3,0,0]=4 2179 B11R1.31 CC(C#N)C(O)c1ccc[s]1 Amb25677657 [0,0,0,0,1,0|3,0,0]=4 2180 B11R1.31 CC(C=O)C(O)c1ccco1 Amb24484903 [0,0,0,0,1,0|3,0,0]=4 2181 B11R1.31 CC(CC)C(Br)c1ccc[s]1 Amb25847361 [0,0,0,0,1,0|3,0,0]=4 2182 B11R1.31 CC(CC)C(Cl)c1ccc[s]1 Amb18324229 [0,0,0,0,1,0|3,0,0]=4 2183 B11R1.31 CC(CC)C(Cl)c1ccco1 Amb24751624 [0,0,0,0,1,0|3,0,0]=4 2184 B11R1.31 CC(CC)C(N)c1c[s]cc1 Amb24447322 [0,0,0,0,1,0|3,0,0]=4 2185 B11R1.31 CC(CC)C(N)c1ccco1 Amb18981668 [0,0,0,0,1,0|3,0,0]=4 2186 B11R1.31 CC(CC)C(O)c1[nH]cc[n]1 Amb24352832 [0,0,0,0,1,0|3,0,0]=4 2187 B11R1.31 CC(CC)C(O)c1[n]cc[s]1 Amb24636655 [0,0,0,0,1,0|3,0,0]=4 2188 B11R1.31 CC(CC)C(O)c1c[nH][n]c1 Amb24724268 [0,0,0,0,1,0|3,0,0]=4 2189 B11R1.31 CC(CC)C(O)c1c[nH]cc1 Amb25794962 [0,0,0,0,1,0|2,0,0]=3 2190 B11R1.31 CC(CC)C(O)c1c[n]c[s]1 Amb24334722 [0,0,0,0,1,0|3,0,0]=4 2191 B11R1.31 CC(CC)C(O)c1c[s]c[n]1 Amb25109594 [0,0,0,0,1,0|3,0,0]=4 2192 B11R1.31 CC(CC)C(O)c1cc[s][n]1 Amb24631830 [0,0,0,0,1,0|3,0,0]=4 2193 B11R1.31 CC(CC)C(O)c1ccc[nH]1 Amb24477503 [0,0,0,0,1,0|2,0,0]=3 2194 B11R1.31 CC(CC)C(O)c1ccc[s]1 Amb18180285 [0,0,0,0,1,0|2,0,0]=3 2195 B11R1.31 CC(CC)C(O)c1ccco1 Amb24403978 [0,0,0,0,1,0|2,0,0]=3 2196 B11R1.31 CC(CC)[C@@H](N)c1c[s]cc1 Amb25202144 [0,0,0,0,1,0|3,0,0]=4 2197 B11R1.31 CC(CC)[C@@H](N)c1ccc[s]1 Amb24542872 [0,0,0,0,1,0|3,0,0]=4 2198 B11R1.31 CC(CC)[C@@H](N)c1ccco1 Amb25302386 [0,0,0,0,1,0|3,0,0]=4 2199 B11R1.31 CC(CC)[C@@H](N)c1cocc1 Amb25258960 [0,0,0,0,1,0|3,0,0]=4 2200 B11R1.31 CC(CC)[C@H](N)c1c[s]cc1 Amb24541995 [0,0,0,0,1,0|3,0,0]=4 2201 B11R1.31 CC(CC)[C@H](N)c1ccco1 Amb24567953 [0,0,0,0,1,0|3,0,0]=4 2202 B11R1.31 CC(CC)[C@H](N)c1cocc1 Amb24542877 [0,0,0,0,1,0|3,0,0]=4 2203 B11R1.31 CC(CN)C(O)c1ccc[nH]1 Amb25062584 [0,0,0,0,1,0|3,0,0]=4 2204 B11R1.31 CC(NC)C(O)c1ccc[s]1 Amb18563963 [0,0,0,0,1,0|1,0,0]=2 2205 B11R1.31 CC(NC)C(O)c1ccco1 Amb24740899 [0,0,0,0,1,0|1,0,0]=2 2206 B11R1.31 CC(OC)C(N)c1c[s]cc1 Amb24354699 [0,0,0,0,1,0|3,0,0]=4 2207 B11R1.31 CC(OC)C(N)c1ccc[nH]1 Amb25704675 [0,0,0,0,1,0|3,0,0]=4 2208 B11R1.31 CC(OC)C(N)c1ccco1 Amb24688712 [0,0,0,0,1,0|3,0,0]=4 2209 B11R1.31 CC(OC)C(N)c1cocc1 Amb25356739 [0,0,0,0,1,0|3,0,0]=4 2210 B11R1.31 CC(OC)C(O)c1c[s]c[n]1 Amb25086930 [0,0,0,0,1,0|3,0,0]=4 2211 B11R1.31 CC(OC)C(O)c1c[s]cc1 Amb25785998 [0,0,0,0,1,0|2,0,0]=3 2212 B11R1.31 CC(OC)C(O)c1ccc[nH]1 Amb25244621 [0,0,0,0,1,0|2,0,0]=3 2213 B11R1.31 CC(OC)C(O)c1ccc[s]1 Amb25790683 [0,0,0,0,1,0|2,0,0]=3 2214 B11R1.31 CCC(C(c1cccs1)O)N Amb17138678 [0,0,0,0,1,0|3,0,0]=4 2215 B11R1.31 CCC(C)C(C)[n]1cccc1 Amb18179411 [0,0,0,0,1,0|3,0,0]=4 2216 B11R1.31 CCC(N)C(O)c1ccco1 Amb18980531 [0,0,0,0,1,0|3,0,0]=4 2217 B11R1.31 CCC(N)C(O)c1ccoc1 Amb24488256 [0,0,0,0,1,0|3,0,0]=4 2218 B11R1.31 CCC(O)C(O)c1ccc[nH]1 Amb24413712 [0,0,0,0,1,0|3,0,0]=4 2219 B11R1.31 CCC(O)C(O)c1ccc[s]1 Amb24334925 [0,0,0,0,1,0|3,0,0]=4 2220 B11R1.31 CCC(O)C(O)c1ccco1 Amb25355032 [0,0,0,0,1,0|3,0,0]=4 2221 B11R1.31 CC[C@@H](N)[C@@H](O)c1cc[s]c1 Amb25209033 [0,0,0,0,1,0|3,0,0]=4 2222 B11R1.31 CC[C@@H](N)[C@@H](O)c1ccoc1 Amb25242653 [0,0,0,0,1,0|3,0,0]=4 2223 B11R1.31 CC[C@H](N)[C@@H](O)c1ccoc1 Amb24541720 [0,0,0,0,1,0|3,0,0]=4 2224 B11R1.31 CC[C@H](O)[C@H](O)c1ccco1 Amb25846997 [0,0,0,0,1,0|3,0,0]=4 2225 B11R1.31 CNC(C)C(=O)c1cc[nH]c1 Amb18065368 [0,0,0,0,1,0|1,0,2]=4 2226 B11R1.31 CNC(C)C(=O)c1cc[s]c1 Amb24460069 [0,0,0,0,1,0|1,0,2]=4 2227 B11R1.31 CNC(C)C(=O)c1ccc[s]1 Amb18563909 [0,0,0,0,1,0|1,0,2]=4 2228 B11R1.31 CNC(C)C(=O)c1ccco1 Amb25104644 [0,0,0,0,1,0|1,0,2]=4 2229 B11R1.31 CNC(C)C(C)[n]1c[n]cc1 Amb18982107 [0,0,0,0,1,0|3,0,0]=4 2230 B11R1.31 CNC(C)C(C)[n]1ccc[n]1 Amb18293732 [0,0,0,0,1,0|3,0,0]=4 2231 B11R1.31 C[C@@H](C#C)[C@@H](O)c1ccco1 Amb25150591 [0,0,0,0,1,0|2,0,1]=4 2232 B11R1.31 C[C@@H](C=C)[C@@H](O)c1ccc[s]1 Amb25204761 [0,0,0,0,1,0|2,0,1]=4 2233 B11R1.31 C[C@@H](C=O)[C@@H](O)c1ccco1 Amb25730816 [0,0,0,0,1,0|3,0,0]=4 2234 B11R1.31 C[C@@H](NC)[C@H](O)c1c[s]cc1 Amb25826694 [0,0,0,0,1,0|1,0,0]=2 2235 B11R1.31 C[C@H](C#C)[C@@H](O)c1ccco1 Amb25332459 [0,0,0,0,1,0|2,0,1]=4 2236 B11R1.31 C[C@H](C=C)[C@H](O)c1ccc[s]1 Amb25149772 [0,0,0,0,1,0|2,0,1]=4 2237 B11R1.31 C[C@H](C=C)[C@H](O)c1ccco1 Amb25357594 [0,0,0,0,1,0|2,0,1]=4 2238 B11R1.31 C[C@H](NC)[C@H](O)c1ccc[s]1 Amb25222576 [0,0,0,0,1,0|1,0,0]=2 2239 B11R1.31 C[C@H](NC)[C@H](O)c1cocc1 Amb25764445 [0,0,0,0,1,0|1,0,0]=2 2240 B13R1.11 C#CC(O)C[C@@H](O)c1ccccc1 Amb24618809 [0,0,0,0,0,1|2,0,1]=4 2241 B13R1.11 CC(CC(C)C=O)c1ccccc1 Amb18127778 [0,0,0,0,0,1|3,0,0]=4 2242 B13R1.11 CC(CC(O)c1ccccc1)=C=C Amb25266831 [0,0,0,0,0,1|1,0,2]=4 2243 B13R1.11 CC(CC(O)c1ccccc1)C#C Amb24688211 [0,0,0,0,0,1|1,0,1]=3 2244 B13R1.11 CC(CO)CC(C)c1ccccc1 Amb22733184 [0,0,0,0,0,1|3,0,0]=4 2245 B13R1.11 CC(NC(C)C#C)c1ccccc1 Amb25858830 [0,0,0,0,0,1|2,0,1]=4 2246 B13R1.11 CC(c1ccccc1)NC(C#N)C Amb17400450 [0,0,0,0,0,1|3,0,0]=4 2247 B13R1.11 CCC(C)NC(=S)c1ccccc1 Amb24754036 [0,0,0,0,0,1|1,1,1]=4 2248 B13R1.11 CC[C@@H](O)C[C@@H](N)c1ccccc1 Amb19929596 [0,0,0,0,0,1|3,0,0]=4 2249 B13R1.11 CC[C@@H](O)C[C@H](N)c1ccccc1 Amb19929595 [0,0,0,0,0,1|3,0,0]=4 2250 B13R1.11 CC[C@H](C)NC(=O)c1ccccc1 Amb24461762 [0,0,0,0,0,1|1,0,2]=4 2251 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb18184205 [0,0,0,0,0,1|2,0,1]=4 2252 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb20631264 [0,0,0,0,0,1|2,0,1]=4 2253 B13R1.11 CNC(=N)N[C@@H](C)c1ccccc1 Amb25152972 [0,0,0,0,0,1|2,0,1]=4 2254 B13R1.11 CNC(=O)C[C@@H](O)c1ccccc1 Amb24490336 [0,0,0,0,0,1|1,0,1]=3 2255 B13R1.11 CNC(=O)C[C@H](C)c1ccccc1 Amb25041089 [0,0,0,0,0,1|2,0,1]=4 2256 B13R1.11 CNC(=O)C[C@H](N)c1ccccc1 Amb24637726 [0,0,0,0,0,1|2,0,1]=4 2257 B13R1.11 CNC(=O)C[C@H](O)c1ccccc1 Amb24444391 [0,0,0,0,0,1|1,0,1]=3 2258 B13R1.11 CNC(=O)NC(C)c1ccccc1 Amb25324528 [0,0,0,0,0,1|2,0,1]=4 2259 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 Amb25040008 [0,0,0,0,0,1|2,0,1]=4 2260 B13R1.11 CNC(=S)N[C@@H](C)c1ccccc1 Amb24414685 [0,0,0,0,0,1|2,0,1]=4 2261 B13R1.11 CNC(=S)\C=C(\O)/c1ccccc1 Amb25270687 [0,0,0,0,0,1|1,0,2]=4 2262 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,0,0,0,0,1|2,0,1]=4 2263 B13R1.11 COC(C)NC(=O)c1ccccc1 Amb24096334 [0,0,0,0,0,1|1,0,2]=4 2264 B13R1.11 C[C@@H](N[C@@H](C)C#N)c1ccccc1 Amb25752018 [0,0,0,0,0,1|3,0,0]=4 2265 B13R1.11 C[C@@H](N[C@H](C)C#C)c1ccccc1 Amb25758951 [0,0,0,0,0,1|2,0,1]=4 2266 B13R1.11 C[C@H](NC(C)C#C)c1ccccc1 Amb25195849 [0,0,0,0,0,1|2,0,1]=4 2267 B13R1.11 C[C@H](N[C@@H](C)C#N)c1ccccc1 Amb24417915 [0,0,0,0,0,1|3,0,0]=4 2268 B13R1.11 C[C@H](N[C@H](C)C#C)c1ccccc1 Amb25041022 [0,0,0,0,0,1|2,0,1]=4 2269 B13R1.11 C[C@H](N[C@H](C)C#N)c1ccccc1 Amb25731977 [0,0,0,0,0,1|3,0,0]=4 2270 B13R1.11 C\C(=C/C(=O)c1ccccc1)\NC Amb24494958 [0,0,0,0,0,1|0,0,3]=4 2271 B13R1.11 C\C(=C/C(C)NC)\c1ccccc1 Amb23555670 [0,0,0,0,0,1|1,0,1]=3 2272 B13R1.11 C\C(=C\C(=O)c1ccccc1)\NC Amb24418806 [0,0,0,0,0,1|0,0,3]=4 2273 B13R1.11 C\C(=C\C(O)c1ccccc1)\C#C Amb25847852 [0,0,0,0,0,1|1,0,2]=4 2274 B13R1.11 C\C(\C=O)=C\C(O)c1ccccc1 Amb24752502 [0,0,0,0,0,1|2,0,1]=4 2275 B13R1.11 C\C(\CC(O)c1ccccc1)=C\C Amb24576542 [0,0,0,0,0,1|1,0,1]=3 2276 B13R1.11 C\C(\CC(O)c1ccccc1)=C\Cl Amb25794461 [0,0,0,0,0,1|2,0,1]=4 2277 B13R1.11 N#CC(CC(c1ccccn1)O)C Amb17335130 [0,0,0,0,0,1|3,0,0]=4 2278 B13R1.11 N#CC(CC(c1cccnc1)O)C Amb17335132 [0,0,0,0,0,1|3,0,0]=4 2279 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,0,0,0,0,1|2,0,1]=4 2280 B13R1.11 NNC(=O)C[C@@H](O)c1ccccc1 Amb24533813 [0,0,0,0,0,1|2,0,1]=4 2281 B13R1.11 OC(c1ccccc1)CC(C#N)C Amb17335052 [0,0,0,0,0,1|2,0,0]=3 2282 B13R1.11 OC(c1ccncc1)CC(C#N)C Amb17335134 [0,0,0,0,0,1|3,0,0]=4 2283 B13R1.135 C#CC(Cl)C(O)Cc1ccccc1 Amb25205081 [0,0,0,0,0,1|2,0,1]=4 2284 B13R1.135 CC(C#N)C(O)Cc1ccccc1 Amb25331719 [0,0,0,0,0,1|2,0,0]=3 2285 B13R1.135 CC(CO)N(O)Cc1ccccc1 Amb25357699 [0,0,0,0,0,1|3,0,0]=4 2286 B13R1.135 CC(NN)C(C)Nc1ccccc1 Amb18648286 [0,0,0,0,0,1|2,0,0]=3 2287 B13R1.135 CC(Nc1ccccc1)C(O)CC Amb25108218 [0,0,0,0,0,1|3,0,0]=4 2288 B13R1.135 CC(OC)C(C)Nc1ccccc1 Amb24355037 [0,0,0,0,0,1|2,0,0]=3 2289 B13R1.135 CC(OC)[C@H](C)Nc1cccc[n]1 Amb24720500 [0,0,0,0,0,1|3,0,0]=4 2290 B13R1.135 CCC(C)C(C)Nc1cc[n]cc1 Amb19016841 [0,0,0,0,0,1|3,0,0]=4 2291 B13R1.135 CCC(C)C(C)Nc1cccc[n]1 Amb19016834 [0,0,0,0,0,1|3,0,0]=4 2292 B13R1.135 CC[C@H](C)C(=O)Nc1ccccc1 Amb24598281 [0,0,0,0,0,1|1,0,2]=4 2293 B13R1.135 CNC(=O)C(Cl)Cc1ccccc1 Amb19083267 [0,0,0,0,0,1|2,0,1]=4 2294 B13R1.135 CNC(=O)C(F)Cc1ccccc1 Amb24343289 [0,0,0,0,0,1|2,0,1]=4 2295 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,0,0,0,0,1|2,0,1]=4 2296 B13R1.135 CNC(=O)[C@@H](C)Cc1ccccc1 Amb25271724 [0,0,0,0,0,1|2,0,1]=4 2297 B13R1.135 CNC(=O)[C@@H](Cc1ccccc1)N Amb10608885 [0,0,0,0,0,1|2,0,1]=4 2298 B13R1.135 CNC(=O)[C@@H](Cl)Cc1ccccc1 Amb25774522 [0,0,0,0,0,1|2,0,1]=4 2299 B13R1.135 CNC(=O)[C@@H](O)Cc1ccccc1 Amb25212856 [0,0,0,0,0,1|1,0,1]=3 2300 B13R1.135 CNC(=O)[C@H](C)Nc1ccccc1 Amb25268956 [0,0,0,0,0,1|2,0,1]=4 2301 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb10878601 [0,0,0,0,0,1|2,0,1]=4 2302 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb15740701 [0,0,0,0,0,1|2,0,1]=4 2303 B13R1.135 CNC(=S)C(C)Cc1ccccc1 Amb24710289 [0,0,0,0,0,1|2,0,1]=4 2304 B13R1.135 CNC(C)C(=O)Nc1cc[n]cc1 Amb18299776 [0,0,0,0,0,1|1,0,2]=4 2305 B13R1.135 CNC(C)C(=O)Nc1ccc[n]c1 Amb18993832 [0,0,0,0,0,1|1,0,2]=4 2306 B13R1.135 CNC(C)C(=O)Nc1cccc[n]1 Amb18993831 [0,0,0,0,0,1|1,0,2]=4 2307 B13R1.135 CNN(C)C(=S)Nc1ccccc1 Amb22468368 [0,0,0,0,0,1|1,1,1]=4 2308 B13R1.135 CN[C@@H](C)C(=O)Nc1ccc[n]c1 Amb24391844 [0,0,0,0,0,1|1,0,2]=4 2309 B13R1.135 COC(=O)C(Cc1ccccc1)O Amb17138951 [0,0,0,0,0,1|2,0,1]=4 2310 B13R1.135 COC(C)C(=O)Nc1ccccc1 Amb24399219 [0,0,0,0,0,1|1,0,2]=4 2311 B13R1.135 CO[C@@H](C)C(=O)Nc1ccccc1 Amb24490481 [0,0,0,0,0,1|1,0,2]=4 2312 B13R1.135 CO[C@H](C)C(=O)Nc1ccccc1 Amb24728406 [0,0,0,0,0,1|1,0,2]=4 2313 B13R1.135 C[C@@H](C#C)[C@@H](O)Cc1ccccc1 Amb24495933 [0,0,0,0,0,1|1,0,1]=3 2314 B13R1.135 C[C@@H](C#C)[C@H](O)Cc1ccccc1 Amb24412155 [0,0,0,0,0,1|1,0,1]=3 2315 B13R1.135 C\C(=C/C)\[C@H](C)Nc1ccccc1 Amb25180843 [0,0,0,0,0,1|2,0,1]=4 2316 B13R1.135 C\C(=C/c1cc[n]cc1)\C(C)NC Amb24349551 [0,0,0,0,0,1|2,0,1]=4 2317 B13R1.135 C\C(=C\C)\C(C)Nc1ccccc1 Amb24743269 [0,0,0,0,0,1|2,0,1]=4 2318 B13R1.135 N#CC(O)C(O)Cc1ccccc1 Amb25091996 [0,0,0,0,0,1|3,0,0]=4 2319 B13R1.135 N#CC(O)[C@@H](O)Cc1ccccc1 Amb25236084 [0,0,0,0,0,1|3,0,0]=4 2320 B13R1.135 N#C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24404786 [0,0,0,0,0,1|3,0,0]=4 2321 B13R1.135 NNC(=O)C(O)Cc1ccccc1 Amb25129792 [0,0,0,0,0,1|2,0,1]=4 2322 B13R1.135 ONC(=O)C(O)Cc1ccccc1 Amb25752983 [0,0,0,0,0,1|2,0,1]=4 2323 B10R0.25 CC(C)C(O)\C(=C\C=C)\C#N Amb18644486 [1,0,1,0,0,0|1,0,1]=4 2324 B10R0.75 CC(C)C(O)C#C\C=C\C=C Amb25356369 [1,0,1,0,0,0|0,0,2]=4 2325 B10R1.15 BrCC(c1ccccc1)O Amb17206105 [2,0,0,0,0,0|1,0,0]=3 2326 B10R1.15 Br[13CH2]C(Br)c1ccccc1 Amb22367266 [2,0,0,0,0,0|2,0,0]=4 2327 B10R1.15 C#C[C@H](O)c1ccccc1 Amb22360907 [2,0,0,0,0,0|0,0,2]=4 2328 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [2,0,0,0,0,0|0,0,2]=4 2329 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [2,0,0,0,0,0|0,0,2]=4 2330 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [2,0,0,0,0,0|0,0,2]=4 2331 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [2,0,0,0,0,0|1,0,0]=3 2332 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [2,0,0,0,0,0|2,0,0]=4 2333 B10R1.15 CCB(N)c1ccccc1 Amb25269618 [2,0,0,0,0,0|2,0,0]=4 2334 B10R1.15 CCB(O)c1ccccc1 Amb25174287 [2,0,0,0,0,0|1,0,0]=3 2335 B10R1.15 CCC(=C)c1ccccc1 Amb22234837 [2,0,0,0,0,0|1,0,1]=4 2336 B10R1.15 CCC(Br)c1c[n]ccc1 Amb24556035 [2,0,0,0,0,0|2,0,0]=4 2337 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [2,0,0,0,0,0|2,0,0]=4 2338 B10R1.15 CCC(Cl)[n+]1ccccc1 Amb24365361 [2,0,0,0,0,0|2,0,0]=4 2339 B10R1.15 CCC(Cl)c1c[n]ccc1 Amb25708334 [2,0,0,0,0,0|2,0,0]=4 2340 B10R1.15 CCC(N)c1cccc[n]1 Amb22587075 [2,0,0,0,0,0|2,0,0]=4 2341 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [2,0,0,0,0,0|1,0,0]=3 2342 B10R1.15 CCC(O)c1c[n]cc[n]1 Amb25064709 [2,0,0,0,0,0|2,0,0]=4 2343 B10R1.15 CCC(c1ccccc1)N Amb1108026 [2,0,0,0,0,0|1,0,0]=3 2344 B10R1.15 CCC(c1ccccn1)N Amb10607917 [2,0,0,0,0,0|2,0,0]=4 2345 B10R1.15 CCC(c1cccnc1)N Amb10607957 [2,0,0,0,0,0|2,0,0]=4 2346 B10R1.15 CCC(c1cccnc1)O Amb17231904 [2,0,0,0,0,0|1,0,0]=3 2347 B10R1.15 CCC(c1ccncc1)O Amb16233288 [2,0,0,0,0,0|1,0,0]=3 2348 B10R1.15 CCN(O)c1ccccc1 Amb25223262 [2,0,0,0,0,0|1,0,0]=3 2349 B10R1.15 CCS(=O)c1ccccc1 Amb22234834 [2,0,0,0,0,0|1,0,1]=4 2350 B10R1.15 CCS(=O)c1ccccc1 Amb22500370 [2,0,0,0,0,0|1,0,1]=4 2351 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb23401519 [2,0,0,0,0,0|2,0,0]=4 2352 B10R1.15 CC[C@@H](N)c1c[n]ccc1 Amb25805543 [2,0,0,0,0,0|2,0,0]=4 2353 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb23401520 [2,0,0,0,0,0|2,0,0]=4 2354 B10R1.15 CC[C@@H](N)c1cc[n]cc1 Amb24744408 [2,0,0,0,0,0|2,0,0]=4 2355 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb23440390 [2,0,0,0,0,0|2,0,0]=4 2356 B10R1.15 CC[C@@H](N)c1cccc[n]1 Amb25797820 [2,0,0,0,0,0|2,0,0]=4 2357 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [2,0,0,0,0,0|1,0,0]=3 2358 B10R1.15 CC[C@@H](O)c1c[n]cc[n]1 Amb24437441 [2,0,0,0,0,0|2,0,0]=4 2359 B10R1.15 CC[C@@H](O)c1cccc[n]1 Amb25717055 [2,0,0,0,0,0|1,0,0]=3 2360 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [2,0,0,0,0,0|2,0,0]=4 2361 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [2,0,0,0,0,0|1,0,0]=3 2362 B10R1.15 CC[C@H](N)c1c[n]ccc1 Amb25277011 [2,0,0,0,0,0|2,0,0]=4 2363 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [2,0,0,0,0,0|1,0,0]=3 2364 B10R1.15 CC[C@H](O)c1c[n]c[n]c1 Amb25087766 [2,0,0,0,0,0|2,0,0]=4 2365 B10R1.15 CC[C@H](O)c1c[n]cc[n]1 Amb25805910 [2,0,0,0,0,0|2,0,0]=4 2366 B10R1.15 CC[C@H](O)c1c[n]ccc1 Amb24432697 [2,0,0,0,0,0|1,0,0]=3 2367 B10R1.15 CC[C@H](O)c1cc[n]c[n]1 Amb25805907 [2,0,0,0,0,0|2,0,0]=4 2368 B10R1.15 CC[S@@](=O)c1ccccc1 Amb22747460 [2,0,0,0,0,0|1,0,1]=4 2369 B10R1.15 CNC(=N)c1ccccc1 Amb23447117 [2,0,0,0,0,0|1,0,1]=4 2370 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [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)c1c[n]ccc1 Amb22587688 [2,0,0,0,0,0|2,0,0]=4 2373 B10R1.15 CNC(C)c1cc[n]cc1 Amb22492289 [2,0,0,0,0,0|2,0,0]=4 2374 B10R1.15 CNC(C)c1cc[n]cc1 Amb22587687 [2,0,0,0,0,0|2,0,0]=4 2375 B10R1.15 CNC(C)c1cccc[n]1 Amb22274428 [2,0,0,0,0,0|2,0,0]=4 2376 B10R1.15 CNC(C)c1cccc[n]1 Amb22587689 [2,0,0,0,0,0|2,0,0]=4 2377 B10R1.15 CNC(c1ccccc1)C Amb1215689 [2,0,0,0,0,0|1,0,0]=3 2378 B10R1.15 CNC(c1ccccn1)C Amb10189608 [2,0,0,0,0,0|2,0,0]=4 2379 B10R1.15 CNC(c1ccccn1)C Amb1115311 [2,0,0,0,0,0|2,0,0]=4 2380 B10R1.15 CNC(c1cccnc1)C Amb10189690 [2,0,0,0,0,0|2,0,0]=4 2381 B10R1.15 CNC(c1cccnc1)C Amb1121577 [2,0,0,0,0,0|2,0,0]=4 2382 B10R1.15 CNC(c1ccncc1)C Amb10189609 [2,0,0,0,0,0|2,0,0]=4 2383 B10R1.15 CNC(c1ccncc1)C Amb1119143 [2,0,0,0,0,0|2,0,0]=4 2384 B10R1.15 CNS(=O)c1ccccc1 Amb24606698 [2,0,0,0,0,0|1,0,1]=4 2385 B10R1.15 CN[C@@H](C)c1cccc[n]1 Amb24744532 [2,0,0,0,0,0|2,0,0]=4 2386 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [2,0,0,0,0,0|1,0,0]=3 2387 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [2,0,0,0,0,0|1,0,0]=3 2388 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [2,0,0,0,0,0|1,0,0]=3 2389 B10R1.15 CN[C@H](C)c1c[n]ccc1 Amb25084519 [2,0,0,0,0,0|2,0,0]=4 2390 B10R1.15 CN[C@H](C)c1cc[n]cc1 Amb25114028 [2,0,0,0,0,0|2,0,0]=4 2391 B10R1.15 COC(C)c1ccccc1 Amb23568513 [2,0,0,0,0,0|2,0,0]=4 2392 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [2,0,0,0,0,0|2,0,0]=4 2393 B10R1.15 COC(O)c1c[n]ccc1 Amb25213606 [2,0,0,0,0,0|2,0,0]=4 2394 B10R1.15 COC(O)c1cccc[n]1 Amb25236210 [2,0,0,0,0,0|2,0,0]=4 2395 B10R1.15 COC(O)c1ccccc1 Amb25225981 [2,0,0,0,0,0|1,0,0]=3 2396 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [2,0,0,0,0,0|2,0,0]=4 2397 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [2,0,0,0,0,0|0,1,0]=3 2398 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [2,0,0,0,0,0|2,0,0]=4 2399 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [2,0,0,0,0,0|2,0,0]=4 2400 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [2,0,0,0,0,0|2,0,0]=4 2401 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [2,0,0,0,0,0|2,0,0]=4 2402 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [2,0,0,0,0,0|2,0,0]=4 2403 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [2,0,0,0,0,0|2,0,0]=4 2404 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [2,0,0,0,0,0|2,0,0]=4 2405 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [2,0,0,0,0,0|2,0,0]=4 2406 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [2,0,0,0,0,0|2,0,0]=4 2407 B10R1.15 ClC(CBr)c1ccccc1 Amb24079929 [2,0,0,0,0,0|2,0,0]=4 2408 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [2,0,0,0,0,0|2,0,0]=4 2409 B10R1.15 ClC[C@@H](c1ccccc1)O Amb16231709 [2,0,0,0,0,0|1,0,0]=3 2410 B10R1.15 ClC[C@@H](c1cccnc1)O Amb16231938 [2,0,0,0,0,0|2,0,0]=4 2411 B10R1.15 ClC[C@H](Cl)c1ccccc1 Amb25131628 [2,0,0,0,0,0|2,0,0]=4 2412 B10R1.15 FC(CBr)c1ccccc1 Amb20075900 [2,0,0,0,0,0|2,0,0]=4 2413 B10R1.15 FCC(Br)c1ccccc1 Amb25366148 [2,0,0,0,0,0|2,0,0]=4 2414 B10R1.15 FCC(Cl)c1ccccc1 Amb25361037 [2,0,0,0,0,0|2,0,0]=4 2415 B10R1.15 FCC(c1ccccc1)N Amb2372575 [2,0,0,0,0,0|2,0,0]=4 2416 B10R1.15 N#C[C@@H](O)c1ccccc1 Amb22744732 [2,0,0,0,0,0|0,0,2]=4 2417 B10R1.15 N#C[C@H](O)c1ccccc1 Amb21618705 [2,0,0,0,0,0|0,0,2]=4 2418 B10R1.15 NC(CBr)c1ccccc1 Amb25690830 [2,0,0,0,0,0|2,0,0]=4 2419 B10R1.15 NC(CI)c1ccccc1 Amb24404731 [2,0,0,0,0,0|2,0,0]=4 2420 B10R1.15 NC(CS)c1ccccc1 Amb25061358 [2,0,0,0,0,0|2,0,0]=4 2421 B10R1.15 NCC(=C)c1ccccc1 Amb10609068 [2,0,0,0,0,0|1,0,1]=4 2422 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [2,0,0,0,0,0|0,0,2]=4 2423 B10R1.15 NCC(Br)c1ccccc1 Amb19516007 [2,0,0,0,0,0|1,0,0]=3 2424 B10R1.15 NCC(F)c1cccc[n]1 Amb24473175 [2,0,0,0,0,0|2,0,0]=4 2425 B10R1.15 NCC(F)c1ccccc1 Amb23454844 [2,0,0,0,0,0|1,0,0]=3 2426 B10R1.15 NCC(N)c1cc[n]cc1 Amb18063802 [2,0,0,0,0,0|2,0,0]=4 2427 B10R1.15 NCC(N)c1ccccc1 Amb21857142 [2,0,0,0,0,0|1,0,0]=3 2428 B10R1.15 NCC(O)c1c[n]c[n]c1 Amb25731161 [2,0,0,0,0,0|2,0,0]=4 2429 B10R1.15 NCC(O)c1cc[n]c[n]1 Amb24434504 [2,0,0,0,0,0|2,0,0]=4 2430 B10R1.15 NCC(O)c1cc[n]cc1 Amb22755845 [2,0,0,0,0,0|1,0,0]=3 2431 B10R1.15 NCC(O)c1cccc[n]1 Amb20622942 [2,0,0,0,0,0|1,0,0]=3 2432 B10R1.15 NCC(O)c1ccccc1 Amb21961704 [2,0,0,0,0,0|0,0,0]=2 2433 B10R1.15 NCC(S)c1ccccc1 Amb18125608 [2,0,0,0,0,0|0,1,0]=3 2434 B10R1.15 NCC(S)c1ccccc1 Amb24106048 [2,0,0,0,0,0|0,1,0]=3 2435 B10R1.15 NCC(c1ccccc1)C Amb1085937 [2,0,0,0,0,0|1,0,0]=3 2436 B10R1.15 NCC(c1ccccc1)O Amb2383121 [2,0,0,0,0,0|0,0,0]=2 2437 B10R1.15 NCC(c1ccccn1)O Amb1109027 [2,0,0,0,0,0|1,0,0]=3 2438 B10R1.15 NCC(c1cccnc1)O Amb10068830 [2,0,0,0,0,0|1,0,0]=3 2439 B10R1.15 NCC(c1cccnc1)O Amb1108854 [2,0,0,0,0,0|1,0,0]=3 2440 B10R1.15 NCC(c1ccncc1)O Amb1108372 [2,0,0,0,0,0|1,0,0]=3 2441 B10R1.15 NC[C@@H](Cl)c1ccccc1 Amb24717355 [2,0,0,0,0,0|1,0,0]=3 2442 B10R1.15 NC[C@@H](F)c1ccccc1 Amb25279947 [2,0,0,0,0,0|1,0,0]=3 2443 B10R1.15 NC[C@@H](N)c1cccc[n]1 Amb25104764 [2,0,0,0,0,0|2,0,0]=4 2444 B10R1.15 NC[C@@H](O)c1c[n]cc[n]1 Amb25370172 [2,0,0,0,0,0|2,0,0]=4 2445 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22744742 [2,0,0,0,0,0|1,0,0]=3 2446 B10R1.15 NC[C@@H](O)c1c[n]ccc1 Amb22748405 [2,0,0,0,0,0|1,0,0]=3 2447 B10R1.15 NC[C@@H](O)c1cc[n]c[n]1 Amb24546069 [2,0,0,0,0,0|2,0,0]=4 2448 B10R1.15 NC[C@@H](O)c1cc[n]cc1 Amb24479579 [2,0,0,0,0,0|1,0,0]=3 2449 B10R1.15 NC[C@@H](O)c1cccc[n]1 Amb25052826 [2,0,0,0,0,0|1,0,0]=3 2450 B10R1.15 NC[C@@H](O)c1ccccc1 Amb24107154 [2,0,0,0,0,0|0,0,0]=2 2451 B10R1.15 NC[C@@H](c1ccccc1)O Amb10070626 [2,0,0,0,0,0|0,0,0]=2 2452 B10R1.15 NC[C@H](F)c1ccccc1 Amb25044881 [2,0,0,0,0,0|1,0,0]=3 2453 B10R1.15 NC[C@H](N)c1c[n]ccc1 Amb24426861 [2,0,0,0,0,0|2,0,0]=4 2454 B10R1.15 NC[C@H](N)c1ccccc1 Amb25757101 [2,0,0,0,0,0|1,0,0]=3 2455 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb23385336 [2,0,0,0,0,0|1,0,0]=3 2456 B10R1.15 NC[C@H](O)c1c[n]ccc1 Amb25127978 [2,0,0,0,0,0|1,0,0]=3 2457 B10R1.15 NC[C@H](O)c1cccc[n]1 Amb24569794 [2,0,0,0,0,0|1,0,0]=3 2458 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [2,0,0,0,0,0|1,0,0]=3 2459 B10R1.15 NNC(O)c1cc[n]cc1 Amb25215180 [2,0,0,0,0,0|2,0,0]=4 2460 B10R1.15 NNC(O)c1ccccc1 Amb25306494 [2,0,0,0,0,0|1,0,0]=3 2461 B10R1.15 NNC(c1ccccc1)C Amb10610271 [2,0,0,0,0,0|2,0,0]=4 2462 B10R1.15 NOC(c1ccccc1)C Amb17089185 [2,0,0,0,0,0|2,0,0]=4 2463 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887019 [2,0,0,0,0,0|2,0,0]=4 2464 B10R1.15 N[C@@H](CF)c1ccccc1 Amb22887020 [2,0,0,0,0,0|2,0,0]=4 2465 B10R1.15 N[C@@H](CS)c1ccccc1 Amb25689822 [2,0,0,0,0,0|2,0,0]=4 2466 B10R1.15 N[C@H](CBr)c1ccccc1 Amb24391587 [2,0,0,0,0,0|2,0,0]=4 2467 B10R1.15 N[C@H](CS)c1ccccc1 Amb25111122 [2,0,0,0,0,0|2,0,0]=4 2468 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [2,0,0,0,0,0|1,0,1]=4 2469 B10R1.15 OC(CBr)c1c[n]ccc1 Amb24641581 [2,0,0,0,0,0|2,0,0]=4 2470 B10R1.15 OC(CBr)c1cc[n]cc1 Amb24099591 [2,0,0,0,0,0|2,0,0]=4 2471 B10R1.15 OC(CF)c1cccc[n]1 Amb25136249 [2,0,0,0,0,0|2,0,0]=4 2472 B10R1.15 OC(CF)c1ccccc1 Amb22731897 [2,0,0,0,0,0|1,0,0]=3 2473 B10R1.15 OCC(F)c1ccccc1 Amb24105399 [2,0,0,0,0,0|2,0,0]=4 2474 B10R1.15 OCC(O)c1c[n]ccc1 Amb23538717 [2,0,0,0,0,0|2,0,0]=4 2475 B10R1.15 OCC(O)c1cc[n]cc1 Amb23538718 [2,0,0,0,0,0|2,0,0]=4 2476 B10R1.15 OCC(S)c1ccccc1 Amb25333535 [2,0,0,0,0,0|1,1,0]=4 2477 B10R1.15 OC[C@@H](Br)c1ccccc1 Amb25770108 [2,0,0,0,0,0|2,0,0]=4 2478 B10R1.15 OC[C@@H](Cl)c1ccccc1 Amb24417788 [2,0,0,0,0,0|2,0,0]=4 2479 B10R1.15 OC[C@@H](F)c1ccccc1 Amb25320636 [2,0,0,0,0,0|2,0,0]=4 2480 B10R1.15 OC[C@@H](S)c1ccccc1 Amb24504991 [2,0,0,0,0,0|1,1,0]=4 2481 B10R1.15 OC[C@H](O)c1c[n]ccc1 Amb24433399 [2,0,0,0,0,0|2,0,0]=4 2482 B10R1.15 OC[C@H](O)c1cc[n]cc1 Amb25831641 [2,0,0,0,0,0|2,0,0]=4 2483 B10R1.15 ONC(c1ccccc1)C Amb10605006 [2,0,0,0,0,0|2,0,0]=4 2484 B10R1.15 O[C@@H](CBr)c1cc[n]cc1 Amb24479572 [2,0,0,0,0,0|2,0,0]=4 2485 B10R1.15 O[C@@H](CBr)c1ccccc1 Amb19929326 [2,0,0,0,0,0|1,0,0]=3 2486 B10R1.15 O[C@@H](CCl)c1cc[n]cc1 Amb24479576 [2,0,0,0,0,0|2,0,0]=4 2487 B10R1.15 O[C@@H](CF)c1ccccc1 Amb24389146 [2,0,0,0,0,0|1,0,0]=3 2488 B10R1.15 O[C@@H](CI)c1ccccc1 Amb25738089 [2,0,0,0,0,0|1,0,0]=3 2489 B10R1.15 O[C@@H](c1ccccc1)C#C Amb10844978 [2,0,0,0,0,0|0,0,2]=4 2490 B10R1.15 O[C@H](CBr)c1c[n]ccc1 Amb24419839 [2,0,0,0,0,0|2,0,0]=4 2491 B10R1.15 O[C@H](CBr)c1cc[n]cc1 Amb24467759 [2,0,0,0,0,0|2,0,0]=4 2492 B10R1.15 O[C@H](CBr)c1ccccc1 Amb19929329 [2,0,0,0,0,0|1,0,0]=3 2493 B10R1.15 O[C@H](CCl)c1cccc[n]1 Amb24462750 [2,0,0,0,0,0|2,0,0]=4 2494 B10R1.15 O[C@H](CF)c1ccccc1 Amb24437736 [2,0,0,0,0,0|1,0,0]=3 2495 B10R1.15 SCC(c1ccccc1)O Amb10608997 [2,0,0,0,0,0|1,0,0]=3 2496 B10R1.17 Br[Mg]CCc1ccccc1 Amb22000585 [2,0,0,0,0,0|2,0,0]=4 2497 B10R1.17 Br[Zn]CCc1ccccc1 Amb22000434 [2,0,0,0,0,0|2,0,0]=4 2498 B10R1.17 CCCCc1ccccn1 Amb10574134 [2,0,0,0,0,0|2,0,0]=4 2499 B10R1.17 CCCCc1ccncc1 Amb10555008 [2,0,0,0,0,0|2,0,0]=4 2500 B10R1.17 CCCNc1ccccc1 Amb22284540 [2,0,0,0,0,0|2,0,0]=4 2501 B10R1.17 CN/N=C/c1ccccc1 Amb17867553 [2,0,0,0,0,0|1,0,1]=4 2502 B10R1.17 CNCCc1c[n]cc[n]1 Amb22059364 [2,0,0,0,0,0|2,0,0]=4 2503 B10R1.17 CNCCc1cc[n]cc1 Amb19958269 [2,0,0,0,0,0|1,0,0]=3 2504 B10R1.17 CNCCc1cccc[n]1 Amb22167479 [2,0,0,0,0,0|1,0,0]=3 2505 B10R1.17 CNCCc1ccccc1 Amb1132990 [2,0,0,0,0,0|0,0,0]=2 2506 B10R1.17 CNCCc1ccccc1 Amb2119452 [2,0,0,0,0,0|0,0,0]=2 2507 B10R1.17 CNCCc1ccccn1 Amb1651624 [2,0,0,0,0,0|1,0,0]=3 2508 B10R1.17 CNCCc1cccnc1 Amb10068754 [2,0,0,0,0,0|1,0,0]=3 2509 B10R1.17 CNCCc1cccnc1 Amb10576212 [2,0,0,0,0,0|1,0,0]=3 2510 B10R1.17 CNCCc1cccnc1 Amb10576410 [2,0,0,0,0,0|1,0,0]=3 2511 B10R1.17 CNCCc1ccncc1 Amb10071184 [2,0,0,0,0,0|1,0,0]=3 2512 B10R1.17 CNNCc1c[n]ccc1 Amb24558769 [2,0,0,0,0,0|2,0,0]=4 2513 B10R1.17 CNNCc1ccccc1 Amb10553073 [2,0,0,0,0,0|1,0,0]=3 2514 B10R1.17 CNOCc1ccccc1 Amb22059601 [2,0,0,0,0,0|1,0,0]=3 2515 B10R1.17 CN\C=N\c1ccccc1 Amb25348617 [2,0,0,0,0,0|1,0,1]=4 2516 B10R1.17 CN\N=N\c1ccccc1 Amb25720206 [2,0,0,0,0,0|2,0,0]=4 2517 B10R1.17 COCC[n+]1ccccc1 Amb10554471 [2,0,0,0,0,0|2,0,0]=4 2518 B10R1.17 COCCc1cccc[n]1 Amb24089662 [2,0,0,0,0,0|2,0,0]=4 2519 B10R1.17 COCNc1ccccc1 Amb10565397 [2,0,0,0,0,0|2,0,0]=4 2520 B10R1.17 CSCCc1cccc[n]1 Amb24552366 [2,0,0,0,0,0|2,0,0]=4 2521 B10R1.17 CSCCc1ccncc1 Amb1864660 [2,0,0,0,0,0|2,0,0]=4 2522 B10R1.17 CSCOc1ccccc1 Amb22231357 [2,0,0,0,0,0|2,0,0]=4 2523 B10R1.17 CSCSc1ccccc1 Amb25162526 [2,0,0,0,0,0|2,0,0]=4 2524 B10R1.17 CSSCc1ccccc1 Amb22230274 [2,0,0,0,0,0|2,0,0]=4 2525 B10R1.17 Cl[Mg]CCc1ccccc1 Amb22338391 [2,0,0,0,0,0|2,0,0]=4 2526 B10R1.17 FCCCc1ccccc1 Amb25737014 [2,0,0,0,0,0|2,0,0]=4 2527 B10R1.17 ICCCc1ccccc1 Amb10605506 [2,0,0,0,0,0|2,0,0]=4 2528 B10R1.17 NCCCc1ccccc1 Amb22490482 [2,0,0,0,0,0|2,0,0]=4 2529 B10R1.17 NNCCc1c[n]ccc1 Amb22491198 [2,0,0,0,0,0|2,0,0]=4 2530 B10R1.17 NNCCc1cccc[n]1 Amb20669588 [2,0,0,0,0,0|2,0,0]=4 2531 B10R1.17 NNCCc1ccccc1 Amb10608987 [2,0,0,0,0,0|1,0,0]=3 2532 B10R1.17 NNCCc1ccccc1 Amb1117029 [2,0,0,0,0,0|1,0,0]=3 2533 B10R1.17 ONCCc1ccccc1 Amb24117032 [2,0,0,0,0,0|1,0,0]=3 2534 B10R1.17 [C-]#[N+]CCc1ccccc1 Amb1981030 [2,0,0,0,0,0|0,0,2]=4 2535 B10R1.17 [SiH3]CCCc1ccccc1 Amb22347053 [2,0,0,0,0,0|1,1,0]=4 2536 B10R1.18 CC(Br)Cc1cc[n]cc1 Amb25208255 [2,0,0,0,0,0|2,0,0]=4 2537 B10R1.18 CC(C)Cc1c[n]ccc1 Amb22043313 [2,0,0,0,0,0|1,0,0]=3 2538 B10R1.18 CC(C)Cc1cc[n]c[n]1 Amb24070388 [2,0,0,0,0,0|2,0,0]=4 2539 B10R1.18 CC(C)Cc1cc[n]cc1 Amb22353758 [2,0,0,0,0,0|1,0,0]=3 2540 B10R1.18 CC(C)Oc1c[n]ccc1 Amb22898896 [2,0,0,0,0,0|2,0,0]=4 2541 B10R1.18 CC(C)Oc1cc[n]cc1 Amb20242496 [2,0,0,0,0,0|2,0,0]=4 2542 B10R1.18 CC(C)Oc1cccc[n]1 Amb22304705 [2,0,0,0,0,0|2,0,0]=4 2543 B10R1.18 CC(C)Sc1cc[n]cc1 Amb24380560 [2,0,0,0,0,0|2,0,0]=4 2544 B10R1.18 CC(C)Sc1cccc[n]1 Amb25130337 [2,0,0,0,0,0|2,0,0]=4 2545 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [2,0,0,0,0,0|0,0,0]=2 2546 B10R1.18 CC(Cc1ccccn1)C Amb15691003 [2,0,0,0,0,0|1,0,0]=3 2547 B10R1.18 CC(Cc1ccccn1)Cl Amb17477796 [2,0,0,0,0,0|2,0,0]=4 2548 B10R1.18 CC(Cc1ccccn1)N Amb1995149 [2,0,0,0,0,0|1,0,0]=3 2549 B10R1.18 CC(Cc1ccccn1)O Amb1995148 [2,0,0,0,0,0|2,0,0]=4 2550 B10R1.18 CC(Cc1cccnc1)Cl Amb17477798 [2,0,0,0,0,0|2,0,0]=4 2551 B10R1.18 CC(Cc1cccnc1)O Amb17477790 [2,0,0,0,0,0|2,0,0]=4 2552 B10R1.18 CC(Cc1ccncc1)Cl Amb17477797 [2,0,0,0,0,0|2,0,0]=4 2553 B10R1.18 CC(Cc1ccncc1)O Amb17477789 [2,0,0,0,0,0|2,0,0]=4 2554 B10R1.18 CC(Cc1cnccn1)N Amb1995174 [2,0,0,0,0,0|2,0,0]=4 2555 B10R1.18 CC(Cc1nccnc1)N Amb10609115 [2,0,0,0,0,0|2,0,0]=4 2556 B10R1.18 CC(Cc1nccnc1)N Amb10609131 [2,0,0,0,0,0|2,0,0]=4 2557 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [2,0,0,0,0,0|1,0,0]=3 2558 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [2,0,0,0,0,0|2,0,0]=4 2559 B10R1.18 CC(Cl)Sc1ccccc1 Amb17673697 [2,0,0,0,0,0|2,0,0]=4 2560 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [2,0,0,0,0,0|1,0,0]=3 2561 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [2,0,0,0,0,0|1,0,1]=4 2562 B10R1.18 CC(N)CC=1C=CCCC1 Amb21962869 [2,0,0,0,0,0|0,0,2]=4 2563 B10R1.18 CC(N)Cc1[n]ccc[n]1 Amb18064016 [2,0,0,0,0,0|2,0,0]=4 2564 B10R1.18 CC(N)Cc1c[n]ccc1 Amb21972219 [2,0,0,0,0,0|1,0,0]=3 2565 B10R1.18 CC(N)Cc1cc[n]c[n]1 Amb18285236 [2,0,0,0,0,0|2,0,0]=4 2566 B10R1.18 CC(N)Cc1cc[n]cc1 Amb21972220 [2,0,0,0,0,0|1,0,0]=3 2567 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [2,0,0,0,0,0|0,0,0]=2 2568 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [2,0,0,0,0,0|0,0,0]=2 2569 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [2,0,0,0,0,0|1,0,0]=3 2570 B10R1.18 CC(Nc1ccccn1)C Amb1104052 [2,0,0,0,0,0|2,0,0]=4 2571 B10R1.18 CC(Nc1cccnc1)C Amb16231494 [2,0,0,0,0,0|2,0,0]=4 2572 B10R1.18 CC(Nc1cccnc1)C Amb2382996 [2,0,0,0,0,0|2,0,0]=4 2573 B10R1.18 CC(Nc1ccncc1)C Amb16231495 [2,0,0,0,0,0|2,0,0]=4 2574 B10R1.18 CC(Nc1ccncc1)C Amb2383009 [2,0,0,0,0,0|2,0,0]=4 2575 B10R1.18 CC(O)Sc1ccccc1 Amb25045636 [2,0,0,0,0,0|2,0,0]=4 2576 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [2,0,0,0,0,0|1,0,0]=3 2577 B10R1.18 CN(C)Cc1cc[n]cc1 Amb20247602 [2,0,0,0,0,0|2,0,0]=4 2578 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [2,0,0,0,0,0|1,0,0]=3 2579 B10R1.18 CN(C)Nc1ccccc1 Amb25810299 [2,0,0,0,0,0|2,0,0]=4 2580 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [2,0,0,0,0,0|2,0,0]=4 2581 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [2,0,0,0,0,0|1,0,0]=3 2582 B10R1.18 C[C@@H](N)Cc1c[n]cc[n]1 Amb25127231 [2,0,0,0,0,0|2,0,0]=4 2583 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [2,0,0,0,0,0|0,0,0]=2 2584 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [2,0,0,0,0,0|0,0,0]=2 2585 B10R1.18 C[C@@H](O)Cc1c[n]ccc1 Amb22896922 [2,0,0,0,0,0|2,0,0]=4 2586 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [2,0,0,0,0,0|1,0,0]=3 2587 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [2,0,0,0,0,0|0,0,0]=2 2588 B10R1.18 C[C@H](N)Cc1c[n]cc[n]1 Amb24360532 [2,0,0,0,0,0|2,0,0]=4 2589 B10R1.18 C[C@H](N)Cc1cccc[n]1 Amb24451425 [2,0,0,0,0,0|1,0,0]=3 2590 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [2,0,0,0,0,0|0,1,0]=3 2591 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [2,0,0,0,0,0|0,1,0]=3 2592 B10R1.18 ClC(Cl)Cc1ccccc1 Amb25783924 [2,0,0,0,0,0|2,0,0]=4 2593 B10R1.18 FC(F)Cc1ccccc1 Amb19894546 [2,0,0,0,0,0|2,0,0]=4 2594 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [2,0,0,0,0,0|1,0,1]=4 2595 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [2,0,0,0,0,0|1,0,1]=4 2596 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [2,0,0,0,0,0|1,0,0]=3 2597 B10R1.18 NS(=N)Cc1ccccc1 Amb25258845 [2,0,0,0,0,0|2,0,0]=4 2598 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [2,0,0,0,0,0|1,0,0]=3 2599 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [2,0,0,0,0,0|1,0,0]=3 2600 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [2,0,0,0,0,0|2,0,0]=4 2601 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [2,0,0,0,0,0|2,0,0]=4 2602 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [1,1,0,0,0,0|2,0,0]=4 2603 B12R1.3 CCCC(c1ccccc1)C=O Amb17594046 [1,1,0,0,0,0|1,0,1]=4 2604 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [1,1,0,0,0,0|2,0,0]=4 2605 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [1,1,0,0,0,0|2,0,0]=4 2606 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [1,1,0,0,0,0|1,0,0]=3 2607 B12R1.3 CCCC(c1ccccc1)NO Amb10605018 [1,1,0,0,0,0|1,0,0]=3 2608 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [1,1,0,0,0,0|2,0,0]=4 2609 B12R1.3 CNCC(c1ccccc1)OC Amb17605856 [1,1,0,0,0,0|0,0,0]=2 2610 B12R1.3 COC(CC#N)c1ccccc1 Amb18797978 [1,1,0,0,0,0|2,0,0]=4 2611 B12R1.3 COCC(C#N)c1ccccc1 Amb25728276 [1,1,0,0,0,0|2,0,0]=4 2612 B12R1.3 C\C=C\C(CO)c1ccccc1 Amb24431887 [1,1,0,0,0,0|1,0,1]=4 2613 B12R1.3 C\C=N\C(CO)c1ccccc1 Amb25038797 [1,1,0,0,0,0|2,0,0]=4 2614 B12R1.3 C\C=N\[C@@H](CO)c1ccccc1 Amb25236547 [1,1,0,0,0,0|2,0,0]=4 2615 B12R1.3 NCCC(c1ccccc1)OC Amb17334641 [1,1,0,0,0,0|2,0,0]=4 2616 B12R1.16 C#CCC(O)c1ccc(Cl)cc1 Amb18186756 [1,1,0,0,0,0|1,0,1]=4 2617 B12R1.16 C#CCC(O)c1ccc(F)cc1 Amb18800772 [1,1,0,0,0,0|1,0,1]=4 2618 B12R1.16 C#CCC(O)c1ccc(O)cc1 Amb18117920 [1,1,0,0,0,0|1,0,1]=4 2619 B12R1.16 C#CC[C@@H](O)c1ccc(F)cc1 Amb24100212 [1,1,0,0,0,0|1,0,1]=4 2620 B12R1.16 C#CC[C@H](O)c1ccc(Cl)cc1 Amb24705595 [1,1,0,0,0,0|1,0,1]=4 2621 B12R1.16 C#CC[C@H](O)c1ccc(F)cc1 Amb25136315 [1,1,0,0,0,0|1,0,1]=4 2622 B12R1.16 C=CCC(O)c1ccc(F)cc1 Amb18788452 [1,1,0,0,0,0|1,0,1]=4 2623 B12R1.16 C=CCC(O)c1ccc(I)cc1 Amb24384870 [1,1,0,0,0,0|1,0,1]=4 2624 B12R1.16 C=CCC(O)c1ccc(O)cc1 Amb18646044 [1,1,0,0,0,0|1,0,1]=4 2625 B12R1.16 C=CC[C@H](O)c1ccc(Cl)cc1 Amb25114679 [1,1,0,0,0,0|1,0,1]=4 2626 B12R1.16 C=CC[C@H](O)c1ccc(O)cc1 Amb24532744 [1,1,0,0,0,0|1,0,1]=4 2627 B12R1.16 CC#CC(O)c1ccc(Br)cc1 Amb25036422 [1,1,0,0,0,0|1,0,1]=4 2628 B12R1.16 CCCC(Br)c1ccc(Cl)cc1 Amb25281165 [1,1,0,0,0,0|2,0,0]=4 2629 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [1,1,0,0,0,0|2,0,0]=4 2630 B12R1.16 CCCC(N)c1ccc(Cl)cc1 Amb20626143 [1,1,0,0,0,0|2,0,0]=4 2631 B12R1.16 CCCC(N)c1ccc(I)cc1 Amb25118824 [1,1,0,0,0,0|2,0,0]=4 2632 B12R1.16 CCCC(N)c1ccc(O)cc1 Amb18939625 [1,1,0,0,0,0|2,0,0]=4 2633 B12R1.16 CCCC(O)c1c[n]c(N)cc1 Amb24532792 [1,1,0,0,0,0|2,0,0]=4 2634 B12R1.16 CCCC(O)c1ccc(Cl)c[n]1 Amb25152356 [1,1,0,0,0,0|2,0,0]=4 2635 B12R1.16 CCCC(O)c1ccc(F)c[n]1 Amb24417756 [1,1,0,0,0,0|2,0,0]=4 2636 B12R1.16 CCCC(O)c1ccc(N)cc1 Amb24619836 [1,1,0,0,0,0|1,0,0]=3 2637 B12R1.16 CCCC(c1ccc(cc1)Br)Cl Amb17160235 [1,1,0,0,0,0|2,0,0]=4 2638 B12R1.16 CCCC(c1ccc(cc1)C)Cl Amb17139051 [1,1,0,0,0,0|2,0,0]=4 2639 B12R1.16 CCCC(c1ccc(cc1)Cl)Cl Amb17139906 [1,1,0,0,0,0|2,0,0]=4 2640 B12R1.16 CCCC(c1ccc(cc1)F)Cl Amb17139162 [1,1,0,0,0,0|2,0,0]=4 2641 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [1,1,0,0,0,0|2,0,0]=4 2642 B12R1.16 CCC[C@@H](N)c1ccc(Br)cc1 Amb24729386 [1,1,0,0,0,0|2,0,0]=4 2643 B12R1.16 CCC[C@@H](N)c1ccc(Cl)cc1 Amb25043269 [1,1,0,0,0,0|2,0,0]=4 2644 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22298535 [1,1,0,0,0,0|2,0,0]=4 2645 B12R1.16 CCC[C@@H](N)c1ccc(F)cc1 Amb22744980 [1,1,0,0,0,0|2,0,0]=4 2646 B12R1.16 CCC[C@@H](N)c1ccc(I)cc1 Amb25195840 [1,1,0,0,0,0|2,0,0]=4 2647 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb22288661 [1,1,0,0,0,0|2,0,0]=4 2648 B12R1.16 CCC[C@@H](N)c1ccc(N)cc1 Amb25149895 [1,1,0,0,0,0|2,0,0]=4 2649 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb22288662 [1,1,0,0,0,0|2,0,0]=4 2650 B12R1.16 CCC[C@@H](N)c1ccc(O)cc1 Amb25063010 [1,1,0,0,0,0|2,0,0]=4 2651 B12R1.16 CCC[C@@H](O)c1ccc(Br)cc1 Amb25069849 [1,1,0,0,0,0|1,0,0]=3 2652 B12R1.16 CCC[C@@H](O)c1ccc(Cl)c[n]1 Amb25047962 [1,1,0,0,0,0|2,0,0]=4 2653 B12R1.16 CCC[C@@H](O)c1ccc(F)c[n]1 Amb25795724 [1,1,0,0,0,0|2,0,0]=4 2654 B12R1.16 CCC[C@@H](O)c1ccc(F)cc1 Amb24404009 [1,1,0,0,0,0|1,0,0]=3 2655 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb22298578 [1,1,0,0,0,0|2,0,0]=4 2656 B12R1.16 CCC[C@H](N)c1ccc(F)cc1 Amb24700451 [1,1,0,0,0,0|2,0,0]=4 2657 B12R1.16 CCC[C@H](N)c1ccc(I)cc1 Amb25337897 [1,1,0,0,0,0|2,0,0]=4 2658 B12R1.16 CCC[C@H](N)c1ccc(N)cc1 Amb22288706 [1,1,0,0,0,0|2,0,0]=4 2659 B12R1.16 CCC[C@H](N)c1ccc(O)cc1 Amb22288707 [1,1,0,0,0,0|2,0,0]=4 2660 B12R1.16 CCC[C@H](N)c1ccc(S)cc1 Amb24341710 [1,1,0,0,0,0|2,0,0]=4 2661 B12R1.16 CCC[C@H](O)c1ccc(Cl)cc1 Amb24483363 [1,1,0,0,0,0|1,0,0]=3 2662 B12R1.16 CCC[C@H](O)c1ccc(F)cc1 Amb24576719 [1,1,0,0,0,0|1,0,0]=3 2663 B12R1.16 CNCC(=C)c1ccc(O)cc1 Amb24727996 [1,1,0,0,0,0|1,0,1]=4 2664 B12R1.16 CNCC(=O)c1ccc(F)cc1 Amb24121219 [1,1,0,0,0,0|0,0,2]=4 2665 B12R1.16 CNCC(=O)c1ccc(N)cc1 Amb18550919 [1,1,0,0,0,0|0,0,2]=4 2666 B12R1.16 CNCC(=O)c1ccc(cc1)Br Amb17248090 [1,1,0,0,0,0|0,0,2]=4 2667 B12R1.16 CNCC(=O)c1ccc(cc1)C Amb17232427 [1,1,0,0,0,0|0,0,2]=4 2668 B12R1.16 CNCC(=O)c1ccc(cc1)F Amb17232631 [1,1,0,0,0,0|0,0,2]=4 2669 B12R1.16 CNCC(=O)c1ccc(cc1)O Amb1075808 [1,1,0,0,0,0|0,0,2]=4 2670 B12R1.16 CNCC(C)c1ccc(N)cc1 Amb24355889 [1,1,0,0,0,0|1,0,0]=3 2671 B12R1.16 CNCC(O)c1ccc(Br)c[n]1 Amb23586103 [1,1,0,0,0,0|1,0,0]=3 2672 B12R1.16 CNCC(O)c1ccc(F)cc1 Amb19373245 [1,1,0,0,0,0|0,0,0]=2 2673 B12R1.16 CNCC(O)c1ccc(I)cc1 Amb25742345 [1,1,0,0,0,0|0,0,0]=2 2674 B12R1.16 CNCC(O)c1ccc(N)cc1 Amb19888327 [1,1,0,0,0,0|0,0,0]=2 2675 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22166782 [1,1,0,0,0,0|0,0,0]=2 2676 B12R1.16 CNCC(O)c1ccc(O)cc1 Amb22346160 [1,1,0,0,0,0|0,0,0]=2 2677 B12R1.16 CNCC(c1ccc(cc1)Br)C Amb17248095 [1,1,0,0,0,0|1,0,0]=3 2678 B12R1.16 CNCC(c1ccc(cc1)Br)O Amb17142608 [1,1,0,0,0,0|0,0,0]=2 2679 B12R1.16 CNCC(c1ccc(cc1)C)C Amb17232442 [1,1,0,0,0,0|1,0,0]=3 2680 B12R1.16 CNCC(c1ccc(cc1)Cl)C Amb17234045 [1,1,0,0,0,0|1,0,0]=3 2681 B12R1.16 CNCC(c1ccc(cc1)F)C Amb17232642 [1,1,0,0,0,0|1,0,0]=3 2682 B12R1.16 CNC[C@@H](N)c1ccc(Cl)cc1 Amb25693381 [1,1,0,0,0,0|1,0,0]=3 2683 B12R1.16 CNC[C@@H](O)c1ccc(Cl)cc1 Amb25152551 [1,1,0,0,0,0|0,0,0]=2 2684 B12R1.16 CNC[C@@H](O)c1ccc(O)cc1 Amb25764531 [1,1,0,0,0,0|0,0,0]=2 2685 B12R1.16 CNC[C@H](O)c1ccc(Br)cc1 Amb25845203 [1,1,0,0,0,0|0,0,0]=2 2686 B12R1.16 CNC[C@H](O)c1ccc(Cl)cc1 Amb24423892 [1,1,0,0,0,0|0,0,0]=2 2687 B12R1.16 CNC[C@H](O)c1ccc(F)c[n]1 Amb25300377 [1,1,0,0,0,0|1,0,0]=3 2688 B12R1.16 COCC(C)c1ccc(N)cc1 Amb25362017 [1,1,0,0,0,0|2,0,0]=4 2689 B12R1.16 COCC(F)c1ccc(O)cc1 Amb25845176 [1,1,0,0,0,0|2,0,0]=4 2690 B12R1.16 COCC(N)c1ccc(Br)cc1 Amb18070171 [1,1,0,0,0,0|2,0,0]=4 2691 B12R1.16 COCC(N)c1ccc(Cl)cc1 Amb18979034 [1,1,0,0,0,0|2,0,0]=4 2692 B12R1.16 COCC(N)c1ccc(F)cc1 Amb19375549 [1,1,0,0,0,0|2,0,0]=4 2693 B12R1.16 COCC(N)c1ccc(I)cc1 Amb24648633 [1,1,0,0,0,0|2,0,0]=4 2694 B12R1.16 COCC(N)c1ccc(O)cc1 Amb24581245 [1,1,0,0,0,0|2,0,0]=4 2695 B12R1.16 COCC(N)c1ccc(S)cc1 Amb24393366 [1,1,0,0,0,0|2,0,0]=4 2696 B12R1.16 COCC(O)c1ccc(Br)[n]c1 Amb24363729 [1,1,0,0,0,0|2,0,0]=4 2697 B12R1.16 COCC(O)c1ccc(Cl)cc1 Amb19058986 [1,1,0,0,0,0|1,0,0]=3 2698 B12R1.16 COCC(O)c1ccc(F)c[n]1 Amb24377421 [1,1,0,0,0,0|2,0,0]=4 2699 B12R1.16 COCC(O)c1ccc(F)cc1 Amb18793595 [1,1,0,0,0,0|1,0,0]=3 2700 B12R1.16 COCC(O)c1ccc(I)cc1 Amb25680763 [1,1,0,0,0,0|1,0,0]=3 2701 B12R1.16 COCC(O)c1ccc(N)cc1 Amb18987938 [1,1,0,0,0,0|1,0,0]=3 2702 B12R1.16 COCC(c1ccc(cc1)C)N Amb1127416 [1,1,0,0,0,0|2,0,0]=4 2703 B12R1.16 COCC(c1ccc(cc1)F)N Amb1139881 [1,1,0,0,0,0|2,0,0]=4 2704 B12R1.16 COC[C@@H](N)c1ccc(Cl)cc1 Amb25709133 [1,1,0,0,0,0|2,0,0]=4 2705 B12R1.16 COC[C@@H](N)c1ccc(N)cc1 Amb24585135 [1,1,0,0,0,0|2,0,0]=4 2706 B12R1.16 COC[C@@H](N)c1ccc(S)cc1 Amb25340455 [1,1,0,0,0,0|2,0,0]=4 2707 B12R1.16 COC[C@H](N)c1ccc(Cl)cc1 Amb25128001 [1,1,0,0,0,0|2,0,0]=4 2708 B12R1.16 COC[C@H](N)c1ccc(N)cc1 Amb25756886 [1,1,0,0,0,0|2,0,0]=4 2709 B12R1.16 COC[C@H](N)c1ccc(O)cc1 Amb24452863 [1,1,0,0,0,0|2,0,0]=4 2710 B12R1.16 COC[C@H](O)c1ccc(Cl)cc1 Amb25158166 [1,1,0,0,0,0|1,0,0]=3 2711 B12R1.16 CSCC(N)c1ccc(Cl)cc1 Amb18995345 [1,1,0,0,0,0|2,0,0]=4 2712 B12R1.16 CSCC(N)c1ccc(F)cc1 Amb18300300 [1,1,0,0,0,0|2,0,0]=4 2713 B12R1.16 CSCC(O)c1ccc(Cl)cc1 Amb24488689 [1,1,0,0,0,0|1,0,0]=3 2714 B12R1.16 CSCC(O)c1ccc(F)cc1 Amb19070006 [1,1,0,0,0,0|1,0,0]=3 2715 B12R1.16 CSCC(O)c1ccc(N)cc1 Amb18987939 [1,1,0,0,0,0|1,0,0]=3 2716 B12R1.16 C[15NH][13CH2][13CH](c1ccc(cc1)O)O Amb17620274 [1,1,0,0,0,0|0,0,0]=2 2717 B12R1.16 Cc1ccc([n]c1)C(O)CCC Amb24412250 [1,1,0,0,0,0|2,0,0]=4 2718 B12R1.16 Cc1ccc([n]c1)C(O)CNC Amb24380693 [1,1,0,0,0,0|1,0,0]=3 2719 B12R1.16 Cc1ccc(c[n]1)C(O)CCC Amb25683800 [1,1,0,0,0,0|2,0,0]=4 2720 B12R1.16 Cc1ccc(c[n]1)C(O)COC Amb25765115 [1,1,0,0,0,0|2,0,0]=4 2721 B12R1.16 Cc1ccc(cc1)C(Cl)CSC Amb25805205 [1,1,0,0,0,0|2,0,0]=4 2722 B12R1.16 Cc1ccc(cc1)C(N)CSC Amb18995350 [1,1,0,0,0,0|2,0,0]=4 2723 B12R1.16 Cc1ccc(cc1)C(O)CC#C Amb18800361 [1,1,0,0,0,0|1,0,1]=4 2724 B12R1.16 Cc1ccc(cc1)C(O)CC=C Amb18177785 [1,1,0,0,0,0|1,0,1]=4 2725 B12R1.16 Cc1ccc(cc1)C(O)CC=O Amb24391927 [1,1,0,0,0,0|2,0,0]=4 2726 B12R1.16 Cc1ccc(cc1)C(O)CCO Amb18563722 [1,1,0,0,0,0|2,0,0]=4 2727 B12R1.16 Cc1ccc(cc1)C(O)COC Amb18792767 [1,1,0,0,0,0|1,0,0]=3 2728 B12R1.16 Cc1ccc(cc1)C(O)CSC Amb19061295 [1,1,0,0,0,0|1,0,0]=3 2729 B12R1.16 Cc1ccc(cc1)[C@@H](N)CCC Amb22298580 [1,1,0,0,0,0|2,0,0]=4 2730 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#C Amb25706066 [1,1,0,0,0,0|1,0,1]=4 2731 B12R1.16 Cc1ccc(cc1)[C@@H](O)CC#N Amb24706705 [1,1,0,0,0,0|2,0,0]=4 2732 B12R1.16 Cc1ccc(cc1)[C@@H](O)CCC Amb24364768 [1,1,0,0,0,0|1,0,0]=3 2733 B12R1.16 Cc1ccc(cc1)[C@H](N)CCC Amb22298537 [1,1,0,0,0,0|2,0,0]=4 2734 B12R1.16 Cc1ccc(cc1)[C@H](N)COC Amb24734357 [1,1,0,0,0,0|2,0,0]=4 2735 B12R1.16 Cc1ccc(cc1)[C@H](O)CCC Amb24709228 [1,1,0,0,0,0|1,0,0]=3 2736 B12R1.16 Cc1ccc(cc1)[C@H](O)CCCl Amb25361013 [1,1,0,0,0,0|2,0,0]=4 2737 B12R1.16 ClCCC(c1ccc(cc1)Br)O Amb17196599 [1,1,0,0,0,0|2,0,0]=4 2738 B12R1.16 ClCCC(c1ccc(cc1)C)O Amb17194565 [1,1,0,0,0,0|2,0,0]=4 2739 B12R1.16 ClCCC(c1ccc(cc1)Cl)O Amb17194897 [1,1,0,0,0,0|2,0,0]=4 2740 B12R1.16 ClCCC(c1ccc(cc1)F)O Amb17194592 [1,1,0,0,0,0|2,0,0]=4 2741 B12R1.16 ICC[C@@H](c1ccc(cc1)F)O Amb16233257 [1,1,0,0,0,0|2,0,0]=4 2742 B12R1.16 N#CCC(O)c1ccc(Br)cc1 Amb18134741 [1,1,0,0,0,0|2,0,0]=4 2743 B12R1.16 N#CC[C@H](O)c1ccc(F)cc1 Amb24683357 [1,1,0,0,0,0|2,0,0]=4 2744 B12R1.16 NCCC(O)c1ccc(Cl)cc1 Amb21984559 [1,1,0,0,0,0|2,0,0]=4 2745 B12R1.16 NCCC(O)c1ccc(F)cc1 Amb21984558 [1,1,0,0,0,0|2,0,0]=4 2746 B12R1.16 NCCC(c1ccc(cc1)Br)O Amb17079141 [1,1,0,0,0,0|2,0,0]=4 2747 B12R1.16 NCCC(c1ccc(cc1)C)O Amb17079132 [1,1,0,0,0,0|2,0,0]=4 2748 B12R1.16 NCCC(c1ccc(cc1)Cl)O Amb17079140 [1,1,0,0,0,0|2,0,0]=4 2749 B12R1.16 NCCC(c1ccc(cc1)F)O Amb17079139 [1,1,0,0,0,0|2,0,0]=4 2750 B12R1.16 NCC[C@@H](O)c1ccc(F)cc1 Amb25148762 [1,1,0,0,0,0|2,0,0]=4 2751 B12R1.16 NCC[C@H](O)c1ccc(Cl)cc1 Amb24727053 [1,1,0,0,0,0|2,0,0]=4 2752 B12R1.16 NCC[C@H](O)c1ccc(F)cc1 Amb25148765 [1,1,0,0,0,0|2,0,0]=4 2753 B12R1.16 NNCC(c1ccc(cc1)Br)O Amb17249280 [1,1,0,0,0,0|1,0,0]=3 2754 B12R1.16 NNCC(c1ccc(cc1)C)O Amb17232610 [1,1,0,0,0,0|1,0,0]=3 2755 B12R1.16 NNCC(c1ccc(cc1)Cl)O Amb17234362 [1,1,0,0,0,0|1,0,0]=3 2756 B12R1.16 NNCC(c1ccc(cc1)F)O Amb17232743 [1,1,0,0,0,0|1,0,0]=3 2757 B12R1.16 NOCC(c1ccc(cc1)Br)O Amb17345008 [1,1,0,0,0,0|2,0,0]=4 2758 B12R1.16 NOCC(c1ccc(cc1)C)O Amb17334705 [1,1,0,0,0,0|2,0,0]=4 2759 B12R1.16 NOCC(c1ccc(cc1)Cl)O Amb17335950 [1,1,0,0,0,0|2,0,0]=4 2760 B12R1.16 NOCC(c1ccc(cc1)F)O Amb17334839 [1,1,0,0,0,0|2,0,0]=4 2761 B12R1.16 OC(CC=O)c1ccc(Cl)cc1 Amb25094341 [1,1,0,0,0,0|2,0,0]=4 2762 B12R1.16 OC(CC=O)c1ccc(F)cc1 Amb25053144 [1,1,0,0,0,0|2,0,0]=4 2763 B12R1.16 OC(CCI)c1ccc(F)cc1 Amb24537939 [1,1,0,0,0,0|2,0,0]=4 2764 B12R1.16 OC(c1ccc(cc1)C)CC#N Amb17232362 [1,1,0,0,0,0|2,0,0]=4 2765 B12R1.16 OC(c1ccc(cc1)F)CC#N Amb17232518 [1,1,0,0,0,0|2,0,0]=4 2766 B12R1.16 OCCC(O)c1ccc(Br)cc1 Amb18070318 [1,1,0,0,0,0|2,0,0]=4 2767 B12R1.16 OCCC(O)c1ccc(Cl)cc1 Amb18066186 [1,1,0,0,0,0|2,0,0]=4 2768 B12R1.16 OCCC(O)c1ccc(F)cc1 Amb18563926 [1,1,0,0,0,0|2,0,0]=4 2769 B12R1.16 OCC[C@@H](O)c1ccc(Cl)cc1 Amb24749568 [1,1,0,0,0,0|2,0,0]=4 2770 B12R1.16 OCC[C@@H](O)c1ccc(F)cc1 Amb25070596 [1,1,0,0,0,0|2,0,0]=4 2771 B12R1.16 OCC[C@H](O)c1ccc(Cl)cc1 Amb25129763 [1,1,0,0,0,0|2,0,0]=4 2772 B12R1.16 OCC[C@H](O)c1ccc(F)cc1 Amb24601023 [1,1,0,0,0,0|2,0,0]=4 2773 B12R1.16 ONCC(c1ccc(cc1)Br)O Amb17345007 [1,1,0,0,0,0|1,0,0]=3 2774 B12R1.16 ONCC(c1ccc(cc1)C)O Amb17334704 [1,1,0,0,0,0|1,0,0]=3 2775 B12R1.16 ONCC(c1ccc(cc1)Cl)O Amb17335949 [1,1,0,0,0,0|1,0,0]=3 2776 B12R1.16 ONCC(c1ccc(cc1)F)O Amb17334838 [1,1,0,0,0,0|1,0,0]=3 2777 B12R1.16 ONCC(c1ccc(cc1)O)O Amb17334758 [1,1,0,0,0,0|1,0,0]=3 2778 B12R1.16 O[C@@H](CCCl)c1ccc(F)cc1 Amb25073942 [1,1,0,0,0,0|2,0,0]=4 2779 B12R1.16 O[C@H](CCCl)c1ccc(F)cc1 Amb24711502 [1,1,0,0,0,0|2,0,0]=4 2780 B12R1.17 C#CCC(O)c1cc(O)ccc1 Amb18117926 [1,1,0,0,0,0|1,0,1]=4 2781 B12R1.17 C#CCC(O)c1cccc(Cl)c1 Amb18186757 [1,1,0,0,0,0|1,0,1]=4 2782 B12R1.17 C#CCC(O)c1cccc(F)c1 Amb18800773 [1,1,0,0,0,0|1,0,1]=4 2783 B12R1.17 C#CCC(O)c1cccc(N)c1 Amb24650876 [1,1,0,0,0,0|1,0,1]=4 2784 B12R1.17 C#CC[C@H](O)c1cc(O)ccc1 Amb25767097 [1,1,0,0,0,0|1,0,1]=4 2785 B12R1.17 C#CC[C@H](O)c1cccc(Cl)c1 Amb25788894 [1,1,0,0,0,0|1,0,1]=4 2786 B12R1.17 C=CCC(O)c1cc(O)ccc1 Amb18646052 [1,1,0,0,0,0|1,0,1]=4 2787 B12R1.17 C=CCC(O)c1cccc(F)c1 Amb18177817 [1,1,0,0,0,0|1,0,1]=4 2788 B12R1.17 C=CCC(O)c1cccc(N)c1 Amb25674950 [1,1,0,0,0,0|1,0,1]=4 2789 B12R1.17 C=CC[C@@H](O)c1cc(O)ccc1 Amb25352493 [1,1,0,0,0,0|1,0,1]=4 2790 B12R1.17 C=CC[C@@H](O)c1cccc(Br)c1 Amb24637865 [1,1,0,0,0,0|1,0,1]=4 2791 B12R1.17 C=CC[C@@H](O)c1cccc(S)c1 Amb25706098 [1,1,0,0,0,0|1,0,1]=4 2792 B12R1.17 C=CC[C@H](O)c1cc(O)ccc1 Amb24525136 [1,1,0,0,0,0|1,0,1]=4 2793 B12R1.17 C=CC[C@H](O)c1cccc(Cl)c1 Amb25241128 [1,1,0,0,0,0|1,0,1]=4 2794 B12R1.17 C=CC[C@H](O)c1cccc(F)c1 Amb24524776 [1,1,0,0,0,0|1,0,1]=4 2795 B12R1.17 CC#CC(O)c1cc(I)ccc1 Amb25064927 [1,1,0,0,0,0|1,0,1]=4 2796 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [1,1,0,0,0,0|2,0,0]=4 2797 B12R1.17 CCCC(N)c1cc(O)ccc1 Amb24379131 [1,1,0,0,0,0|2,0,0]=4 2798 B12R1.17 CCCC(O)c1c[n]cc(Cl)c1 Amb25104366 [1,1,0,0,0,0|2,0,0]=4 2799 B12R1.17 CCCC(O)c1c[n]cc(F)c1 Amb18180201 [1,1,0,0,0,0|2,0,0]=4 2800 B12R1.17 CCCC(O)c1cc(Cl)cc[n]1 Amb25847785 [1,1,0,0,0,0|2,0,0]=4 2801 B12R1.17 CCCC(O)c1cc(I)ccc1 Amb25310854 [1,1,0,0,0,0|1,0,0]=3 2802 B12R1.17 CCCC(O)c1cc(N)ccc1 Amb25087129 [1,1,0,0,0,0|1,0,0]=3 2803 B12R1.17 CCCC(O)c1cc(O)ccc1 Amb24706852 [1,1,0,0,0,0|1,0,0]=3 2804 B12R1.17 CCCC(O)c1cccc(Br)[n]1 Amb25706154 [1,1,0,0,0,0|2,0,0]=4 2805 B12R1.17 CCCC(c1cccc(c1)Br)O Amb17248424 [1,1,0,0,0,0|1,0,0]=3 2806 B12R1.17 CCCC(c1cccc(c1)C)N Amb17232449 [1,1,0,0,0,0|2,0,0]=4 2807 B12R1.17 CCCC(c1cccc(c1)C)O Amb17232484 [1,1,0,0,0,0|1,0,0]=3 2808 B12R1.17 CCCC(c1cccc(c1)Cl)N Amb17234050 [1,1,0,0,0,0|2,0,0]=4 2809 B12R1.17 CCCC(c1cccc(c1)Cl)O Amb17234155 [1,1,0,0,0,0|1,0,0]=3 2810 B12R1.17 CCCC(c1cccc(c1)F)N Amb17232649 [1,1,0,0,0,0|2,0,0]=4 2811 B12R1.17 CCCC(c1cccc(c1)F)O Amb17232673 [1,1,0,0,0,0|1,0,0]=3 2812 B12R1.17 CCC[C@@H](N)c1cc(Br)ccc1 Amb25301508 [1,1,0,0,0,0|2,0,0]=4 2813 B12R1.17 CCC[C@@H](N)c1cc(Cl)ccc1 Amb24426769 [1,1,0,0,0,0|2,0,0]=4 2814 B12R1.17 CCC[C@@H](N)c1cc(F)ccc1 Amb25709212 [1,1,0,0,0,0|2,0,0]=4 2815 B12R1.17 CCC[C@@H](N)c1cc(O)ccc1 Amb25328595 [1,1,0,0,0,0|2,0,0]=4 2816 B12R1.17 CCC[C@@H](O)c1c[n]cc(Br)c1 Amb25763374 [1,1,0,0,0,0|2,0,0]=4 2817 B12R1.17 CCC[C@@H](O)c1cc(Cl)cc[n]1 Amb25156889 [1,1,0,0,0,0|2,0,0]=4 2818 B12R1.17 CCC[C@@H](O)c1cc(Cl)ccc1 Amb25069848 [1,1,0,0,0,0|1,0,0]=3 2819 B12R1.17 CCC[C@H](N)c1cc(Br)ccc1 Amb24400381 [1,1,0,0,0,0|2,0,0]=4 2820 B12R1.17 CCC[C@H](O)c1c[n]cc(Br)c1 Amb24704858 [1,1,0,0,0,0|2,0,0]=4 2821 B12R1.17 CCC[C@H](O)c1cc(Br)ccc1 Amb25762439 [1,1,0,0,0,0|1,0,0]=3 2822 B12R1.17 CNCC(=O)c1cccc(Cl)c1 Amb18863066 [1,1,0,0,0,0|0,0,2]=4 2823 B12R1.17 CNCC(=O)c1cccc(F)c1 Amb18862706 [1,1,0,0,0,0|0,0,2]=4 2824 B12R1.17 CNCC(=O)c1cccc(N)c1 Amb18051532 [1,1,0,0,0,0|0,0,2]=4 2825 B12R1.17 CNCC(=O)c1cccc(O)c1 Amb18646278 [1,1,0,0,0,0|0,0,2]=4 2826 B12R1.17 CNCC(=O)c1cccc(c1)Br Amb17315041 [1,1,0,0,0,0|0,0,2]=4 2827 B12R1.17 CNCC(=O)c1cccc(c1)O Amb16231895 [1,1,0,0,0,0|0,0,2]=4 2828 B12R1.17 CNCC(=O)c1cccc(c1)O Amb17619313 [1,1,0,0,0,0|0,0,2]=4 2829 B12R1.17 CNCC(C)c1cccc(O)c1 Amb25804026 [1,1,0,0,0,0|1,0,0]=3 2830 B12R1.17 CNCC(Cl)c1cccc(F)c1 Amb24635680 [1,1,0,0,0,0|1,0,0]=3 2831 B12R1.17 CNCC(O)c1c[n]cc(Br)c1 Amb23586082 [1,1,0,0,0,0|1,0,0]=3 2832 B12R1.17 CNCC(O)c1c[n]cc(F)c1 Amb25787544 [1,1,0,0,0,0|1,0,0]=3 2833 B12R1.17 CNCC(O)c1cccc(F)c1 Amb18289718 [1,1,0,0,0,0|0,0,0]=2 2834 B12R1.17 CNCC(O)c1cccc(I)c1 Amb25121468 [1,1,0,0,0,0|0,0,0]=2 2835 B12R1.17 CNCC(c1cccc(c1)Br)O Amb17142607 [1,1,0,0,0,0|0,0,0]=2 2836 B12R1.17 CNCC(c1cccc(c1)N)O Amb17594135 [1,1,0,0,0,0|0,0,0]=2 2837 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb19133645 [1,1,0,0,0,0|0,0,0]=2 2838 B12R1.17 CNC[C@@H](O)c1cc(O)ccc1 Amb22799790 [1,1,0,0,0,0|0,0,0]=2 2839 B12R1.17 CNC[C@H](C)c1cccc(O)c1 Amb25774924 [1,1,0,0,0,0|1,0,0]=3 2840 B12R1.17 CNC[C@H](O)c1cc(O)ccc1 Amb22168059 [1,1,0,0,0,0|0,0,0]=2 2841 B12R1.17 CNC[C@H](c1cccc(c1)O)O Amb16231685 [1,1,0,0,0,0|0,0,0]=2 2842 B12R1.17 COCC(F)c1cccc(O)c1 Amb25283248 [1,1,0,0,0,0|2,0,0]=4 2843 B12R1.17 COCC(N)c1cccc(Cl)c1 Amb18983032 [1,1,0,0,0,0|2,0,0]=4 2844 B12R1.17 COCC(N)c1cccc(I)c1 Amb25034579 [1,1,0,0,0,0|2,0,0]=4 2845 B12R1.17 COCC(N)c1cccc(O)c1 Amb24378072 [1,1,0,0,0,0|2,0,0]=4 2846 B12R1.17 COCC(N)c1cccc(S)c1 Amb24428810 [1,1,0,0,0,0|2,0,0]=4 2847 B12R1.17 COCC(O)c1c[n]cc(F)c1 Amb18180316 [1,1,0,0,0,0|2,0,0]=4 2848 B12R1.17 COCC(O)c1cccc(Cl)c1 Amb19076385 [1,1,0,0,0,0|1,0,0]=3 2849 B12R1.17 COCC(O)c1cccc(F)c1 Amb18793594 [1,1,0,0,0,0|1,0,0]=3 2850 B12R1.17 COCC(c1cccc(c1)N)O Amb13952267 [1,1,0,0,0,0|1,0,0]=3 2851 B12R1.17 COC[C@@H](N)c1cc(N)ccc1 Amb25132108 [1,1,0,0,0,0|2,0,0]=4 2852 B12R1.17 COC[C@@H](N)c1cccc(Br)c1 Amb25669519 [1,1,0,0,0,0|2,0,0]=4 2853 B12R1.17 COC[C@@H](N)c1cccc(Cl)c1 Amb24670292 [1,1,0,0,0,0|2,0,0]=4 2854 B12R1.17 COC[C@@H](N)c1cccc(F)c1 Amb25794807 [1,1,0,0,0,0|2,0,0]=4 2855 B12R1.17 COC[C@@H](N)c1cccc(O)c1 Amb25809467 [1,1,0,0,0,0|2,0,0]=4 2856 B12R1.17 COC[C@H](N)c1cc(N)ccc1 Amb24360714 [1,1,0,0,0,0|2,0,0]=4 2857 B12R1.17 COC[C@H](N)c1cccc(I)c1 Amb25691760 [1,1,0,0,0,0|2,0,0]=4 2858 B12R1.17 CSCC(C)c1cccc(Cl)c1 Amb24525351 [1,1,0,0,0,0|2,0,0]=4 2859 B12R1.17 CSCC(N)c1cccc(Cl)c1 Amb18995356 [1,1,0,0,0,0|2,0,0]=4 2860 B12R1.17 CSCC(N)c1cccc(F)c1 Amb18995351 [1,1,0,0,0,0|2,0,0]=4 2861 B12R1.17 CSCC(O)c1c[n]cc(F)c1 Amb19070729 [1,1,0,0,0,0|2,0,0]=4 2862 B12R1.17 CSCC(O)c1cccc(F)c1 Amb19070007 [1,1,0,0,0,0|1,0,0]=3 2863 B12R1.17 CSCC(O)c1cccc(N)c1 Amb18296181 [1,1,0,0,0,0|1,0,0]=3 2864 B12R1.17 Cc1c[n]cc([n]1)C(O)CNC Amb24579216 [1,1,0,0,0,0|2,0,0]=4 2865 B12R1.17 Cc1c[n]cc(c1)C(O)CSC Amb24753350 [1,1,0,0,0,0|2,0,0]=4 2866 B12R1.17 Cc1cc(cc[n]1)C(O)CCC Amb25331562 [1,1,0,0,0,0|2,0,0]=4 2867 B12R1.17 Cc1cc(ccc1)C(=O)CNC Amb18862586 [1,1,0,0,0,0|0,0,2]=4 2868 B12R1.17 Cc1cc(ccc1)C(O)CC#C Amb18800364 [1,1,0,0,0,0|1,0,1]=4 2869 B12R1.17 Cc1cc(ccc1)C(O)CC=C Amb18177788 [1,1,0,0,0,0|1,0,1]=4 2870 B12R1.17 Cc1cc(ccc1)C(O)CC=O Amb24366566 [1,1,0,0,0,0|2,0,0]=4 2871 B12R1.17 Cc1cc(ccc1)C(O)CCCl Amb25725000 [1,1,0,0,0,0|2,0,0]=4 2872 B12R1.17 Cc1cc(ccc1)[C@@H](O)CC#N Amb25092023 [1,1,0,0,0,0|2,0,0]=4 2873 B12R1.17 Cc1cc(ccc1)[C@H](O)CC#C Amb25157924 [1,1,0,0,0,0|1,0,1]=4 2874 B12R1.17 Cc1cc[n]c(c1)C(O)CCC Amb24425208 [1,1,0,0,0,0|2,0,0]=4 2875 B12R1.17 Cc1cc[n]c(c1)C(O)COC Amb25115393 [1,1,0,0,0,0|2,0,0]=4 2876 B12R1.17 Cc1cc[n]c(c1)[C@@H](O)CCC Amb25848810 [1,1,0,0,0,0|2,0,0]=4 2877 B12R1.17 Cc1cc[n]c(c1)[C@H](O)CCC Amb25048748 [1,1,0,0,0,0|2,0,0]=4 2878 B12R1.17 Cc1cccc([n]1)[C@@H](O)CCC Amb25787490 [1,1,0,0,0,0|2,0,0]=4 2879 B12R1.17 Cc1cccc(c1)C(C)CNC Amb25069401 [1,1,0,0,0,0|1,0,0]=3 2880 B12R1.17 Cc1cccc(c1)C(N)COC Amb18975558 [1,1,0,0,0,0|2,0,0]=4 2881 B12R1.17 Cc1cccc(c1)C(N)CSC Amb18995349 [1,1,0,0,0,0|2,0,0]=4 2882 B12R1.17 Cc1cccc(c1)C(O)C#CC Amb24619196 [1,1,0,0,0,0|1,0,1]=4 2883 B12R1.17 Cc1cccc(c1)C(O)COC Amb18792769 [1,1,0,0,0,0|1,0,0]=3 2884 B12R1.17 Cc1cccc(c1)C(O)CSC Amb19061294 [1,1,0,0,0,0|1,0,0]=3 2885 B12R1.17 Cc1cccc(c1)[C@@H](N)CCC Amb22746897 [1,1,0,0,0,0|2,0,0]=4 2886 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb22298528 [1,1,0,0,0,0|2,0,0]=4 2887 B12R1.17 Cc1cccc(c1)[C@H](N)CCC Amb25328596 [1,1,0,0,0,0|2,0,0]=4 2888 B12R1.17 N#CCC(O)c1cc(O)ccc1 Amb25674244 [1,1,0,0,0,0|2,0,0]=4 2889 B12R1.17 N#CCC(O)c1cccc(Br)c1 Amb25139301 [1,1,0,0,0,0|2,0,0]=4 2890 B12R1.17 N#CCC(c1cccc(c1)C)O Amb1111387 [1,1,0,0,0,0|2,0,0]=4 2891 B12R1.17 N#CCC(c1cccc(c1)Cl)O Amb17233865 [1,1,0,0,0,0|2,0,0]=4 2892 B12R1.17 N#CCC(c1cccc(c1)F)O Amb17232517 [1,1,0,0,0,0|2,0,0]=4 2893 B12R1.17 N#CC[C@@H](O)c1cc(O)ccc1 Amb24492822 [1,1,0,0,0,0|2,0,0]=4 2894 B12R1.17 N#CC[C@@H](O)c1cccc(Cl)c1 Amb24360505 [1,1,0,0,0,0|2,0,0]=4 2895 B12R1.17 N#CC[C@@H](O)c1cccc(F)c1 Amb25721001 [1,1,0,0,0,0|2,0,0]=4 2896 B12R1.17 N#CC[C@H](O)c1cccc(F)c1 Amb25699065 [1,1,0,0,0,0|2,0,0]=4 2897 B12R1.17 NCCC(O)c1cc(Br)ccc1 Amb18121493 [1,1,0,0,0,0|2,0,0]=4 2898 B12R1.17 NCCC(O)c1cc(I)ccc1 Amb24493265 [1,1,0,0,0,0|2,0,0]=4 2899 B12R1.17 NCCC(O)c1cc(O)ccc1 Amb18251885 [1,1,0,0,0,0|2,0,0]=4 2900 B12R1.17 NCCC(c1cccc(c1)C)O Amb17232540 [1,1,0,0,0,0|2,0,0]=4 2901 B12R1.17 NCCC(c1cccc(c1)Cl)O Amb17234260 [1,1,0,0,0,0|2,0,0]=4 2902 B12R1.17 NCCC(c1cccc(c1)F)O Amb17232697 [1,1,0,0,0,0|2,0,0]=4 2903 B12R1.17 NCC[C@@H](O)c1cc(Cl)ccc1 Amb25105024 [1,1,0,0,0,0|2,0,0]=4 2904 B12R1.17 NNCC(O)c1cccc(F)c1 Amb18563928 [1,1,0,0,0,0|1,0,0]=3 2905 B12R1.17 NNCC(c1cccc(c1)Br)O Amb17249279 [1,1,0,0,0,0|1,0,0]=3 2906 B12R1.17 NNCC(c1cccc(c1)C)O Amb17232609 [1,1,0,0,0,0|1,0,0]=3 2907 B12R1.17 NNCC(c1cccc(c1)Cl)O Amb17234361 [1,1,0,0,0,0|1,0,0]=3 2908 B12R1.17 OC(CC=O)c1cccc(Br)c1 Amb25258748 [1,1,0,0,0,0|2,0,0]=4 2909 B12R1.17 OCCC(O)c1cccc(Br)c1 Amb24513513 [1,1,0,0,0,0|2,0,0]=4 2910 B12R1.17 OCCC(O)c1cccc(F)c1 Amb24406026 [1,1,0,0,0,0|2,0,0]=4 2911 B12R1.17 OCC[C@@H](O)c1cccc(Cl)c1 Amb25049479 [1,1,0,0,0,0|2,0,0]=4 2912 B12R1.17 OCC[C@@H](O)c1cccc(F)c1 Amb24405405 [1,1,0,0,0,0|2,0,0]=4 2913 B12R1.17 ONCC(c1cccc(c1)Br)O Amb17345006 [1,1,0,0,0,0|1,0,0]=3 2914 B12R1.17 ONCC(c1cccc(c1)C)O Amb17334703 [1,1,0,0,0,0|1,0,0]=3 2915 B12R1.17 ONCC(c1cccc(c1)Cl)O Amb17335948 [1,1,0,0,0,0|1,0,0]=3 2916 B12R1.17 ONCC(c1cccc(c1)O)O Amb17334759 [1,1,0,0,0,0|1,0,0]=3 2917 B12R1.17 O[C@@H](CCCl)c1cc(Cl)ccc1 Amb24655785 [1,1,0,0,0,0|2,0,0]=4 2918 B12R1.17 Oc1cccc(c1)C(O)CCO Amb24430894 [1,1,0,0,0,0|2,0,0]=4 2919 B12R1.17 Oc1cccc(c1)[C@@H](O)CCO Amb24686857 [1,1,0,0,0,0|2,0,0]=4 2920 B12R1.17 Oc1cccc(c1)[C@H](O)CCO Amb25797566 [1,1,0,0,0,0|2,0,0]=4 2921 B12R1.30 C#CCCC(O)c1ccccc1 Amb18800360 [1,1,0,0,0,0|1,0,1]=4 2922 B12R1.30 CC#CCC(N)c1ccccc1 Amb18988278 [1,1,0,0,0,0|2,0,0]=4 2923 B12R1.30 CC#CCC(O)c1c[n]ccc1 Amb18797973 [1,1,0,0,0,0|2,0,0]=4 2924 B12R1.30 CC#CCC(O)c1cc[n]cc1 Amb18797974 [1,1,0,0,0,0|2,0,0]=4 2925 B12R1.30 CC#CCC(O)c1cccc[n]1 Amb18797972 [1,1,0,0,0,0|2,0,0]=4 2926 B12R1.30 CC#CCC(O)c1ccccc1 Amb18797803 [1,1,0,0,0,0|1,0,0]=3 2927 B12R1.30 CC#CC[C@H](N)c1ccccc1 Amb25055199 [1,1,0,0,0,0|2,0,0]=4 2928 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [1,1,0,0,0,0|2,0,0]=4 2929 B12R1.30 CC(CNC#N)c1ccccc1 Amb24419584 [1,1,0,0,0,0|1,0,1]=4 2930 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [1,1,0,0,0,0|2,0,0]=4 2931 B12R1.30 CCC#CC(O)c1ccccc1 Amb24672537 [1,1,0,0,0,0|1,0,1]=4 2932 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [1,1,0,0,0,0|2,0,0]=4 2933 B12R1.30 CCNCC(N)c1ccccc1 Amb19009737 [1,1,0,0,0,0|1,0,0]=3 2934 B12R1.30 CCNCC(O)c1ccccc1 Amb22491734 [1,1,0,0,0,0|0,0,0]=2 2935 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [1,1,0,0,0,0|1,0,0]=3 2936 B12R1.30 CCNCC(c1ccccn1)O Amb17138608 [1,1,0,0,0,0|1,0,0]=3 2937 B12R1.30 CCNCC(c1cccnc1)O Amb17138609 [1,1,0,0,0,0|1,0,0]=3 2938 B12R1.30 CCNCC(c1ccncc1)O Amb17138610 [1,1,0,0,0,0|1,0,0]=3 2939 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [1,1,0,0,0,0|2,0,0]=4 2940 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [1,1,0,0,0,0|1,0,1]=4 2941 B12R1.30 CNCCC(=O)c1ccccc1 Amb11032366 [1,1,0,0,0,0|0,0,2]=4 2942 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb20240620 [1,1,0,0,0,0|0,0,0]=2 2943 B12R1.30 CNCC[C@@H](O)c1ccccc1 Amb22747753 [1,1,0,0,0,0|0,0,0]=2 2944 B12R1.30 CN\N=C\C(C)c1ccccc1 Amb24476432 [1,1,0,0,0,0|1,0,1]=4 2945 B12R1.30 COCCC(O)c1ccccc1 Amb18788453 [1,1,0,0,0,0|1,0,0]=3 2946 B12R1.30 CO\C=C\C(O)c1ccccc1 Amb25204750 [1,1,0,0,0,0|1,0,1]=4 2947 B12R1.30 CO\N=C\C(O)c1ccccc1 Amb25788975 [1,1,0,0,0,0|0,0,2]=4 2948 B12R1.30 CO\N=C\[C@@H](O)c1ccccc1 Amb24592391 [1,1,0,0,0,0|0,0,2]=4 2949 B12R1.30 C\C(=C/CNC)\c1ccccc1 Amb23555664 [1,1,0,0,0,0|1,0,1]=4 2950 B12R1.30 C\C=C\CC(O)c1c[n]ccc1 Amb25832725 [1,1,0,0,0,0|2,0,0]=4 2951 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [1,1,0,0,0,0|0,0,1]=3 2952 B12R1.30 ClCCCC(c1ccccc1)O Amb17194564 [1,1,0,0,0,0|1,0,0]=3 2953 B12R1.30 N#CCC[C@H](O)c1ccccc1 Amb24466214 [1,1,0,0,0,0|1,0,1]=4 2954 B12R1.30 N#CNCC(O)c1ccccc1 Amb18800628 [1,1,0,0,0,0|0,0,1]=3 2955 B12R1.30 NCCCC(O)c1cc[n]cc1 Amb18563731 [1,1,0,0,0,0|2,0,0]=4 2956 B12R1.30 NCCCC(O)c1cccc[n]1 Amb18563728 [1,1,0,0,0,0|2,0,0]=4 2957 B12R1.30 NCCCC(O)c1ccccc1 Amb21984517 [1,1,0,0,0,0|1,0,0]=3 2958 B12R1.30 NCCCC(c1ccccc1)O Amb17079154 [1,1,0,0,0,0|1,0,0]=3 2959 B12R1.30 NCCCC(c1cccnc1)O Amb17232606 [1,1,0,0,0,0|2,0,0]=4 2960 B12R1.30 N[C@@H](CCCO)c1ccccc1 Amb23440411 [1,1,0,0,0,0|2,0,0]=4 2961 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [1,1,0,0,0,0|0,0,1]=3 2962 B12R1.30 OC(C\C=C/Cl)c1ccccc1 Amb25109311 [1,1,0,0,0,0|1,0,1]=4 2963 B12R1.30 OC(c1ccccc1)CCC#N Amb17232364 [1,1,0,0,0,0|1,0,1]=4 2964 B12R1.30 OCC#C[C@H](O)c1ccccc1 Amb24588419 [1,1,0,0,0,0|1,0,1]=4 2965 B12R1.30 OCCCC(c1ccccc1)O Amb17334675 [1,1,0,0,0,0|1,0,0]=3 2966 B12R1.30 OCCCC(c1cccnc1)O Amb17619700 [1,1,0,0,0,0|2,0,0]=4 2967 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [1,1,0,0,0,0|1,0,1]=4 2968 B12R1.30 OC\C=C\[C@@H](O)c1ccccc1 Amb25285682 [1,1,0,0,0,0|1,0,1]=4 2969 B12R1.30 O[C@H](C\C=C/Cl)c1ccccc1 Amb25751194 [1,1,0,0,0,0|1,0,1]=4 2970 B12R1.30 O\N=C\CC(O)c1ccccc1 Amb25156836 [1,1,0,0,0,0|1,0,1]=4 2971 B12R1.30 [N-]=[N+]=NCC(O)c1ccccc1 Amb18792465 [1,1,0,0,0,0|1,0,1]=4 2972 B12R1.30 [N-]=[N+]=NC[C@H](O)c1ccccc1 Amb25102649 [1,1,0,0,0,0|1,0,1]=4 2973 B12R1.39 CC(O)(CC=O)c1ccccc1 Amb18646085 [1,1,0,0,0,0|2,0,0]=4 2974 B12R1.39 CC(O)(CCCl)c1ccccc1 Amb25114796 [1,1,0,0,0,0|2,0,0]=4 2975 B12R1.39 CC(O)(CCO)c1ccccc1 Amb25716950 [1,1,0,0,0,0|2,0,0]=4 2976 B12R1.39 CCCC(F)(F)c1ccccc1 Amb19894549 [1,1,0,0,0,0|2,0,0]=4 2977 B12R1.39 CNCC(C)(N)c1ccccc1 Amb18298752 [1,1,0,0,0,0|1,0,0]=3 2978 B12R1.39 CNCC(C)(O)c1c[n]c[n]c1 Amb25148910 [1,1,0,0,0,0|2,0,0]=4 2979 B12R1.39 CNCC(C)(O)c1c[n]cc[n]1 Amb25719998 [1,1,0,0,0,0|2,0,0]=4 2980 B12R1.39 CNCC(C)(O)c1c[n]ccc1 Amb18062824 [1,1,0,0,0,0|1,0,0]=3 2981 B12R1.39 CNCC(C)(O)c1cc[n]cc1 Amb18562953 [1,1,0,0,0,0|1,0,0]=3 2982 B12R1.39 CNCC(C)(O)c1cccc[n]1 Amb18064992 [1,1,0,0,0,0|1,0,0]=3 2983 B12R1.39 CNCC(F)(F)c1c[n]ccc1 Amb25062659 [1,1,0,0,0,0|2,0,0]=4 2984 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [1,1,0,0,0,0|2,0,0]=4 2985 B12R1.39 COCC(C)(O)c1c[n]ccc1 Amb18805605 [1,1,0,0,0,0|2,0,0]=4 2986 B12R1.39 COCC(C)(O)c1cc[n]cc1 Amb22897033 [1,1,0,0,0,0|2,0,0]=4 2987 B12R1.39 COCC(C)(O)c1cccc[n]1 Amb22897034 [1,1,0,0,0,0|2,0,0]=4 2988 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [1,1,0,0,0,0|1,0,0]=3 2989 B12R1.39 COC[C@@](C)(N)c1ccccc1 Amb25856946 [1,1,0,0,0,0|2,0,0]=4 2990 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [1,1,0,0,0,0|1,0,0]=3 2991 B12R1.39 C[C@@](O)(CCCl)c1ccccc1 Amb25361033 [1,1,0,0,0,0|2,0,0]=4 2992 B12R1.39 C[C@](O)(CCCl)c1ccccc1 Amb25667166 [1,1,0,0,0,0|2,0,0]=4 2993 B12R1.39 NC(O)(CCO)c1ccccc1 Amb24431011 [1,1,0,0,0,0|2,0,0]=4 2994 B12R1.39 NCCC(c1ccccc1)(O)C Amb17594116 [1,1,0,0,0,0|2,0,0]=4 2995 B12R1.39 NNCC(F)(F)c1ccccc1 Amb25692683 [1,1,0,0,0,0|2,0,0]=4 2996 B12R1.39 NNCC(c1ccccc1)(O)C Amb17232616 [1,1,0,0,0,0|1,0,0]=3 2997 B12R1.39 N[C@](O)(CCO)c1ccccc1 Amb25356322 [1,1,0,0,0,0|2,0,0]=4 2998 B12R1.107 BrC(c1ccccc1)CN(C)C Amb10563751 [1,1,0,0,0,0|1,0,0]=3 2999 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [1,1,0,0,0,0|1,0,1]=4 3000 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [1,1,0,0,0,0|1,0,1]=4 3001 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [1,1,0,0,0,0|1,0,1]=4 3002 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [1,1,0,0,0,0|2,0,0]=4 3003 B12R1.107 CC(=C)CC(O)c1cc[n]cc1 Amb24439149 [1,1,0,0,0,0|2,0,0]=4 3004 B12R1.107 CC(=C)CC(O)c1ccc[n]c1 Amb25083900 [1,1,0,0,0,0|2,0,0]=4 3005 B12R1.107 CC(=C)CC(O)c1cccc[n]1 Amb25675378 [1,1,0,0,0,0|2,0,0]=4 3006 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [1,1,0,0,0,0|2,0,0]=4 3007 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [1,1,0,0,0,0|1,0,0]=3 3008 B12R1.107 CC(=O)CC(c1ccccn1)O Amb1016907 [1,1,0,0,0,0|2,0,0]=4 3009 B12R1.107 CC(=O)C[C@@H](O)c1cccc[n]1 Amb25319984 [1,1,0,0,0,0|2,0,0]=4 3010 B12R1.107 CC(C)CC(O)c1cc[n]cc1 Amb18792668 [1,1,0,0,0,0|2,0,0]=4 3011 B12R1.107 CC(C)CC(O)c1cccc[n]1 Amb18792671 [1,1,0,0,0,0|2,0,0]=4 3012 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [1,1,0,0,0,0|2,0,0]=4 3013 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [1,1,0,0,0,0|2,0,0]=4 3014 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [1,1,0,0,0,0|1,0,0]=3 3015 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [1,1,0,0,0,0|2,0,0]=4 3016 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [1,1,0,0,0,0|1,0,0]=3 3017 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [1,1,0,0,0,0|2,0,0]=4 3018 B12R1.107 CC(CC(c1cccnc1)O)C Amb17232541 [1,1,0,0,0,0|2,0,0]=4 3019 B12R1.107 CC(CN(C)C)c1ccccc1 Amb22491726 [1,1,0,0,0,0|1,0,0]=3 3020 B12R1.107 CC(CN(C)C)c1ccccc1 Amb25848155 [1,1,0,0,0,0|1,0,0]=3 3021 B12R1.107 CC(CN(C)N)c1ccccc1 Amb24379493 [1,1,0,0,0,0|1,0,0]=3 3022 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [1,1,0,0,0,0|2,0,0]=4 3023 B12R1.107 CC(N)CC(O)c1ccc[n]c1 Amb25798886 [1,1,0,0,0,0|2,0,0]=4 3024 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [1,1,0,0,0,0|1,0,0]=3 3025 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [1,1,0,0,0,0|1,0,0]=3 3026 B12R1.107 CC(NN(C)C)c1ccccc1 Amb24608774 [1,1,0,0,0,0|2,0,0]=4 3027 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [1,1,0,0,0,0|2,0,0]=4 3028 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [1,1,0,0,0,0|2,0,0]=4 3029 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [1,1,0,0,0,0|1,1,0]=4 3030 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [1,1,0,0,0,0|1,0,0]=3 3031 B12R1.107 CN(C)CC(=O)c1ccccc1 Amb22264767 [1,1,0,0,0,0|0,0,2]=4 3032 B12R1.107 CN(C)CC(Br)c1ccccc1 Amb25055256 [1,1,0,0,0,0|1,0,0]=3 3033 B12R1.107 CN(C)CC(F)c1ccccc1 Amb24623425 [1,1,0,0,0,0|1,0,0]=3 3034 B12R1.107 CN(C)CC(N)c1cc[n]cc1 Amb25315967 [1,1,0,0,0,0|2,0,0]=4 3035 B12R1.107 CN(C)CC(N)c1cccc[n]1 Amb24543991 [1,1,0,0,0,0|2,0,0]=4 3036 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [1,1,0,0,0,0|1,0,0]=3 3037 B12R1.107 CN(C)CC(O)c1c[n]c[n]c1 Amb25316533 [1,1,0,0,0,0|2,0,0]=4 3038 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [1,1,0,0,0,0|1,0,0]=3 3039 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 Amb22226504 [1,1,0,0,0,0|0,0,0]=2 3040 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [1,1,0,0,0,0|0,0,0]=2 3041 B12R1.107 CN(C)\C=C(/O)\c1ccccc1 Amb24068870 [1,1,0,0,0,0|0,0,2]=4 3042 B12R1.107 CN(CC(c1ccccn1)O)C Amb17550347 [1,1,0,0,0,0|1,0,0]=3 3043 B12R1.107 CN(CC(c1cccnc1)O)C Amb17550203 [1,1,0,0,0,0|1,0,0]=3 3044 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [1,1,0,0,0,0|2,0,0]=4 3045 B12R1.107 CS(=O)CC(O)c1cc[n]cc1 Amb25753341 [1,1,0,0,0,0|2,0,0]=4 3046 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [1,1,0,0,0,0|1,0,0]=3 3047 B12R1.107 CS(=O)C[C@@H](O)c1cc[n]cc1 Amb25333612 [1,1,0,0,0,0|2,0,0]=4 3048 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [1,1,0,0,0,0|1,0,1]=4 3049 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [1,1,0,0,0,0|2,0,0]=4 3050 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [1,1,0,0,0,0|2,0,0]=4 3051 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [1,1,0,0,0,0|2,0,0]=4 3052 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [1,1,0,0,0,0|2,0,0]=4 3053 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [1,1,0,0,0,0|1,0,0]=3 3054 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [1,1,0,0,0,0|1,0,1]=4 3055 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [1,1,0,0,0,0|2,0,0]=4 3056 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [1,1,0,0,0,0|1,0,0]=3 3057 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [1,1,0,0,0,0|2,0,0]=4 3058 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [1,1,0,0,0,0|1,0,0]=3 3059 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [1,1,0,0,0,0|1,1,0]=4 3060 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [1,1,0,0,0,0|1,0,1]=4 3061 B12R1.107 ClC(c1ccccc1)CN(C)C Amb10563749 [1,1,0,0,0,0|1,0,0]=3 3062 B12R1.107 ClC(c1ccccc1)CN(C)C Amb17546791 [1,1,0,0,0,0|1,0,0]=3 3063 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [1,1,0,0,0,0|2,0,0]=4 3064 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [1,1,0,0,0,0|2,0,0]=4 3065 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [1,1,0,0,0,0|2,0,0]=4 3066 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [1,1,0,0,0,0|2,0,0]=4 3067 B12R1.107 NC(c1ccccc1)CN(C)C Amb1218288 [1,1,0,0,0,0|1,0,0]=3 3068 B12R1.107 OC(CC(F)F)c1ccccc1 Amb24433354 [1,1,0,0,0,0|2,0,0]=4 3069 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [1,1,0,0,0,0|2,0,0]=4 3070 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [1,1,0,0,0,0|1,0,0]=3 3071 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [1,1,0,0,0,0|1,0,0]=3 3072 B12R1.107 OC(c1ccccc1)CN(C)C Amb10563753 [1,1,0,0,0,0|0,0,0]=2 3073 B12R1.107 OC(c1ccccc1)CN(C)C Amb17104281 [1,1,0,0,0,0|0,0,0]=2 3074 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [1,1,0,0,0,0|1,0,1]=4 3075 B12R1.107 OC(c1ccncc1)CN(C)C Amb17550252 [1,1,0,0,0,0|1,0,0]=3 3076 B12R1.308 C#CCC(O)c1ccccc1Cl Amb18186758 [1,1,0,0,0,0|1,0,1]=4 3077 B12R1.308 C#CCC(O)c1ccccc1F Amb18788274 [1,1,0,0,0,0|1,0,1]=4 3078 B12R1.308 C#CC[C@@H](O)c1ccccc1F Amb24100209 [1,1,0,0,0,0|1,0,1]=4 3079 B12R1.308 C#CC[C@H](O)c1ccccc1Cl Amb25158196 [1,1,0,0,0,0|1,0,1]=4 3080 B12R1.308 C=CCC(O)c1ccccc1Br Amb24671319 [1,1,0,0,0,0|1,0,1]=4 3081 B12R1.308 C=CCC(O)c1ccccc1Cl Amb19074253 [1,1,0,0,0,0|1,0,1]=4 3082 B12R1.308 C=CCC(O)c1ccccc1F Amb18177819 [1,1,0,0,0,0|1,0,1]=4 3083 B12R1.308 C=CCC(O)c1ccccc1I Amb25775871 [1,1,0,0,0,0|1,0,1]=4 3084 B12R1.308 C=CCC(O)c1ccccc1O Amb18646046 [1,1,0,0,0,0|1,0,1]=4 3085 B12R1.308 C=CC[C@@H](O)c1ccccc1Cl Amb24372071 [1,1,0,0,0,0|1,0,1]=4 3086 B12R1.308 C=CC[C@H](O)c1ccccc1Cl Amb24534332 [1,1,0,0,0,0|1,0,1]=4 3087 B12R1.308 C=CC[C@H](O)c1ccccc1O Amb24497366 [1,1,0,0,0,0|1,0,1]=4 3088 B12R1.308 C=CC[C@H](O)c1ccccc1S Amb24608088 [1,1,0,0,0,0|1,0,1]=4 3089 B12R1.308 CC#CC(O)c1ccccc1Cl Amb25859323 [1,1,0,0,0,0|1,0,1]=4 3090 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [1,1,0,0,0,0|2,0,0]=4 3091 B12R1.308 CCCC(Cl)c1ccccc1F Amb25127215 [1,1,0,0,0,0|2,0,0]=4 3092 B12R1.308 CCCC(N)c1ccccc1N Amb25119381 [1,1,0,0,0,0|2,0,0]=4 3093 B12R1.308 CCCC(N)c1ccccc1S Amb24488673 [1,1,0,0,0,0|2,0,0]=4 3094 B12R1.308 CCCC(O)c1[n]cccc1Br Amb24554689 [1,1,0,0,0,0|2,0,0]=4 3095 B12R1.308 CCCC(O)c1[n]cccc1O Amb25092013 [1,1,0,0,0,0|2,0,0]=4 3096 B12R1.308 CCCC(O)c1c[n]ccc1Cl Amb25317649 [1,1,0,0,0,0|2,0,0]=4 3097 B12R1.308 CCCC(O)c1ccc[n]c1N Amb25719741 [1,1,0,0,0,0|2,0,0]=4 3098 B12R1.308 CCCC(O)c1ccccc1I Amb24623046 [1,1,0,0,0,0|1,0,0]=3 3099 B12R1.308 CCCC(O)c1ccccc1N Amb24473035 [1,1,0,0,0,0|1,0,0]=3 3100 B12R1.308 CCCC(O)c1ccccc1O Amb18646532 [1,1,0,0,0,0|1,0,0]=3 3101 B12R1.308 CCCC(c1ccccc1C)N Amb17232446 [1,1,0,0,0,0|2,0,0]=4 3102 B12R1.308 CCCC(c1ccccc1C)O Amb17232483 [1,1,0,0,0,0|1,0,0]=3 3103 B12R1.308 CCCC(c1ccccc1Cl)N Amb17234047 [1,1,0,0,0,0|2,0,0]=4 3104 B12R1.308 CCCC(c1ccccc1Cl)O Amb17234154 [1,1,0,0,0,0|1,0,0]=3 3105 B12R1.308 CCCC(c1ccccc1F)N Amb17232645 [1,1,0,0,0,0|2,0,0]=4 3106 B12R1.308 CCCC(c1ccccc1F)O Amb17232666 [1,1,0,0,0,0|1,0,0]=3 3107 B12R1.308 CCC[C@@H](N)c1ccccc1I Amb24443865 [1,1,0,0,0,0|2,0,0]=4 3108 B12R1.308 CCC[C@@H](O)c1[n]cccc1Cl Amb24343501 [1,1,0,0,0,0|2,0,0]=4 3109 B12R1.308 CCC[C@@H](O)c1cc[n]cc1Cl Amb25210984 [1,1,0,0,0,0|2,0,0]=4 3110 B12R1.308 CCC[C@@H](O)c1cc[n]cc1F Amb25719941 [1,1,0,0,0,0|2,0,0]=4 3111 B12R1.308 CCC[C@@H](O)c1ccccc1Br Amb24705993 [1,1,0,0,0,0|1,0,0]=3 3112 B12R1.308 CCC[C@@H](O)c1ccccc1Cl Amb25043992 [1,1,0,0,0,0|1,0,0]=3 3113 B12R1.308 CCC[C@H](N)c1ccccc1Br Amb25096337 [1,1,0,0,0,0|2,0,0]=4 3114 B12R1.308 CCC[C@H](N)c1ccccc1N Amb25088274 [1,1,0,0,0,0|2,0,0]=4 3115 B12R1.308 CCC[C@H](O)c1[n]cccc1F Amb25355276 [1,1,0,0,0,0|2,0,0]=4 3116 B12R1.308 CCC[C@H](O)c1c[n]ccc1Cl Amb24386986 [1,1,0,0,0,0|2,0,0]=4 3117 B12R1.308 CCC[C@H](O)c1cc[n]cc1Cl Amb25361495 [1,1,0,0,0,0|2,0,0]=4 3118 B12R1.308 CCC[C@H](O)c1cc[n]cc1F Amb24718709 [1,1,0,0,0,0|2,0,0]=4 3119 B12R1.308 CNCC(=O)c1ccccc1Br Amb18160384 [1,1,0,0,0,0|0,0,2]=4 3120 B12R1.308 CNCC(=O)c1ccccc1Cl Amb18863065 [1,1,0,0,0,0|0,0,2]=4 3121 B12R1.308 CNCC(=O)c1ccccc1F Amb18862705 [1,1,0,0,0,0|0,0,2]=4 3122 B12R1.308 CNCC(C)c1ccccc1Br Amb25035170 [1,1,0,0,0,0|1,0,0]=3 3123 B12R1.308 CNCC(C)c1ccccc1F Amb25827937 [1,1,0,0,0,0|1,0,0]=3 3124 B12R1.308 CNCC(O)c1[n]cccc1Br Amb23586111 [1,1,0,0,0,0|1,0,0]=3 3125 B12R1.308 CNCC(O)c1cc[n]cc1F Amb25259123 [1,1,0,0,0,0|1,0,0]=3 3126 B12R1.308 CNCC(O)c1cc[n]cc1O Amb25195080 [1,1,0,0,0,0|1,0,0]=3 3127 B12R1.308 CNCC(O)c1ccccc1Br Amb18301236 [1,1,0,0,0,0|0,0,0]=2 3128 B12R1.308 CNCC(O)c1ccccc1O Amb24739803 [1,1,0,0,0,0|0,0,0]=2 3129 B12R1.308 CNC[C@@H](O)c1ccccc1O Amb24427596 [1,1,0,0,0,0|0,0,0]=2 3130 B12R1.308 COCC(N)c1ccccc1Cl Amb18979037 [1,1,0,0,0,0|2,0,0]=4 3131 B12R1.308 COCC(N)c1ccccc1N Amb25709589 [1,1,0,0,0,0|2,0,0]=4 3132 B12R1.308 COCC(N)c1ccccc1S Amb25790028 [1,1,0,0,0,0|2,0,0]=4 3133 B12R1.308 COCC(O)c1ccc[n]c1N Amb24667513 [1,1,0,0,0,0|2,0,0]=4 3134 B12R1.308 COCC(O)c1ccccc1Br Amb24641135 [1,1,0,0,0,0|1,0,0]=3 3135 B12R1.308 COCC(O)c1ccccc1Cl Amb19058987 [1,1,0,0,0,0|1,0,0]=3 3136 B12R1.308 COCC(O)c1ccccc1F Amb18806459 [1,1,0,0,0,0|1,0,0]=3 3137 B12R1.308 COCC(O)c1ccccc1N Amb18987946 [1,1,0,0,0,0|1,0,0]=3 3138 B12R1.308 COCC(c1ccccc1C)N Amb1129629 [1,1,0,0,0,0|2,0,0]=4 3139 B12R1.308 COCC(c1ccccc1F)N Amb1139580 [1,1,0,0,0,0|2,0,0]=4 3140 B12R1.308 COC[C@@H](N)c1ccccc1Cl Amb24670291 [1,1,0,0,0,0|2,0,0]=4 3141 B12R1.308 COC[C@@H](N)c1ccccc1F Amb25852206 [1,1,0,0,0,0|2,0,0]=4 3142 B12R1.308 COC[C@H](N)c1ccccc1Br Amb25225784 [1,1,0,0,0,0|2,0,0]=4 3143 B12R1.308 COC[C@H](N)c1ccccc1Cl Amb25118021 [1,1,0,0,0,0|2,0,0]=4 3144 B12R1.308 COC[C@H](N)c1ccccc1I Amb24483885 [1,1,0,0,0,0|2,0,0]=4 3145 B12R1.308 COC[C@H](N)c1ccccc1S Amb25063716 [1,1,0,0,0,0|2,0,0]=4 3146 B12R1.308 CSCC(N)c1ccccc1Cl Amb18300371 [1,1,0,0,0,0|2,0,0]=4 3147 B12R1.308 CSCC(N)c1ccccc1F Amb18995354 [1,1,0,0,0,0|2,0,0]=4 3148 B12R1.308 CSCC(O)c1c[n]ccc1N Amb24640917 [1,1,0,0,0,0|2,0,0]=4 3149 B12R1.308 CSCC(O)c1ccc[n]c1N Amb24483399 [1,1,0,0,0,0|2,0,0]=4 3150 B12R1.308 CSCC(O)c1ccccc1Cl Amb25789089 [1,1,0,0,0,0|1,0,0]=3 3151 B12R1.308 CSCC(O)c1ccccc1F Amb19070008 [1,1,0,0,0,0|1,0,0]=3 3152 B12R1.308 CSCC(O)c1ccccc1N Amb18987947 [1,1,0,0,0,0|1,0,0]=3 3153 B12R1.308 C\C=C\C(O)c1ccccc1O Amb24378436 [1,1,0,0,0,0|1,0,1]=4 3154 B12R1.308 Cc1[n]cccc1C(O)COC Amb24429455 [1,1,0,0,0,0|2,0,0]=4 3155 B12R1.308 Cc1c[n]ccc1C(O)CCC Amb25354367 [1,1,0,0,0,0|2,0,0]=4 3156 B12R1.308 Cc1c[n]ccc1C(O)COC Amb24471169 [1,1,0,0,0,0|2,0,0]=4 3157 B12R1.308 Cc1cc[n]cc1C(O)CCC Amb25751730 [1,1,0,0,0,0|2,0,0]=4 3158 B12R1.308 Cc1cc[n]cc1C(O)CSC Amb24594847 [1,1,0,0,0,0|2,0,0]=4 3159 B12R1.308 Cc1cc[n]cc1[C@H](O)CCC Amb24398454 [1,1,0,0,0,0|2,0,0]=4 3160 B12R1.308 Cc1ccc[n]c1C(O)CCC Amb18182634 [1,1,0,0,0,0|2,0,0]=4 3161 B12R1.308 Cc1ccc[n]c1C(O)CNC Amb24711552 [1,1,0,0,0,0|1,0,0]=3 3162 B12R1.308 Cc1ccc[n]c1C(O)COC Amb24446154 [1,1,0,0,0,0|2,0,0]=4 3163 B12R1.308 Cc1ccc[n]c1[C@H](O)CCC Amb25043993 [1,1,0,0,0,0|2,0,0]=4 3164 B12R1.308 Cc1ccccc1C(=O)CNC Amb18862585 [1,1,0,0,0,0|0,0,2]=4 3165 B12R1.308 Cc1ccccc1C(C)CNC Amb25255160 [1,1,0,0,0,0|1,0,0]=3 3166 B12R1.308 Cc1ccccc1C(C)CNN Amb24365526 [1,1,0,0,0,0|2,0,0]=4 3167 B12R1.308 Cc1ccccc1C(Cl)CCC Amb25157873 [1,1,0,0,0,0|2,0,0]=4 3168 B12R1.308 Cc1ccccc1C(N)CSC Amb18995352 [1,1,0,0,0,0|2,0,0]=4 3169 B12R1.308 Cc1ccccc1C(O)CC#C Amb18800363 [1,1,0,0,0,0|1,0,1]=4 3170 B12R1.308 Cc1ccccc1C(O)CC=C Amb18177787 [1,1,0,0,0,0|1,0,1]=4 3171 B12R1.308 Cc1ccccc1C(O)COC Amb18792768 [1,1,0,0,0,0|1,0,0]=3 3172 B12R1.308 Cc1ccccc1C(O)CSC Amb19061296 [1,1,0,0,0,0|1,0,0]=3 3173 B12R1.308 Cc1ccccc1C(O)\C=C\C Amb25112696 [1,1,0,0,0,0|1,0,1]=4 3174 B12R1.308 Cc1ccccc1[C@@H](N)CCC Amb22298562 [1,1,0,0,0,0|2,0,0]=4 3175 B12R1.308 Cc1ccccc1[C@@H](N)COC Amb24447174 [1,1,0,0,0,0|2,0,0]=4 3176 B12R1.308 Cc1ccccc1[C@H](N)CCC Amb22298519 [1,1,0,0,0,0|2,0,0]=4 3177 B12R1.308 Cc1ccccc1[C@H](O)CNC Amb24398599 [1,1,0,0,0,0|0,0,0]=2 3178 B12R1.308 N#CCC(c1ccccc1C)O Amb1111330 [1,1,0,0,0,0|2,0,0]=4 3179 B12R1.308 N#CCC(c1ccccc1F)O Amb17232516 [1,1,0,0,0,0|2,0,0]=4 3180 B12R1.308 N#CC[C@@H](O)c1ccccc1Br Amb25070680 [1,1,0,0,0,0|2,0,0]=4 3181 B12R1.308 N#CC[C@@H](O)c1ccccc1Cl Amb25058529 [1,1,0,0,0,0|2,0,0]=4 3182 B12R1.308 N#CC[C@H](O)c1ccccc1Cl Amb25215874 [1,1,0,0,0,0|2,0,0]=4 3183 B12R1.308 N#CC[C@H](O)c1ccccc1F Amb25354676 [1,1,0,0,0,0|2,0,0]=4 3184 B12R1.308 NCCC(O)c1ccccc1Br Amb18747006 [1,1,0,0,0,0|2,0,0]=4 3185 B12R1.308 NCCC(O)c1ccccc1O Amb24718394 [1,1,0,0,0,0|2,0,0]=4 3186 B12R1.308 NCCC(c1ccccc1C)O Amb17232539 [1,1,0,0,0,0|2,0,0]=4 3187 B12R1.308 NCCC(c1ccccc1Cl)O Amb17234259 [1,1,0,0,0,0|2,0,0]=4 3188 B12R1.308 NCCC(c1ccccc1F)O Amb17232696 [1,1,0,0,0,0|2,0,0]=4 3189 B12R1.308 NNCC(O)c1ccccc1Br Amb18070085 [1,1,0,0,0,0|1,0,0]=3 3190 B12R1.308 NNCC(c1ccccc1C)O Amb17232608 [1,1,0,0,0,0|1,0,0]=3 3191 B12R1.308 NNCC(c1ccccc1Cl)O Amb17234360 [1,1,0,0,0,0|1,0,0]=3 3192 B12R1.308 NNCC(c1ccccc1F)O Amb17232742 [1,1,0,0,0,0|1,0,0]=3 3193 B12R1.308 OC(CCCl)c1ccccc1Cl Amb25159575 [1,1,0,0,0,0|2,0,0]=4 3194 B12R1.308 OCCC(O)c1ccccc1Br Amb24668754 [1,1,0,0,0,0|2,0,0]=4 3195 B12R1.308 OCCC(O)c1ccccc1Cl Amb25275717 [1,1,0,0,0,0|2,0,0]=4 3196 B12R1.308 OCCC(O)c1ccccc1F Amb24649873 [1,1,0,0,0,0|2,0,0]=4 3197 B12R1.308 OCC[C@@H](O)c1ccccc1F Amb25308216 [1,1,0,0,0,0|2,0,0]=4 3198 B12R1.308 OCC[C@H](O)c1ccccc1Br Amb24385097 [1,1,0,0,0,0|2,0,0]=4 3199 B12R1.308 OCC[C@H](O)c1ccccc1Cl Amb24748463 [1,1,0,0,0,0|2,0,0]=4 3200 B12R1.308 OCC[C@H](O)c1ccccc1F Amb25353877 [1,1,0,0,0,0|2,0,0]=4 3201 B12R1.308 ONCC(c1ccccc1C)O Amb17334702 [1,1,0,0,0,0|1,0,0]=3 3202 B12R1.308 ONCC(c1ccccc1Cl)O Amb17335947 [1,1,0,0,0,0|1,0,0]=3 3203 B12R1.308 ONCC(c1ccccc1F)O Amb17334837 [1,1,0,0,0,0|1,0,0]=3 3204 B12R1.20 CC(=O)C(O)c1ccc(Br)cc1 Amb25816507 [1,1,0,0,0,0|1,0,1]=4 3205 B12R1.20 CC(=O)C(O)c1ccc(F)cc1 Amb24700376 [1,1,0,0,0,0|1,0,1]=4 3206 B12R1.20 CC(=O)C(O)c1ccc(O)cc1 Amb18646451 [1,1,0,0,0,0|1,0,1]=4 3207 B12R1.20 CC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25852918 [1,1,0,0,0,0|1,0,1]=4 3208 B12R1.20 CC(=O)[C@H](O)c1ccc(Cl)cc1 Amb25371989 [1,1,0,0,0,0|1,0,1]=4 3209 B12R1.20 CC(=O)[C@H](O)c1ccc(O)cc1 Amb25807613 [1,1,0,0,0,0|1,0,1]=4 3210 B12R1.20 CC(Br)C(O)c1ccc(F)cc1 Amb24700611 [1,1,0,0,0,0|1,0,0]=3 3211 B12R1.20 CC(C(=O)c1ccc(cc1)O)C Amb17232466 [1,1,0,0,0,0|0,0,2]=4 3212 B12R1.20 CC(C(C)Br)c1ccc(Br)cc1 Amb24362041 [1,1,0,0,0,0|2,0,0]=4 3213 B12R1.20 CC(C(C)Br)c1ccc(I)cc1 Amb25159817 [1,1,0,0,0,0|2,0,0]=4 3214 B12R1.20 CC(C(C)N)c1ccc(Br)cc1 Amb18161837 [1,1,0,0,0,0|1,0,0]=3 3215 B12R1.20 CC(C(C)N)c1ccc(Cl)cc1 Amb18823024 [1,1,0,0,0,0|1,0,0]=3 3216 B12R1.20 CC(C(C)N)c1ccc(F)c[n]1 Amb24483571 [1,1,0,0,0,0|2,0,0]=4 3217 B12R1.20 CC(C(C)N)c1ccc(F)cc1 Amb18646792 [1,1,0,0,0,0|1,0,0]=3 3218 B12R1.20 CC(C(C)N)c1ccc(I)cc1 Amb25045736 [1,1,0,0,0,0|1,0,0]=3 3219 B12R1.20 CC(C(C)O)c1ccc(I)cc1 Amb24353088 [1,1,0,0,0,0|2,0,0]=4 3220 B12R1.20 CC(C(c1ccc(cc1)C)Cl)C Amb17139050 [1,1,0,0,0,0|1,0,0]=3 3221 B12R1.20 CC(C(c1ccc(cc1)C)O)S Amb10554013 [1,1,0,0,0,0|1,0,0]=3 3222 B12R1.20 CC(C)C(Br)c1ccc(Cl)cc1 Amb25757807 [1,1,0,0,0,0|1,0,0]=3 3223 B12R1.20 CC(C)C(F)c1ccc(N)cc1 Amb24368240 [1,1,0,0,0,0|1,0,0]=3 3224 B12R1.20 CC(C)C(N)c1ccc(Br)[n]c1 Amb25061968 [1,1,0,0,0,0|2,0,0]=4 3225 B12R1.20 CC(C)C(N)c1ccc(Cl)c[n]1 Amb25823927 [1,1,0,0,0,0|2,0,0]=4 3226 B12R1.20 CC(C)C(N)c1ccc(F)[n]c1 Amb18199298 [1,1,0,0,0,0|2,0,0]=4 3227 B12R1.20 CC(C)C(N)c1ccc(F)c[n]1 Amb18199296 [1,1,0,0,0,0|2,0,0]=4 3228 B12R1.20 CC(C)C(N)c1ccc(I)c[n]1 Amb25669544 [1,1,0,0,0,0|2,0,0]=4 3229 B12R1.20 CC(C)C(N)c1ccc(N)[n]c1 Amb18199661 [1,1,0,0,0,0|2,0,0]=4 3230 B12R1.20 CC(C)C(N)c1ccc(O)cc1 Amb24603967 [1,1,0,0,0,0|1,0,0]=3 3231 B12R1.20 CC(C)C(N)c1ccc(S)[n]c1 Amb25124915 [1,1,0,0,0,0|2,0,0]=4 3232 B12R1.20 CC(C)C(O)c1ccc(Br)[n]c1 Amb24719866 [1,1,0,0,0,0|1,0,0]=3 3233 B12R1.20 CC(C)C(O)c1ccc(I)cc1 Amb24445374 [1,1,0,0,0,0|0,0,0]=2 3234 B12R1.20 CC(C)C(O)c1ccc(O)cc1 Amb25773417 [1,1,0,0,0,0|0,0,0]=2 3235 B12R1.20 CC(C)N(N)c1ccc(Cl)cc1 Amb23591066 [1,1,0,0,0,0|2,0,0]=4 3236 B12R1.20 CC(C)S(=O)c1ccc(Br)cc1 Amb21856287 [1,1,0,0,0,0|1,0,1]=4 3237 B12R1.20 CC(C)S(=O)c1ccc(N)cc1 Amb18954240 [1,1,0,0,0,0|1,0,1]=4 3238 B12R1.20 CC(C)[C@@H](N)c1ccc(Br)c[n]1 Amb24411104 [1,1,0,0,0,0|2,0,0]=4 3239 B12R1.20 CC(C)[C@@H](N)c1ccc(Cl)cc1 Amb25719589 [1,1,0,0,0,0|1,0,0]=3 3240 B12R1.20 CC(C)[C@@H](N)c1ccc(F)c[n]1 Amb25707418 [1,1,0,0,0,0|2,0,0]=4 3241 B12R1.20 CC(C)[C@@H](N)c1ccc(F)cc1 Amb22298534 [1,1,0,0,0,0|1,0,0]=3 3242 B12R1.20 CC(C)[C@@H](N)c1ccc(I)c[n]1 Amb24727179 [1,1,0,0,0,0|2,0,0]=4 3243 B12R1.20 CC(C)[C@@H](N)c1ccc(I)cc1 Amb25696418 [1,1,0,0,0,0|1,0,0]=3 3244 B12R1.20 CC(C)[C@@H](N)c1ccc(N)cc1 Amb25702851 [1,1,0,0,0,0|1,0,0]=3 3245 B12R1.20 CC(C)[C@@H](N)c1ccc(O)[n]c1 Amb25667260 [1,1,0,0,0,0|2,0,0]=4 3246 B12R1.20 CC(C)[C@@H](N)c1ccc(O)c[n]1 Amb25667275 [1,1,0,0,0,0|2,0,0]=4 3247 B12R1.20 CC(C)[C@@H](N)c1ccc(S)[n]c1 Amb25336409 [1,1,0,0,0,0|2,0,0]=4 3248 B12R1.20 CC(C)[C@@H](N)c1ccc(S)cc1 Amb25710939 [1,1,0,0,0,0|1,0,0]=3 3249 B12R1.20 CC(C)[C@@H](O)c1ccc(Cl)cc1 Amb24620851 [1,1,0,0,0,0|0,0,0]=2 3250 B12R1.20 CC(C)[C@H](N)c1ccc(Br)cc1 Amb24451484 [1,1,0,0,0,0|1,0,0]=3 3251 B12R1.20 CC(C)[C@H](N)c1ccc(Cl)[n]c1 Amb24617543 [1,1,0,0,0,0|2,0,0]=4 3252 B12R1.20 CC(C)[C@H](N)c1ccc(F)[n]c1 Amb24436419 [1,1,0,0,0,0|2,0,0]=4 3253 B12R1.20 CC(C)[C@H](N)c1ccc(F)cc1 Amb22298577 [1,1,0,0,0,0|1,0,0]=3 3254 B12R1.20 CC(C)[C@H](N)c1ccc(I)c[n]1 Amb25118808 [1,1,0,0,0,0|2,0,0]=4 3255 B12R1.20 CC(C)[C@H](N)c1ccc(N)[n]c1 Amb24351182 [1,1,0,0,0,0|2,0,0]=4 3256 B12R1.20 CC(C)[C@H](N)c1ccc(N)c[n]1 Amb24662536 [1,1,0,0,0,0|2,0,0]=4 3257 B12R1.20 CC(C)[C@H](N)c1ccc(N)cc1 Amb24369019 [1,1,0,0,0,0|1,0,0]=3 3258 B12R1.20 CC(C)[C@H](N)c1ccc(O)[n]c1 Amb24487256 [1,1,0,0,0,0|2,0,0]=4 3259 B12R1.20 CC(C)[C@H](N)c1ccc(O)c[n]1 Amb25286492 [1,1,0,0,0,0|2,0,0]=4 3260 B12R1.20 CC(C)[C@H](N)c1ccc(O)cc1 Amb25128044 [1,1,0,0,0,0|1,0,0]=3 3261 B12R1.20 CC(C)[C@H](N)c1ccc(S)[n]c1 Amb25714194 [1,1,0,0,0,0|2,0,0]=4 3262 B12R1.20 CC(C)[C@H](O)c1ccc(Cl)cc1 Amb25806785 [1,1,0,0,0,0|0,0,0]=2 3263 B12R1.20 CC(F)C(N)c1ccc(Cl)cc1 Amb25269776 [1,1,0,0,0,0|2,0,0]=4 3264 B12R1.20 CC(F)C(N)c1ccc(F)cc1 Amb24564249 [1,1,0,0,0,0|2,0,0]=4 3265 B12R1.20 CC(N(c1ccc(cc1)N)C)C Amb1135234 [1,1,0,0,0,0|2,0,0]=4 3266 B12R1.20 CC(N)C(=O)c1ccc(O)cc1 Amb18828423 [1,1,0,0,0,0|0,0,2]=4 3267 B12R1.20 CC(N)C(=O)c1ccc(O)cc1 Amb24080998 [1,1,0,0,0,0|0,0,2]=4 3268 B12R1.20 CC(N)C(Cl)c1ccc(Cl)cc1 Amb25743422 [1,1,0,0,0,0|1,0,0]=3 3269 B12R1.20 CC(N)C(F)c1ccc(F)cc1 Amb25739537 [1,1,0,0,0,0|1,0,0]=3 3270 B12R1.20 CC(N)C(N)c1ccc(Cl)cc1 Amb24727054 [1,1,0,0,0,0|1,0,0]=3 3271 B12R1.20 CC(N)C(N)c1ccc(O)cc1 Amb25300599 [1,1,0,0,0,0|1,0,0]=3 3272 B12R1.20 CC(N)C(O)c1ccc(Cl)[n]c1 Amb24667856 [1,1,0,0,0,0|1,0,0]=3 3273 B12R1.20 CC(N)C(O)c1ccc(F)cc1 Amb22757366 [1,1,0,0,0,0|0,0,0]=2 3274 B12R1.20 CC(N)C(O)c1ccc(I)cc1 Amb25312162 [1,1,0,0,0,0|0,0,0]=2 3275 B12R1.20 CC(N)C(O)c1ccc(N)cc1 Amb25252875 [1,1,0,0,0,0|0,0,0]=2 3276 B12R1.20 CC(N)C(O)c1ccc(O)cc1 Amb18288260 [1,1,0,0,0,0|0,0,0]=2 3277 B12R1.20 CC(N)[C@@H](O)c1ccc(O)cc1 Amb25151120 [1,1,0,0,0,0|0,0,0]=2 3278 B12R1.20 CC(O)C(F)c1ccc(Cl)cc1 Amb25317259 [1,1,0,0,0,0|2,0,0]=4 3279 B12R1.20 CC(O)C(N)c1ccc(I)cc1 Amb24400403 [1,1,0,0,0,0|2,0,0]=4 3280 B12R1.20 CC(O)C(N)c1ccc(S)cc1 Amb24377200 [1,1,0,0,0,0|2,0,0]=4 3281 B12R1.20 CC(O)C(O)c1ccc(Cl)cc1 Amb25107771 [1,1,0,0,0,0|1,0,0]=3 3282 B12R1.20 CC(O)C(O)c1ccc(O)cc1 Amb22329663 [1,1,0,0,0,0|1,0,0]=3 3283 B12R1.20 CC(O)[C@@H](N)c1ccc(Cl)cc1 Amb24386533 [1,1,0,0,0,0|2,0,0]=4 3284 B12R1.20 CC(O)[C@@H](N)c1ccc(N)cc1 Amb24470997 [1,1,0,0,0,0|2,0,0]=4 3285 B12R1.20 CC(O)[C@@H](N)c1ccc(O)cc1 Amb25342137 [1,1,0,0,0,0|2,0,0]=4 3286 B12R1.20 CC(O)[C@@H](N)c1ccc(S)cc1 Amb25126099 [1,1,0,0,0,0|2,0,0]=4 3287 B12R1.20 CC(O)[C@H](N)c1ccc(Br)cc1 Amb25850041 [1,1,0,0,0,0|2,0,0]=4 3288 B12R1.20 CC(O)[C@H](N)c1ccc(Cl)cc1 Amb24413930 [1,1,0,0,0,0|2,0,0]=4 3289 B12R1.20 CC(O)[C@H](N)c1ccc(O)cc1 Amb24554138 [1,1,0,0,0,0|2,0,0]=4 3290 B12R1.20 CC(c1ccc(cc1)N)N(C)C Amb17090400 [1,1,0,0,0,0|2,0,0]=4 3291 B12R1.20 CN(C(C)C)c1ccc(F)cc1 Amb25846842 [1,1,0,0,0,0|2,0,0]=4 3292 B12R1.20 CN(C(C)C)c1ccc(O)cc1 Amb25684175 [1,1,0,0,0,0|2,0,0]=4 3293 B12R1.20 CN(C)C(C)c1ccc(Br)cc1 Amb21955701 [1,1,0,0,0,0|2,0,0]=4 3294 B12R1.20 CN(C)C(C)c1ccc(Cl)cc1 Amb24747924 [1,1,0,0,0,0|2,0,0]=4 3295 B12R1.20 CN(C)C(C)c1ccc(O)cc1 Amb25223024 [1,1,0,0,0,0|2,0,0]=4 3296 B12R1.20 CN(C)C(N)c1ccc(F)cc1 Amb25733778 [1,1,0,0,0,0|2,0,0]=4 3297 B12R1.20 CN(C)[C@@H](C)c1ccc(O)cc1 Amb24715954 [1,1,0,0,0,0|2,0,0]=4 3298 B12R1.20 C[C@@H](N)C(O)c1ccc(Cl)cc1 Amb25725974 [1,1,0,0,0,0|0,0,0]=2 3299 B12R1.20 C[C@@H](N)[C@@H](F)c1ccc(Cl)cc1 Amb25751526 [1,1,0,0,0,0|1,0,0]=3 3300 B12R1.20 C[C@@H](N)[C@@H](N)c1ccc(F)cc1 Amb24695402 [1,1,0,0,0,0|1,0,0]=3 3301 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(Br)cc1 Amb24525868 [1,1,0,0,0,0|0,0,0]=2 3302 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(Cl)c[n]1 Amb25292561 [1,1,0,0,0,0|1,0,0]=3 3303 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(Cl)cc1 Amb25042032 [1,1,0,0,0,0|0,0,0]=2 3304 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(N)c[n]1 Amb24542881 [1,1,0,0,0,0|1,0,0]=3 3305 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(N)cc1 Amb25073150 [1,1,0,0,0,0|0,0,0]=2 3306 B12R1.20 C[C@@H](N)[C@@H](O)c1ccc(O)c[n]1 Amb24711876 [1,1,0,0,0,0|1,0,0]=3 3307 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(Cl)cc1 Amb24546378 [1,1,0,0,0,0|0,0,0]=2 3308 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(F)[n]c1 Amb24542880 [1,1,0,0,0,0|1,0,0]=3 3309 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(F)c[n]1 Amb25200301 [1,1,0,0,0,0|1,0,0]=3 3310 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(N)cc1 Amb25222708 [1,1,0,0,0,0|0,0,0]=2 3311 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(O)[n]c1 Amb24629004 [1,1,0,0,0,0|1,0,0]=3 3312 B12R1.20 C[C@@H](N)[C@H](O)c1ccc(O)cc1 Amb25337509 [1,1,0,0,0,0|0,0,0]=2 3313 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(Br)cc1 Amb24382068 [1,1,0,0,0,0|2,0,0]=4 3314 B12R1.20 C[C@@H](O)[C@@H](N)c1ccc(N)cc1 Amb24537803 [1,1,0,0,0,0|2,0,0]=4 3315 B12R1.20 C[C@@H](O)[C@@H](O)c1ccc(Cl)cc1 Amb25823078 [1,1,0,0,0,0|1,0,0]=3 3316 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(Br)cc1 Amb25055183 [1,1,0,0,0,0|2,0,0]=4 3317 B12R1.20 C[C@@H](O)[C@H](N)c1ccc(F)cc1 Amb25335384 [1,1,0,0,0,0|2,0,0]=4 3318 B12R1.20 C[C@@H](O)[C@H](O)c1ccc(O)cc1 Amb24584477 [1,1,0,0,0,0|1,0,0]=3 3319 B12R1.20 C[C@H](N)[C@@H](N)c1ccc(Br)[n]c1 Amb25200074 [1,1,0,0,0,0|2,0,0]=4 3320 B12R1.20 C[C@H](N)[C@@H](N)c1ccc(Br)c[n]1 Amb24542336 [1,1,0,0,0,0|2,0,0]=4 3321 B12R1.20 C[C@H](N)[C@@H](N)c1ccc(Br)cc1 Amb24587602 [1,1,0,0,0,0|1,0,0]=3 3322 B12R1.20 C[C@H](N)[C@@H](N)c1ccc(O)cc1 Amb24542552 [1,1,0,0,0,0|1,0,0]=3 3323 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(Cl)c[n]1 Amb25326811 [1,1,0,0,0,0|1,0,0]=3 3324 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(F)[n]c1 Amb24598867 [1,1,0,0,0,0|1,0,0]=3 3325 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(F)c[n]1 Amb25199447 [1,1,0,0,0,0|1,0,0]=3 3326 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(N)cc1 Amb25372279 [1,1,0,0,0,0|0,0,0]=2 3327 B12R1.20 C[C@H](N)[C@@H](O)c1ccc(O)[n]c1 Amb24542883 [1,1,0,0,0,0|1,0,0]=3 3328 B12R1.20 C[C@H](N)[C@H](N)c1ccc(F)cc1 Amb24468725 [1,1,0,0,0,0|1,0,0]=3 3329 B12R1.20 C[C@H](N)[C@H](O)c1ccc(Br)cc1 Amb24587603 [1,1,0,0,0,0|0,0,0]=2 3330 B12R1.20 C[C@H](N)[C@H](O)c1ccc(Cl)cc1 Amb24542735 [1,1,0,0,0,0|0,0,0]=2 3331 B12R1.20 C[C@H](N)[C@H](O)c1ccc(F)[n]c1 Amb24542884 [1,1,0,0,0,0|1,0,0]=3 3332 B12R1.20 C[C@H](N)[C@H](O)c1ccc(F)cc1 Amb24565248 [1,1,0,0,0,0|0,0,0]=2 3333 B12R1.20 C[C@H](N)[C@H](O)c1ccc(N)[n]c1 Amb25242652 [1,1,0,0,0,0|1,0,0]=3 3334 B12R1.20 C[C@H](N)[C@H](O)c1ccc(N)cc1 Amb25152375 [1,1,0,0,0,0|0,0,0]=2 3335 B12R1.20 C[C@H](N)[C@H](O)c1ccc(O)c[n]1 Amb25233213 [1,1,0,0,0,0|1,0,0]=3 3336 B12R1.20 C[C@H](O)[C@@H](F)c1ccc(F)cc1 Amb25221387 [1,1,0,0,0,0|2,0,0]=4 3337 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(Cl)cc1 Amb25669590 [1,1,0,0,0,0|2,0,0]=4 3338 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(I)cc1 Amb25369710 [1,1,0,0,0,0|2,0,0]=4 3339 B12R1.20 C[C@H](O)[C@@H](N)c1ccc(N)cc1 Amb24567692 [1,1,0,0,0,0|2,0,0]=4 3340 B12R1.20 C[C@H](O)[C@@H](O)c1ccc(Cl)cc1 Amb25058607 [1,1,0,0,0,0|1,0,0]=3 3341 B12R1.20 C[C@H](O)[C@H](N)c1ccc(Br)cc1 Amb25805244 [1,1,0,0,0,0|2,0,0]=4 3342 B12R1.20 C[C@H](O)[C@H](N)c1ccc(I)cc1 Amb25696576 [1,1,0,0,0,0|2,0,0]=4 3343 B12R1.20 C[C@H](O)[C@H](N)c1ccc(O)cc1 Amb24377198 [1,1,0,0,0,0|2,0,0]=4 3344 B12R1.20 C[C@H](O)[C@H](N)c1ccc(S)cc1 Amb25340511 [1,1,0,0,0,0|2,0,0]=4 3345 B12R1.20 C[C@H](O)[C@H](O)c1ccc(Cl)cc1 Amb25788065 [1,1,0,0,0,0|1,0,0]=3 3346 B12R1.20 C[C@H](O)[C@H](O)c1ccc(F)cc1 Amb25820217 [1,1,0,0,0,0|1,0,0]=3 3347 B12R1.20 Cc1[n]cc(c[n]1)[C@@H](O)C(C)C Amb24583838 [1,1,0,0,0,0|2,0,0]=4 3348 B12R1.20 Cc1c[n]c([n]c1)C(O)C(C)C Amb25704079 [1,1,0,0,0,0|2,0,0]=4 3349 B12R1.20 Cc1c[n]c(c[n]1)C(O)C(C)C Amb24603765 [1,1,0,0,0,0|2,0,0]=4 3350 B12R1.20 Cc1ccc([n]c1)C(N)C(C)C Amb24488517 [1,1,0,0,0,0|2,0,0]=4 3351 B12R1.20 Cc1ccc([n]c1)C(O)C(C)N Amb25106186 [1,1,0,0,0,0|1,0,0]=3 3352 B12R1.20 Cc1ccc([n]c1)[C@@H](O)[C@@H](C)N Amb25227967 [1,1,0,0,0,0|1,0,0]=3 3353 B12R1.20 Cc1ccc([n]c1)[C@@H](O)[C@H](C)N Amb25755486 [1,1,0,0,0,0|1,0,0]=3 3354 B12R1.20 Cc1ccc(c[n]1)C(N)C(C)C Amb18828645 [1,1,0,0,0,0|2,0,0]=4 3355 B12R1.20 Cc1ccc(c[n]1)[C@@H](N)C(C)C Amb25667276 [1,1,0,0,0,0|2,0,0]=4 3356 B12R1.20 Cc1ccc(c[n]1)[C@@H](O)C(C)C Amb24705934 [1,1,0,0,0,0|1,0,0]=3 3357 B12R1.20 Cc1ccc(c[n]1)[C@@H](O)[C@@H](C)N Amb24550595 [1,1,0,0,0,0|1,0,0]=3 3358 B12R1.20 Cc1ccc(c[n]1)[C@H](N)C(C)C Amb24723836 [1,1,0,0,0,0|2,0,0]=4 3359 B12R1.20 Cc1ccc(c[n]1)[C@H](O)[C@H](C)N Amb25201708 [1,1,0,0,0,0|1,0,0]=3 3360 B12R1.20 Cc1ccc(cc1)C(=O)C(C)N Amb24081001 [1,1,0,0,0,0|0,0,2]=4 3361 B12R1.20 Cc1ccc(cc1)C(=O)[C@H](C)N Amb25757021 [1,1,0,0,0,0|0,0,2]=4 3362 B12R1.20 Cc1ccc(cc1)C(Br)C(C)C Amb24591940 [1,1,0,0,0,0|1,0,0]=3 3363 B12R1.20 Cc1ccc(cc1)C(C)C(C)N Amb18829123 [1,1,0,0,0,0|1,0,0]=3 3364 B12R1.20 Cc1ccc(cc1)C(C)N(C)C Amb25271218 [1,1,0,0,0,0|2,0,0]=4 3365 B12R1.20 Cc1ccc(cc1)C(N)C(C)N Amb25148768 [1,1,0,0,0,0|1,0,0]=3 3366 B12R1.20 Cc1ccc(cc1)C(N)N(C)C Amb25103902 [1,1,0,0,0,0|2,0,0]=4 3367 B12R1.20 Cc1ccc(cc1)C(O)C(C)=C Amb25098914 [1,1,0,0,0,0|0,0,2]=4 3368 B12R1.20 Cc1ccc(cc1)C(O)C(N)=N Amb24084346 [1,1,0,0,0,0|1,0,1]=4 3369 B12R1.20 Cc1ccc(cc1)C(O)C(N)=O Amb18800898 [1,1,0,0,0,0|1,0,1]=4 3370 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(C)C Amb22298586 [1,1,0,0,0,0|1,0,0]=3 3371 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(C)C Amb25798041 [1,1,0,0,0,0|1,0,0]=3 3372 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(C)C Amb24642710 [1,1,0,0,0,0|0,0,0]=2 3373 B12R1.20 Cc1ccc(cc1)[C@@H](O)C(N)=N Amb25331476 [1,1,0,0,0,0|1,0,1]=4 3374 B12R1.20 Cc1ccc(cc1)[C@@H](O)[C@@H](C)N Amb24550856 [1,1,0,0,0,0|0,0,0]=2 3375 B12R1.20 Cc1ccc(cc1)[C@@H](O)[C@H](C)O Amb24431029 [1,1,0,0,0,0|1,0,0]=3 3376 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@@H](C)O Amb25343914 [1,1,0,0,0,0|2,0,0]=4 3377 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@H](C)O Amb24412147 [1,1,0,0,0,0|2,0,0]=4 3378 B12R1.20 Cc1ccc(cc1)[C@H](N)C(C)C Amb22298546 [1,1,0,0,0,0|1,0,0]=3 3379 B12R1.20 Cc1ccc(cc1)[C@H](N)C(C)C Amb24341531 [1,1,0,0,0,0|1,0,0]=3 3380 B12R1.20 Cc1ccc(cc1)[C@H](O)C(C)=O Amb25320143 [1,1,0,0,0,0|1,0,1]=4 3381 B12R1.20 Cc1ccc(cc1)[C@H](O)C(N)=N Amb24738424 [1,1,0,0,0,0|1,0,1]=4 3382 B12R1.20 Cc1ccc(cc1)[C@H](O)[C@@H](C)O Amb25816305 [1,1,0,0,0,0|1,0,0]=3 3383 B12R1.20 Cc1ccc(cc1)[C@H](O)[C@H](C)O Amb25158064 [1,1,0,0,0,0|1,0,0]=3 3384 B12R1.20 ClC(c1ccc(cc1)Br)C(C)C Amb17160234 [1,1,0,0,0,0|1,0,0]=3 3385 B12R1.20 ClC(c1ccc(cc1)Cl)C(C)C Amb17139905 [1,1,0,0,0,0|1,0,0]=3 3386 B12R1.20 ClC(c1ccc(cc1)F)C(C)C Amb17139161 [1,1,0,0,0,0|1,0,0]=3 3387 B12R1.20 NC(=N)C(O)c1ccc(Cl)cc1 Amb25667224 [1,1,0,0,0,0|1,0,1]=4 3388 B12R1.20 NC(=N)C(O)c1ccc(F)cc1 Amb25224827 [1,1,0,0,0,0|1,0,1]=4 3389 B12R1.20 NC(=O)C(O)c1ccc(Br)cc1 Amb24100617 [1,1,0,0,0,0|1,0,1]=4 3390 B12R1.20 NC(=O)C(O)c1ccc(Cl)cc1 Amb19075669 [1,1,0,0,0,0|1,0,1]=4 3391 B12R1.20 NC(=O)C(O)c1ccc(F)cc1 Amb18806073 [1,1,0,0,0,0|1,0,1]=4 3392 B12R1.20 NC(=O)C(O)c1ccc(I)cc1 Amb25700495 [1,1,0,0,0,0|1,0,1]=4 3393 B12R1.20 NC(=O)C(O)c1ccc(O)cc1 Amb18805580 [1,1,0,0,0,0|1,0,1]=4 3394 B12R1.20 NC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25346222 [1,1,0,0,0,0|1,0,1]=4 3395 B12R1.20 NC(=O)[C@H](O)c1ccc(Cl)cc1 Amb24398035 [1,1,0,0,0,0|1,0,1]=4 3396 B12R1.20 NC(=S)C(O)c1ccc(O)cc1 Amb24487581 [1,1,0,0,0,0|1,0,1]=4 3397 B12R1.20 NC(c1ccc(cc1)Br)C(N)C Amb13953206 [1,1,0,0,0,0|1,0,0]=3 3398 B12R1.20 NC(c1ccc(cc1)Br)C(O)C Amb17248848 [1,1,0,0,0,0|2,0,0]=4 3399 B12R1.20 NC(c1ccc(cc1)Cl)C(O)C Amb17234268 [1,1,0,0,0,0|2,0,0]=4 3400 B12R1.20 Nc1ccc(cc1)C(O)C(F)F Amb22387865 [1,1,0,0,0,0|2,0,0]=4 3401 B12R1.20 Nc1ccc(cc1)C(O)C(N)=O Amb24100608 [1,1,0,0,0,0|1,0,1]=4 3402 B12R1.20 OC(C(Cl)Cl)c1ccc(Cl)cc1 Amb25280173 [1,1,0,0,0,0|2,0,0]=4 3403 B12R1.20 OC(C(F)F)c1ccc(Br)cc1 Amb22387863 [1,1,0,0,0,0|2,0,0]=4 3404 B12R1.20 OC(c1ccc(cc1)Br)C(C)C Amb17142527 [1,1,0,0,0,0|0,0,0]=2 3405 B12R1.20 OC(c1ccc(cc1)Cl)C(C)C Amb17139096 [1,1,0,0,0,0|0,0,0]=2 3406 B12R1.20 OC(c1ccc(cc1)F)C(C)C Amb17138631 [1,1,0,0,0,0|0,0,0]=2 3407 B12R1.20 OC(c1ccc(cc1)N)C(C)C Amb17101751 [1,1,0,0,0,0|0,0,0]=2 3408 B12R1.20 O[C@@H](C(F)F)c1ccc(Br)cc1 Amb25083349 [1,1,0,0,0,0|2,0,0]=4 3409 B12R1.20 O[C@@H](C(F)F)c1ccc(F)cc1 Amb24525137 [1,1,0,0,0,0|2,0,0]=4 3410 B12R1.20 O[C@H](C(F)F)c1ccc(Cl)cc1 Amb25058520 [1,1,0,0,0,0|2,0,0]=4 3411 B12R1.20 Oc1ccc(cc1)C(O)C(Cl)Cl Amb25375454 [1,1,0,0,0,0|2,0,0]=4 3412 B12R1.124 CC(=C)C(O)c1ccccc1Cl Amb25333923 [1,1,0,0,0,0|0,0,2]=4 3413 B12R1.124 CC(=C)C(O)c1ccccc1F Amb25136591 [1,1,0,0,0,0|0,0,2]=4 3414 B12R1.124 CC(=C)C(O)c1ccccc1O Amb24497319 [1,1,0,0,0,0|0,0,2]=4 3415 B12R1.124 CC(=O)C(O)c1ccccc1Cl Amb25248975 [1,1,0,0,0,0|1,0,1]=4 3416 B12R1.124 CC(=O)[C@@H](O)c1ccccc1F Amb25306551 [1,1,0,0,0,0|1,0,1]=4 3417 B12R1.124 CC(C(=O)c1ccccc1Br)C Amb17343722 [1,1,0,0,0,0|0,0,2]=4 3418 B12R1.124 CC(C(=O)c1ccccc1C)C Amb17232414 [1,1,0,0,0,0|0,0,2]=4 3419 B12R1.124 CC(C(=O)c1ccccc1Cl)C Amb17233963 [1,1,0,0,0,0|0,0,2]=4 3420 B12R1.124 CC(C(=O)c1ccccc1F)C Amb17232578 [1,1,0,0,0,0|0,0,2]=4 3421 B12R1.124 CC(C(=O)c1ccccc1O)C Amb17232471 [1,1,0,0,0,0|0,0,2]=4 3422 B12R1.124 CC(C(C)N)c1ccccc1Br Amb18161843 [1,1,0,0,0,0|1,0,0]=3 3423 B12R1.124 CC(C(C)N)c1ccccc1Cl Amb18191712 [1,1,0,0,0,0|1,0,0]=3 3424 B12R1.124 CC(C(C)N)c1ccccc1F Amb18199473 [1,1,0,0,0,0|1,0,0]=3 3425 B12R1.124 CC(C(C)O)c1ccccc1Br Amb25725772 [1,1,0,0,0,0|2,0,0]=4 3426 B12R1.124 CC(C(C)O)c1ccccc1Cl Amb25787409 [1,1,0,0,0,0|2,0,0]=4 3427 B12R1.124 CC(C(C)O)c1ccccc1O Amb24357145 [1,1,0,0,0,0|2,0,0]=4 3428 B12R1.124 CC(C(c1ccccc1C)N)C Amb17232440 [1,1,0,0,0,0|1,0,0]=3 3429 B12R1.124 CC(C(c1ccccc1C)N)O Amb17232544 [1,1,0,0,0,0|2,0,0]=4 3430 B12R1.124 CC(C(c1ccccc1C)O)C Amb17232498 [1,1,0,0,0,0|0,0,0]=2 3431 B12R1.124 CC(C(c1ccccc1Cl)N)C Amb17234043 [1,1,0,0,0,0|1,0,0]=3 3432 B12R1.124 CC(C(c1ccccc1Cl)N)O Amb17234262 [1,1,0,0,0,0|2,0,0]=4 3433 B12R1.124 CC(C(c1ccccc1Cl)O)C Amb17234163 [1,1,0,0,0,0|0,0,0]=2 3434 B12R1.124 CC(C(c1ccccc1F)N)C Amb17232641 [1,1,0,0,0,0|1,0,0]=3 3435 B12R1.124 CC(C(c1ccccc1F)N)O Amb17232699 [1,1,0,0,0,0|2,0,0]=4 3436 B12R1.124 CC(C(c1ccccc1F)O)C Amb17232670 [1,1,0,0,0,0|0,0,0]=2 3437 B12R1.124 CC(C)C(=O)c1ccccc1N Amb18645870 [1,1,0,0,0,0|0,0,2]=4 3438 B12R1.124 CC(C)C(C)c1ccc[n]c1N Amb25287311 [1,1,0,0,0,0|2,0,0]=4 3439 B12R1.124 CC(C)C(Cl)c1c[n]ccc1N Amb24406090 [1,1,0,0,0,0|2,0,0]=4 3440 B12R1.124 CC(C)C(Cl)c1cc[n]cc1F Amb24703626 [1,1,0,0,0,0|2,0,0]=4 3441 B12R1.124 CC(C)C(Cl)c1ccc[n]c1N Amb25721516 [1,1,0,0,0,0|2,0,0]=4 3442 B12R1.124 CC(C)C(F)c1ccccc1O Amb25848397 [1,1,0,0,0,0|1,0,0]=3 3443 B12R1.124 CC(C)C(N)c1[n]cccc1Br Amb24455028 [1,1,0,0,0,0|2,0,0]=4 3444 B12R1.124 CC(C)C(N)c1[n]cccc1Cl Amb25769890 [1,1,0,0,0,0|2,0,0]=4 3445 B12R1.124 CC(C)C(N)c1[n]cccc1O Amb24470692 [1,1,0,0,0,0|2,0,0]=4 3446 B12R1.124 CC(C)C(N)c1c[n]ccc1Cl Amb18822601 [1,1,0,0,0,0|2,0,0]=4 3447 B12R1.124 CC(C)C(N)c1c[n]ccc1O Amb25288339 [1,1,0,0,0,0|2,0,0]=4 3448 B12R1.124 CC(C)C(N)c1cc[n]cc1Br Amb24383698 [1,1,0,0,0,0|2,0,0]=4 3449 B12R1.124 CC(C)C(N)c1cc[n]cc1Cl Amb25678044 [1,1,0,0,0,0|2,0,0]=4 3450 B12R1.124 CC(C)C(N)c1cc[n]cc1F Amb25843824 [1,1,0,0,0,0|2,0,0]=4 3451 B12R1.124 CC(C)C(N)c1ccc[n]c1Cl Amb25669431 [1,1,0,0,0,0|2,0,0]=4 3452 B12R1.124 CC(C)C(N)c1ccc[n]c1O Amb25785414 [1,1,0,0,0,0|2,0,0]=4 3453 B12R1.124 CC(C)C(N)c1ccc[n]c1S Amb25667119 [1,1,0,0,0,0|2,0,0]=4 3454 B12R1.124 CC(C)C(N)c1ccccc1Br Amb25292237 [1,1,0,0,0,0|1,0,0]=3 3455 B12R1.124 CC(C)C(N)c1ccccc1N Amb25756091 [1,1,0,0,0,0|1,0,0]=3 3456 B12R1.124 CC(C)C(N)c1ccccc1O Amb24654334 [1,1,0,0,0,0|1,0,0]=3 3457 B12R1.124 CC(C)C(O)c1[n]c[n]cc1Br Amb24687452 [1,1,0,0,0,0|2,0,0]=4 3458 B12R1.124 CC(C)C(O)c1[n]cccc1Br Amb25071191 [1,1,0,0,0,0|1,0,0]=3 3459 B12R1.124 CC(C)C(O)c1[n]cccc1F Amb24685755 [1,1,0,0,0,0|1,0,0]=3 3460 B12R1.124 CC(C)C(O)c1c[n]ccc1N Amb25736680 [1,1,0,0,0,0|1,0,0]=3 3461 B12R1.124 CC(C)C(O)c1cc[n]cc1F Amb25677761 [1,1,0,0,0,0|1,0,0]=3 3462 B12R1.124 CC(C)C(O)c1ccc[n]c1N Amb24433034 [1,1,0,0,0,0|1,0,0]=3 3463 B12R1.124 CC(C)C(O)c1ccccc1I Amb25827416 [1,1,0,0,0,0|0,0,0]=2 3464 B12R1.124 CC(C)C(O)c1ccccc1N Amb22059603 [1,1,0,0,0,0|0,0,0]=2 3465 B12R1.124 CC(C)C(O)c1ccccc1O Amb18646530 [1,1,0,0,0,0|0,0,0]=2 3466 B12R1.124 CC(C)S(=O)c1ccccc1N Amb18954225 [1,1,0,0,0,0|1,0,1]=4 3467 B12R1.124 CC(C)S(=O)c1ccccc1O Amb18648964 [1,1,0,0,0,0|1,0,1]=4 3468 B12R1.124 CC(C)[C@@H](N)c1[n]cccc1Cl Amb24390215 [1,1,0,0,0,0|2,0,0]=4 3469 B12R1.124 CC(C)[C@@H](N)c1[n]cccc1O Amb25149879 [1,1,0,0,0,0|2,0,0]=4 3470 B12R1.124 CC(C)[C@@H](N)c1c[n]ccc1N Amb24484206 [1,1,0,0,0,0|2,0,0]=4 3471 B12R1.124 CC(C)[C@@H](N)c1cc[n]cc1Cl Amb25084562 [1,1,0,0,0,0|2,0,0]=4 3472 B12R1.124 CC(C)[C@@H](N)c1ccc[n]c1Cl Amb24700423 [1,1,0,0,0,0|2,0,0]=4 3473 B12R1.124 CC(C)[C@@H](N)c1ccc[n]c1N Amb24393363 [1,1,0,0,0,0|2,0,0]=4 3474 B12R1.124 CC(C)[C@@H](N)c1ccccc1Cl Amb22756531 [1,1,0,0,0,0|1,0,0]=3 3475 B12R1.124 CC(C)[C@@H](N)c1ccccc1Cl Amb24680865 [1,1,0,0,0,0|1,0,0]=3 3476 B12R1.124 CC(C)[C@@H](N)c1ccccc1F Amb24587736 [1,1,0,0,0,0|1,0,0]=3 3477 B12R1.124 CC(C)[C@@H](N)c1ccccc1N Amb25724327 [1,1,0,0,0,0|1,0,0]=3 3478 B12R1.124 CC(C)[C@@H](O)c1ccccc1Br Amb24686679 [1,1,0,0,0,0|0,0,0]=2 3479 B12R1.124 CC(C)[C@@H](O)c1ccccc1Cl Amb24719810 [1,1,0,0,0,0|0,0,0]=2 3480 B12R1.124 CC(C)[C@@H](O)c1ccccc1F Amb24492943 [1,1,0,0,0,0|0,0,0]=2 3481 B12R1.124 CC(C)[C@H](N)c1[n]cccc1F Amb24545372 [1,1,0,0,0,0|2,0,0]=4 3482 B12R1.124 CC(C)[C@H](N)c1c[n]ccc1O Amb24670286 [1,1,0,0,0,0|2,0,0]=4 3483 B12R1.124 CC(C)[C@H](N)c1cc[n]cc1Br Amb24382640 [1,1,0,0,0,0|2,0,0]=4 3484 B12R1.124 CC(C)[C@H](N)c1ccc[n]c1Cl Amb24386026 [1,1,0,0,0,0|2,0,0]=4 3485 B12R1.124 CC(C)[C@H](N)c1ccc[n]c1F Amb25149880 [1,1,0,0,0,0|2,0,0]=4 3486 B12R1.124 CC(C)[C@H](N)c1ccc[n]c1N Amb24401509 [1,1,0,0,0,0|2,0,0]=4 3487 B12R1.124 CC(C)[C@H](N)c1ccc[n]c1O Amb25378811 [1,1,0,0,0,0|2,0,0]=4 3488 B12R1.124 CC(C)[C@H](N)c1ccc[n]c1S Amb24667966 [1,1,0,0,0,0|2,0,0]=4 3489 B12R1.124 CC(C)[C@H](N)c1ccccc1Br Amb25800191 [1,1,0,0,0,0|1,0,0]=3 3490 B12R1.124 CC(C)[C@H](N)c1ccccc1Cl Amb22503756 [1,1,0,0,0,0|1,0,0]=3 3491 B12R1.124 CC(C)[C@H](N)c1ccccc1Cl Amb25680148 [1,1,0,0,0,0|1,0,0]=3 3492 B12R1.124 CC(C)[C@H](N)c1ccccc1F Amb25324331 [1,1,0,0,0,0|1,0,0]=3 3493 B12R1.124 CC(C)[C@H](N)c1ccccc1S Amb25335399 [1,1,0,0,0,0|1,0,0]=3 3494 B12R1.124 CC(C)[C@H](O)c1ccccc1Br Amb25308308 [1,1,0,0,0,0|0,0,0]=2 3495 B12R1.124 CC(C)[C@H](O)c1ccccc1F Amb25841622 [1,1,0,0,0,0|0,0,0]=2 3496 B12R1.124 CC(Cl)C(C)c1ccccc1F Amb24474326 [1,1,0,0,0,0|2,0,0]=4 3497 B12R1.124 CC(F)C(N)c1ccccc1Cl Amb25194797 [1,1,0,0,0,0|2,0,0]=4 3498 B12R1.124 CC(F)C(N)c1ccccc1O Amb24559551 [1,1,0,0,0,0|2,0,0]=4 3499 B12R1.124 CC(N(c1ccccc1N)C)C Amb1141202 [1,1,0,0,0,0|2,0,0]=4 3500 B12R1.124 CC(N)C(=O)c1ccccc1Br Amb18160374 [1,1,0,0,0,0|0,0,2]=4 3501 B12R1.124 CC(N)C(=O)c1ccccc1Cl Amb18823031 [1,1,0,0,0,0|0,0,2]=4 3502 B12R1.124 CC(N)C(=O)c1ccccc1F Amb18827241 [1,1,0,0,0,0|0,0,2]=4 3503 B12R1.124 CC(N)C(N)c1ccccc1F Amb25326663 [1,1,0,0,0,0|1,0,0]=3 3504 B12R1.124 CC(N)C(O)c1[n]cccc1Cl Amb24699389 [1,1,0,0,0,0|1,0,0]=3 3505 B12R1.124 CC(N)C(O)c1[n]cccc1F Amb24559653 [1,1,0,0,0,0|1,0,0]=3 3506 B12R1.124 CC(N)C(O)c1[n]cccc1O Amb25291134 [1,1,0,0,0,0|1,0,0]=3 3507 B12R1.124 CC(N)C(O)c1ccc[n]c1N Amb24564767 [1,1,0,0,0,0|1,0,0]=3 3508 B12R1.124 CC(N)C(O)c1ccccc1F Amb19149220 [1,1,0,0,0,0|0,0,0]=2 3509 B12R1.124 CC(N)C(O)c1ccccc1N Amb25242675 [1,1,0,0,0,0|0,0,0]=2 3510 B12R1.124 CC(N)C(O)c1ccccc1O Amb18827198 [1,1,0,0,0,0|0,0,0]=2 3511 B12R1.124 CC(O)C(N)c1ccccc1I Amb24741618 [1,1,0,0,0,0|2,0,0]=4 3512 B12R1.124 CC(O)C(N)c1ccccc1N Amb24548013 [1,1,0,0,0,0|2,0,0]=4 3513 B12R1.124 CC(O)C(N)c1ccccc1O Amb24746675 [1,1,0,0,0,0|2,0,0]=4 3514 B12R1.124 CC(O)C(O)c1cc[n]cc1F Amb25816318 [1,1,0,0,0,0|2,0,0]=4 3515 B12R1.124 CC(O)C(O)c1ccc[n]c1N Amb25816478 [1,1,0,0,0,0|2,0,0]=4 3516 B12R1.124 CC(O)C(O)c1ccccc1O Amb24722821 [1,1,0,0,0,0|1,0,0]=3 3517 B12R1.124 CC(O)[C@@H](N)c1ccccc1F Amb25091100 [1,1,0,0,0,0|2,0,0]=4 3518 B12R1.124 CC(O)[C@@H](N)c1ccccc1N Amb24447701 [1,1,0,0,0,0|2,0,0]=4 3519 B12R1.124 CC(O)[C@@H](O)c1ccccc1Br Amb24420423 [1,1,0,0,0,0|1,0,0]=3 3520 B12R1.124 CC(O)[C@H](N)c1ccccc1Br Amb25265718 [1,1,0,0,0,0|2,0,0]=4 3521 B12R1.124 CC(O)[C@H](N)c1ccccc1Cl Amb24341803 [1,1,0,0,0,0|2,0,0]=4 3522 B12R1.124 CC(O)[C@H](N)c1ccccc1F Amb25676286 [1,1,0,0,0,0|2,0,0]=4 3523 B12R1.124 CC(O)[C@H](N)c1ccccc1I Amb25677515 [1,1,0,0,0,0|2,0,0]=4 3524 B12R1.124 CC(O)[C@H](N)c1ccccc1O Amb25859103 [1,1,0,0,0,0|2,0,0]=4 3525 B12R1.124 CN(C(C)C)c1ccccc1I Amb24346867 [1,1,0,0,0,0|2,0,0]=4 3526 B12R1.124 CN(C)C(C)c1ccccc1Br Amb25154604 [1,1,0,0,0,0|2,0,0]=4 3527 B12R1.124 CN(C)C(C)c1ccccc1S Amb24694175 [1,1,0,0,0,0|2,0,0]=4 3528 B12R1.124 CN(C)[C@@H](C)c1ccccc1O Amb25094366 [1,1,0,0,0,0|2,0,0]=4 3529 B12R1.124 C[C@@H](N)[C@@H](O)c1[n]cccc1F Amb25200295 [1,1,0,0,0,0|1,0,0]=3 3530 B12R1.124 C[C@@H](N)[C@@H](O)c1[n]cccc1N Amb24542734 [1,1,0,0,0,0|1,0,0]=3 3531 B12R1.124 C[C@@H](N)[C@@H](O)c1[n]cccc1O Amb24542878 [1,1,0,0,0,0|1,0,0]=3 3532 B12R1.124 C[C@@H](N)[C@@H](O)c1c[n]ccc1Cl Amb25200215 [1,1,0,0,0,0|1,0,0]=3 3533 B12R1.124 C[C@@H](N)[C@@H](O)c1ccc[n]c1N Amb24746089 [1,1,0,0,0,0|1,0,0]=3 3534 B12R1.124 C[C@@H](N)[C@@H](O)c1ccccc1Cl Amb24652735 [1,1,0,0,0,0|0,0,0]=2 3535 B12R1.124 C[C@@H](N)[C@@H](O)c1ccccc1O Amb25322123 [1,1,0,0,0,0|0,0,0]=2 3536 B12R1.124 C[C@@H](N)[C@H](O)c1[n]cccc1F Amb24642002 [1,1,0,0,0,0|1,0,0]=3 3537 B12R1.124 C[C@@H](N)[C@H](O)c1c[n]ccc1Cl Amb25241687 [1,1,0,0,0,0|1,0,0]=3 3538 B12R1.124 C[C@@H](N)[C@H](O)c1ccccc1F Amb24599005 [1,1,0,0,0,0|0,0,0]=2 3539 B12R1.124 C[C@@H](O)[C@@H](C)c1ccccc1N Amb24695229 [1,1,0,0,0,0|2,0,0]=4 3540 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1Br Amb25826654 [1,1,0,0,0,0|2,0,0]=4 3541 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1F Amb24484299 [1,1,0,0,0,0|2,0,0]=4 3542 B12R1.124 C[C@@H](O)[C@@H](N)c1ccccc1I Amb25667335 [1,1,0,0,0,0|2,0,0]=4 3543 B12R1.124 C[C@@H](O)[C@@H](O)c1ccccc1Cl Amb25256358 [1,1,0,0,0,0|1,0,0]=3 3544 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1Br Amb24710646 [1,1,0,0,0,0|2,0,0]=4 3545 B12R1.124 C[C@@H](O)[C@H](N)c1ccccc1F Amb24417148 [1,1,0,0,0,0|2,0,0]=4 3546 B12R1.124 C[C@@H](O)[C@H](O)c1ccccc1Cl Amb25676585 [1,1,0,0,0,0|1,0,0]=3 3547 B12R1.124 C[C@@H](O)[C@H](O)c1ccccc1F Amb24397257 [1,1,0,0,0,0|1,0,0]=3 3548 B12R1.124 C[C@H](N)[C@@H](N)c1ccc[n]c1N Amb24697829 [1,1,0,0,0,0|2,0,0]=4 3549 B12R1.124 C[C@H](N)[C@@H](N)c1ccccc1I Amb24604776 [1,1,0,0,0,0|1,0,0]=3 3550 B12R1.124 C[C@H](N)[C@@H](O)c1[n]cccc1Cl Amb25201707 [1,1,0,0,0,0|1,0,0]=3 3551 B12R1.124 C[C@H](N)[C@@H](O)c1[n]cccc1F Amb24678297 [1,1,0,0,0,0|1,0,0]=3 3552 B12R1.124 C[C@H](N)[C@@H](O)c1[n]cccc1N Amb24563998 [1,1,0,0,0,0|1,0,0]=3 3553 B12R1.124 C[C@H](N)[C@@H](O)c1c[n]ccc1Cl Amb25233644 [1,1,0,0,0,0|1,0,0]=3 3554 B12R1.124 C[C@H](N)[C@@H](O)c1ccc[n]c1N Amb24595904 [1,1,0,0,0,0|1,0,0]=3 3555 B12R1.124 C[C@H](N)[C@@H](O)c1ccccc1F Amb25200173 [1,1,0,0,0,0|0,0,0]=2 3556 B12R1.124 C[C@H](N)[C@@H](O)c1ccccc1O Amb25202139 [1,1,0,0,0,0|0,0,0]=2 3557 B12R1.124 C[C@H](N)[C@H](O)c1[n]cccc1O Amb25259271 [1,1,0,0,0,0|1,0,0]=3 3558 B12R1.124 C[C@H](N)[C@H](O)c1ccc[n]c1Cl Amb24542725 [1,1,0,0,0,0|1,0,0]=3 3559 B12R1.124 C[C@H](N)[C@H](O)c1ccc[n]c1N Amb24595896 [1,1,0,0,0,0|1,0,0]=3 3560 B12R1.124 C[C@H](N)[C@H](O)c1ccccc1Cl Amb25252277 [1,1,0,0,0,0|0,0,0]=2 3561 B12R1.124 C[C@H](N)[C@H](O)c1ccccc1N Amb25379221 [1,1,0,0,0,0|0,0,0]=2 3562 B12R1.124 C[C@H](O)[C@@H](C)c1ccccc1N Amb24636832 [1,1,0,0,0,0|2,0,0]=4 3563 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1Br Amb25771694 [1,1,0,0,0,0|2,0,0]=4 3564 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1Cl Amb25245236 [1,1,0,0,0,0|2,0,0]=4 3565 B12R1.124 C[C@H](O)[C@@H](N)c1ccccc1F Amb25849179 [1,1,0,0,0,0|2,0,0]=4 3566 B12R1.124 C[C@H](O)[C@@H](O)c1ccccc1Cl Amb25280204 [1,1,0,0,0,0|1,0,0]=3 3567 B12R1.124 C[C@H](O)[C@@H](O)c1ccccc1O Amb25320177 [1,1,0,0,0,0|1,0,0]=3 3568 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1Cl Amb24732364 [1,1,0,0,0,0|2,0,0]=4 3569 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1F Amb24392926 [1,1,0,0,0,0|2,0,0]=4 3570 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1N Amb24487127 [1,1,0,0,0,0|2,0,0]=4 3571 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1O Amb24522959 [1,1,0,0,0,0|2,0,0]=4 3572 B12R1.124 C[C@H](O)[C@H](N)c1ccccc1S Amb25667120 [1,1,0,0,0,0|2,0,0]=4 3573 B12R1.124 C[C@H](O)[C@H](O)c1ccccc1F Amb25220590 [1,1,0,0,0,0|1,0,0]=3 3574 B12R1.124 Cc1[n]cccc1C(O)C(C)N Amb24617736 [1,1,0,0,0,0|1,0,0]=3 3575 B12R1.124 Cc1[n]cccc1[C@@H](O)[C@H](C)N Amb24587432 [1,1,0,0,0,0|1,0,0]=3 3576 B12R1.124 Cc1[n]cccc1[C@H](O)[C@@H](C)N Amb25200032 [1,1,0,0,0,0|1,0,0]=3 3577 B12R1.124 Cc1[n]cccc1[C@H](O)[C@H](C)N Amb25233645 [1,1,0,0,0,0|1,0,0]=3 3578 B12R1.124 Cc1c[n]ccc1C(N)C(C)C Amb25842943 [1,1,0,0,0,0|2,0,0]=4 3579 B12R1.124 Cc1c[n]ccc1C(O)C(C)C Amb24643448 [1,1,0,0,0,0|1,0,0]=3 3580 B12R1.124 Cc1cc[n]cc1C(N)C(C)C Amb18828708 [1,1,0,0,0,0|2,0,0]=4 3581 B12R1.124 Cc1cc[n]cc1C(O)C(C)N Amb18827552 [1,1,0,0,0,0|1,0,0]=3 3582 B12R1.124 Cc1cc[n]cc1[C@@H](O)[C@H](C)N Amb25199683 [1,1,0,0,0,0|1,0,0]=3 3583 B12R1.124 Cc1cc[n]cc1[C@H](N)C(C)C Amb25718251 [1,1,0,0,0,0|2,0,0]=4 3584 B12R1.124 Cc1cc[n]cc1[C@H](O)[C@@H](C)N Amb24694460 [1,1,0,0,0,0|1,0,0]=3 3585 B12R1.124 Cc1cc[n]cc1[C@H](O)[C@H](C)N Amb25233214 [1,1,0,0,0,0|1,0,0]=3 3586 B12R1.124 Cc1ccc[n]c1C(N)C(C)C Amb18956588 [1,1,0,0,0,0|2,0,0]=4 3587 B12R1.124 Cc1ccc[n]c1C(O)C(C)C Amb18182633 [1,1,0,0,0,0|1,0,0]=3 3588 B12R1.124 Cc1ccc[n]c1C(O)C(C)N Amb25269668 [1,1,0,0,0,0|1,0,0]=3 3589 B12R1.124 Cc1ccc[n]c1[C@@H](N)C(C)C Amb25327561 [1,1,0,0,0,0|2,0,0]=4 3590 B12R1.124 Cc1ccc[n]c1[C@@H](O)[C@@H](C)N Amb24585190 [1,1,0,0,0,0|1,0,0]=3 3591 B12R1.124 Cc1ccc[n]c1[C@H](O)[C@@H](C)N Amb24542879 [1,1,0,0,0,0|1,0,0]=3 3592 B12R1.124 Cc1ccccc1C(=O)C(C)N Amb18829245 [1,1,0,0,0,0|0,0,2]=4 3593 B12R1.124 Cc1ccccc1C(C)C(C)N Amb24619318 [1,1,0,0,0,0|1,0,0]=3 3594 B12R1.124 Cc1ccccc1C(Cl)C(C)C Amb24524989 [1,1,0,0,0,0|1,0,0]=3 3595 B12R1.124 Cc1ccccc1C(N)C(C)N Amb25804632 [1,1,0,0,0,0|1,0,0]=3 3596 B12R1.124 Cc1ccccc1C(O)C(C)=O Amb25712931 [1,1,0,0,0,0|1,0,1]=4 3597 B12R1.124 Cc1ccccc1C(O)C(N)=N Amb25159647 [1,1,0,0,0,0|1,0,1]=4 3598 B12R1.124 Cc1ccccc1C(O)C(N)=O Amb18800897 [1,1,0,0,0,0|1,0,1]=4 3599 B12R1.124 Cc1ccccc1N(C)C(C)C Amb25091925 [1,1,0,0,0,0|2,0,0]=4 3600 B12R1.124 Cc1ccccc1[C@@H](N)C(C)C Amb22298584 [1,1,0,0,0,0|1,0,0]=3 3601 B12R1.124 Cc1ccccc1[C@@H](N)[C@@H](C)O Amb25751402 [1,1,0,0,0,0|2,0,0]=4 3602 B12R1.124 Cc1ccccc1[C@@H](O)C(C)=O Amb24722864 [1,1,0,0,0,0|1,0,1]=4 3603 B12R1.124 Cc1ccccc1[C@H](N)C(C)C Amb22298544 [1,1,0,0,0,0|1,0,0]=3 3604 B12R1.124 Cc1ccccc1[C@H](N)C(C)O Amb24438525 [1,1,0,0,0,0|2,0,0]=4 3605 B12R1.124 Cc1ccccc1[C@H](N)[C@@H](C)O Amb25787588 [1,1,0,0,0,0|2,0,0]=4 3606 B12R1.124 Cc1ccccc1[C@H](N)[C@H](C)N Amb24595580 [1,1,0,0,0,0|1,0,0]=3 3607 B12R1.124 Cc1ccccc1[C@H](N)[C@H](C)O Amb25340339 [1,1,0,0,0,0|2,0,0]=4 3608 B12R1.124 Cc1ccccc1[C@H](O)C(C)C Amb24688260 [1,1,0,0,0,0|0,0,0]=2 3609 B12R1.124 Cc1ccccc1[C@H](O)[C@@H](C)N Amb25375759 [1,1,0,0,0,0|0,0,0]=2 3610 B12R1.124 Cc1ccccc1[C@H](O)[C@H](C)N Amb25771749 [1,1,0,0,0,0|0,0,0]=2 3611 B12R1.124 NC(=N)C(O)c1ccccc1Br Amb24100285 [1,1,0,0,0,0|1,0,1]=4 3612 B12R1.124 NC(=N)C(O)c1ccccc1Cl Amb24070108 [1,1,0,0,0,0|1,0,1]=4 3613 B12R1.124 NC(=O)C(O)c1ccccc1Br Amb24123019 [1,1,0,0,0,0|1,0,1]=4 3614 B12R1.124 NC(=O)C(O)c1ccccc1Cl Amb19075671 [1,1,0,0,0,0|1,0,1]=4 3615 B12R1.124 NC(=O)C(O)c1ccccc1F Amb18806074 [1,1,0,0,0,0|1,0,1]=4 3616 B12R1.124 NC(=O)[C@@H](O)c1ccccc1Cl Amb22799808 [1,1,0,0,0,0|1,0,1]=4 3617 B12R1.124 NC(=O)[C@H](O)c1ccccc1Cl Amb24355348 [1,1,0,0,0,0|1,0,1]=4 3618 B12R1.124 NC(=S)C(O)c1ccccc1Cl Amb25159696 [1,1,0,0,0,0|1,0,1]=4 3619 B12R1.124 NC(=S)C(O)c1ccccc1F Amb25159483 [1,1,0,0,0,0|1,0,1]=4 3620 B12R1.124 OC(C(Cl)Cl)c1ccccc1Cl Amb17666633 [1,1,0,0,0,0|2,0,0]=4 3621 B12R1.124 OC(C(F)F)c1ccccc1Br Amb25064949 [1,1,0,0,0,0|2,0,0]=4 3622 B12R1.124 OC(C(F)F)c1ccccc1F Amb24485539 [1,1,0,0,0,0|2,0,0]=4 3623 B12R1.124 OC(c1cnccc1Cl)C(C)C Amb10975228 [1,1,0,0,0,0|1,0,0]=3 3624 B12R1.124 O[C@@H](C(F)F)c1ccccc1F Amb25705023 [1,1,0,0,0,0|2,0,0]=4 3625 B12R1.124 O[C@H](C(F)F)c1ccccc1Br Amb25125372 [1,1,0,0,0,0|2,0,0]=4 3626 B12R1.124 O[C@H](C(F)F)c1ccccc1F Amb25776110 [1,1,0,0,0,0|2,0,0]=4 3627 B12R1.124 Oc1ccccc1C(O)C(F)F Amb25112530 [1,1,0,0,0,0|2,0,0]=4 3628 B12R1.225 CC(=C)C(O)c1cccc(I)c1 Amb24660150 [1,1,0,0,0,0|0,0,2]=4 3629 B12R1.225 CC(=O)C(O)c1cccc(F)c1 Amb24706962 [1,1,0,0,0,0|1,0,1]=4 3630 B12R1.225 CC(=O)C(c1cccc(c1)Cl)O Amb17611032 [1,1,0,0,0,0|1,0,1]=4 3631 B12R1.225 CC(=O)C(c1cccc(c1)O)O Amb17594122 [1,1,0,0,0,0|1,0,1]=4 3632 B12R1.225 CC(=O)[C@H](O)c1cc(O)ccc1 Amb25855760 [1,1,0,0,0,0|1,0,1]=4 3633 B12R1.225 CC(=O)[C@H](O)c1cccc(Cl)c1 Amb25832686 [1,1,0,0,0,0|1,0,1]=4 3634 B12R1.225 CC(Br)C(C)c1cccc(Cl)c1 Amb25071912 [1,1,0,0,0,0|2,0,0]=4 3635 B12R1.225 CC(C(C)N)c1cc(Br)ccc1 Amb18161825 [1,1,0,0,0,0|1,0,0]=3 3636 B12R1.225 CC(C(C)N)c1cc(F)ccc1 Amb18199472 [1,1,0,0,0,0|1,0,0]=3 3637 B12R1.225 CC(C(C)N)c1cc(I)ccc1 Amb24581687 [1,1,0,0,0,0|1,0,0]=3 3638 B12R1.225 CC(C(C)O)c1cc(Cl)ccc1 Amb24363903 [1,1,0,0,0,0|2,0,0]=4 3639 B12R1.225 CC(C(C)O)c1cc(O)ccc1 Amb25674463 [1,1,0,0,0,0|2,0,0]=4 3640 B12R1.225 CC(C(c1cccc(c1)Br)N)C Amb17248094 [1,1,0,0,0,0|1,0,0]=3 3641 B12R1.225 CC(C(c1cccc(c1)Br)N)O Amb17248845 [1,1,0,0,0,0|2,0,0]=4 3642 B12R1.225 CC(C(c1cccc(c1)C)N)C Amb17232441 [1,1,0,0,0,0|1,0,0]=3 3643 B12R1.225 CC(C(c1cccc(c1)C)N)O Amb17232547 [1,1,0,0,0,0|2,0,0]=4 3644 B12R1.225 CC(C(c1cccc(c1)C)O)C Amb17232500 [1,1,0,0,0,0|0,0,0]=2 3645 B12R1.225 CC(C(c1cccc(c1)Cl)N)C Amb17234044 [1,1,0,0,0,0|1,0,0]=3 3646 B12R1.225 CC(C(c1cccc(c1)Cl)N)O Amb17234265 [1,1,0,0,0,0|2,0,0]=4 3647 B12R1.225 CC(C(c1cccc(c1)Cl)O)C Amb17234165 [1,1,0,0,0,0|0,0,0]=2 3648 B12R1.225 CC(C(c1cccc(c1)F)N)C Amb17232648 [1,1,0,0,0,0|1,0,0]=3 3649 B12R1.225 CC(C(c1cccc(c1)F)O)C Amb17232672 [1,1,0,0,0,0|0,0,0]=2 3650 B12R1.225 CC(C(c1cccc(c1)O)O)N Amb16233102 [1,1,0,0,0,0|0,0,0]=2 3651 B12R1.225 CC(C)C(=O)c1cccc(O)c1 Amb24532514 [1,1,0,0,0,0|0,0,2]=4 3652 B12R1.225 CC(C)C(Br)c1c[n]cc(Br)c1 Amb23509148 [1,1,0,0,0,0|2,0,0]=4 3653 B12R1.225 CC(C)C(C)c1cccc(Br)c1 Amb25091718 [1,1,0,0,0,0|1,0,0]=3 3654 B12R1.225 CC(C)C(F)c1cccc(N)c1 Amb24439319 [1,1,0,0,0,0|1,0,0]=3 3655 B12R1.225 CC(C)C(N)C1=CC=CC(=O)N1 Amb18827549 [1,1,0,0,0,0|2,0,0]=4 3656 B12R1.225 CC(C)C(N)c1c[n]cc(Br)c1 Amb23450057 [1,1,0,0,0,0|2,0,0]=4 3657 B12R1.225 CC(C)C(N)c1c[n]cc(Cl)c1 Amb25077151 [1,1,0,0,0,0|2,0,0]=4 3658 B12R1.225 CC(C)C(N)c1c[n]cc(F)c1 Amb18954867 [1,1,0,0,0,0|2,0,0]=4 3659 B12R1.225 CC(C)C(N)c1c[n]cc(I)c1 Amb25726857 [1,1,0,0,0,0|2,0,0]=4 3660 B12R1.225 CC(C)C(N)c1c[n]cc(N)c1 Amb25152305 [1,1,0,0,0,0|2,0,0]=4 3661 B12R1.225 CC(C)C(N)c1cc(Br)cc[n]1 Amb25081930 [1,1,0,0,0,0|2,0,0]=4 3662 B12R1.225 CC(C)C(N)c1cc(N)cc[n]1 Amb24589619 [1,1,0,0,0,0|2,0,0]=4 3663 B12R1.225 CC(C)C(N)c1cc[n]c(Br)c1 Amb25365815 [1,1,0,0,0,0|2,0,0]=4 3664 B12R1.225 CC(C)C(N)c1cc[n]c(Cl)c1 Amb25667256 [1,1,0,0,0,0|2,0,0]=4 3665 B12R1.225 CC(C)C(N)c1cc[n]c(N)c1 Amb25709588 [1,1,0,0,0,0|2,0,0]=4 3666 B12R1.225 CC(C)C(N)c1cc[n]c(O)c1 Amb24487378 [1,1,0,0,0,0|2,0,0]=4 3667 B12R1.225 CC(C)C(N)c1cccc(Cl)[n]1 Amb24359748 [1,1,0,0,0,0|2,0,0]=4 3668 B12R1.225 CC(C)C(N)c1cccc(F)[n]1 Amb25113479 [1,1,0,0,0,0|2,0,0]=4 3669 B12R1.225 CC(C)C(N)c1cccc(I)[n]1 Amb24667829 [1,1,0,0,0,0|2,0,0]=4 3670 B12R1.225 CC(C)C(N)c1cccc(I)c1 Amb24443925 [1,1,0,0,0,0|1,0,0]=3 3671 B12R1.225 CC(C)C(N)c1cccc(N)[n]1 Amb25794121 [1,1,0,0,0,0|2,0,0]=4 3672 B12R1.225 CC(C)C(N)c1cccc(N)c1 Amb24589361 [1,1,0,0,0,0|1,0,0]=3 3673 B12R1.225 CC(C)C(N)c1cccc(S)c1 Amb24394155 [1,1,0,0,0,0|1,0,0]=3 3674 B12R1.225 CC(C)C(O)c1c[n]cc(Br)c1 Amb23450055 [1,1,0,0,0,0|1,0,0]=3 3675 B12R1.225 CC(C)C(O)c1c[n]cc(Cl)c1 Amb25068014 [1,1,0,0,0,0|1,0,0]=3 3676 B12R1.225 CC(C)C(O)c1c[n]cc(F)c1 Amb18180200 [1,1,0,0,0,0|1,0,0]=3 3677 B12R1.225 CC(C)C(O)c1c[n]cc(I)c1 Amb24555449 [1,1,0,0,0,0|1,0,0]=3 3678 B12R1.225 CC(C)C(O)c1cccc(I)c1 Amb24418344 [1,1,0,0,0,0|0,0,0]=2 3679 B12R1.225 CC(C)C(O)c1cccc(O)c1 Amb25093811 [1,1,0,0,0,0|0,0,0]=2 3680 B12R1.225 CC(C)S(=O)c1cccc(F)c1 Amb24487396 [1,1,0,0,0,0|1,0,1]=4 3681 B12R1.225 CC(C)[C@@H](N)c1c[n]cc(Cl)c1 Amb25131709 [1,1,0,0,0,0|2,0,0]=4 3682 B12R1.225 CC(C)[C@@H](N)c1c[n]cc(F)c1 Amb25831113 [1,1,0,0,0,0|2,0,0]=4 3683 B12R1.225 CC(C)[C@@H](N)c1c[n]cc(N)c1 Amb24487106 [1,1,0,0,0,0|2,0,0]=4 3684 B12R1.225 CC(C)[C@@H](N)c1c[n]cc(O)c1 Amb25138026 [1,1,0,0,0,0|2,0,0]=4 3685 B12R1.225 CC(C)[C@@H](N)c1cc(I)cc[n]1 Amb25764065 [1,1,0,0,0,0|2,0,0]=4 3686 B12R1.225 CC(C)[C@@H](N)c1cc(N)cc[n]1 Amb25112728 [1,1,0,0,0,0|2,0,0]=4 3687 B12R1.225 CC(C)[C@@H](N)c1cc[n]c(Br)c1 Amb25302515 [1,1,0,0,0,0|2,0,0]=4 3688 B12R1.225 CC(C)[C@@H](N)c1cc[n]c(Cl)c1 Amb25367311 [1,1,0,0,0,0|2,0,0]=4 3689 B12R1.225 CC(C)[C@@H](N)c1cc[n]c(F)c1 Amb24487257 [1,1,0,0,0,0|2,0,0]=4 3690 B12R1.225 CC(C)[C@@H](N)c1cc[n]c(O)c1 Amb25831099 [1,1,0,0,0,0|2,0,0]=4 3691 B12R1.225 CC(C)[C@@H](N)c1cccc(Br)[n]1 Amb25669681 [1,1,0,0,0,0|2,0,0]=4 3692 B12R1.225 CC(C)[C@@H](N)c1cccc(F)[n]1 Amb25735060 [1,1,0,0,0,0|2,0,0]=4 3693 B12R1.225 CC(C)[C@@H](N)c1cccc(I)[n]1 Amb25301736 [1,1,0,0,0,0|2,0,0]=4 3694 B12R1.225 CC(C)[C@@H](N)c1cccc(I)c1 Amb25148823 [1,1,0,0,0,0|1,0,0]=3 3695 B12R1.225 CC(C)[C@@H](N)c1cccc(N)[n]1 Amb25059883 [1,1,0,0,0,0|2,0,0]=4 3696 B12R1.225 CC(C)[C@@H](N)c1cccc(N)c1 Amb24665620 [1,1,0,0,0,0|1,0,0]=3 3697 B12R1.225 CC(C)[C@@H](N)c1cccc(O)c1 Amb25149816 [1,1,0,0,0,0|1,0,0]=3 3698 B12R1.225 CC(C)[C@@H](N)c1cccc(S)c1 Amb25808018 [1,1,0,0,0,0|1,0,0]=3 3699 B12R1.225 CC(C)[C@@H](O)c1cccc(Cl)c1 Amb25353663 [1,1,0,0,0,0|0,0,0]=2 3700 B12R1.225 CC(C)[C@H](N)c1c[n]cc(Cl)c1 Amb24487102 [1,1,0,0,0,0|2,0,0]=4 3701 B12R1.225 CC(C)[C@H](N)c1c[n]cc(I)c1 Amb24678890 [1,1,0,0,0,0|2,0,0]=4 3702 B12R1.225 CC(C)[C@H](N)c1cc(Cl)cc[n]1 Amb25842646 [1,1,0,0,0,0|2,0,0]=4 3703 B12R1.225 CC(C)[C@H](N)c1cc[n]c(Cl)c1 Amb25727689 [1,1,0,0,0,0|2,0,0]=4 3704 B12R1.225 CC(C)[C@H](N)c1cc[n]c(F)c1 Amb24460803 [1,1,0,0,0,0|2,0,0]=4 3705 B12R1.225 CC(C)[C@H](N)c1cc[n]c(N)c1 Amb25111622 [1,1,0,0,0,0|2,0,0]=4 3706 B12R1.225 CC(C)[C@H](N)c1cc[n]c(O)c1 Amb25367183 [1,1,0,0,0,0|2,0,0]=4 3707 B12R1.225 CC(C)[C@H](N)c1cccc(Br)[n]1 Amb25737045 [1,1,0,0,0,0|2,0,0]=4 3708 B12R1.225 CC(C)[C@H](N)c1cccc(F)[n]1 Amb25138025 [1,1,0,0,0,0|2,0,0]=4 3709 B12R1.225 CC(C)[C@H](N)c1cccc(N)c1 Amb25044426 [1,1,0,0,0,0|1,0,0]=3 3710 B12R1.225 CC(C)[C@H](N)c1cccc(S)c1 Amb24484155 [1,1,0,0,0,0|1,0,0]=3 3711 B12R1.225 CC(C)[C@H](O)c1cccc(Cl)c1 Amb24646355 [1,1,0,0,0,0|0,0,0]=2 3712 B12R1.225 CC(C)[C@H](O)c1cccc(O)c1 Amb24591800 [1,1,0,0,0,0|0,0,0]=2 3713 B12R1.225 CC(N)C(=O)c1cccc(Br)c1 Amb18160379 [1,1,0,0,0,0|0,0,2]=4 3714 B12R1.225 CC(N)C(=O)c1cccc(Cl)c1 Amb23437980 [1,1,0,0,0,0|0,0,2]=4 3715 B12R1.225 CC(N)C(=O)c1cccc(F)c1 Amb18827240 [1,1,0,0,0,0|0,0,2]=4 3716 B12R1.225 CC(N)C(=O)c1cccc(O)c1 Amb18828422 [1,1,0,0,0,0|0,0,2]=4 3717 B12R1.225 CC(N)C(F)c1cc(Cl)ccc1 Amb24715490 [1,1,0,0,0,0|1,0,0]=3 3718 B12R1.225 CC(N)C(N)c1cc(Br)[n]cc1 Amb24656012 [1,1,0,0,0,0|2,0,0]=4 3719 B12R1.225 CC(N)C(N)c1cc(O)ccc1 Amb25327877 [1,1,0,0,0,0|1,0,0]=3 3720 B12R1.225 CC(N)C(N)c1cccc(Br)[n]1 Amb25327878 [1,1,0,0,0,0|2,0,0]=4 3721 B12R1.225 CC(N)C(O)c1cc(Br)c[n]c1 Amb25040896 [1,1,0,0,0,0|1,0,0]=3 3722 B12R1.225 CC(N)C(O)c1cc(F)ccc1 Amb20623984 [1,1,0,0,0,0|0,0,0]=2 3723 B12R1.225 CC(N)C(O)c1cc(I)ccc1 Amb24365022 [1,1,0,0,0,0|0,0,0]=2 3724 B12R1.225 CC(N)C(O)c1cc(N)cc[n]1 Amb24612451 [1,1,0,0,0,0|1,0,0]=3 3725 B12R1.225 CC(N)C(O)c1cccc(F)[n]1 Amb24714924 [1,1,0,0,0,0|1,0,0]=3 3726 B12R1.225 CC(N)[C@H](O)c1cc(O)ccc1 Amb25059140 [1,1,0,0,0,0|0,0,0]=2 3727 B12R1.225 CC(O)C(N)c1cc(F)ccc1 Amb18199109 [1,1,0,0,0,0|2,0,0]=4 3728 B12R1.225 CC(O)C(N)c1cc(N)ccc1 Amb24504719 [1,1,0,0,0,0|2,0,0]=4 3729 B12R1.225 CC(O)C(N)c1cc(S)ccc1 Amb25840847 [1,1,0,0,0,0|2,0,0]=4 3730 B12R1.225 CC(O)C(O)c1cc(F)c[n]c1 Amb25354432 [1,1,0,0,0,0|2,0,0]=4 3731 B12R1.225 CC(O)C(O)c1cc(F)ccc1 Amb25244367 [1,1,0,0,0,0|1,0,0]=3 3732 B12R1.225 CC(O)[C@@H](N)c1cc(Cl)ccc1 Amb25840441 [1,1,0,0,0,0|2,0,0]=4 3733 B12R1.225 CC(O)[C@@H](N)c1cc(I)ccc1 Amb25034880 [1,1,0,0,0,0|2,0,0]=4 3734 B12R1.225 CC(O)[C@@H](N)c1cc(S)ccc1 Amb25308042 [1,1,0,0,0,0|2,0,0]=4 3735 B12R1.225 CC(O)[C@H](N)c1cc(F)ccc1 Amb25721022 [1,1,0,0,0,0|2,0,0]=4 3736 B12R1.225 CC(O)[C@H](N)c1cc(O)ccc1 Amb25751697 [1,1,0,0,0,0|2,0,0]=4 3737 B12R1.225 CC([C@@H](c1cccc(c1)Br)N)C Amb10603244 [1,1,0,0,0,0|1,0,0]=3 3738 B12R1.225 CC([C@@H](c1cccc(c1)Cl)N)C Amb10603245 [1,1,0,0,0,0|1,0,0]=3 3739 B12R1.225 CC([C@@H](c1cccc(c1)F)N)C Amb10603110 [1,1,0,0,0,0|1,0,0]=3 3740 B12R1.225 CC([C@H](c1cccc(c1)Br)N)C Amb10603202 [1,1,0,0,0,0|1,0,0]=3 3741 B12R1.225 CC([C@H](c1cccc(c1)Cl)N)C Amb10603203 [1,1,0,0,0,0|1,0,0]=3 3742 B12R1.225 CC([C@H](c1cccc(c1)F)N)C Amb10603106 [1,1,0,0,0,0|1,0,0]=3 3743 B12R1.225 CN(C(C)C)c1cccc(F)c1 Amb25262074 [1,1,0,0,0,0|2,0,0]=4 3744 B12R1.225 CN(C(c1cccc(c1)N)C)C Amb17090316 [1,1,0,0,0,0|2,0,0]=4 3745 B12R1.225 CN(C)C(C)c1cccc(Br)c1 Amb25257843 [1,1,0,0,0,0|2,0,0]=4 3746 B12R1.225 CN(C)C(C)c1cccc(F)c1 Amb25792131 [1,1,0,0,0,0|2,0,0]=4 3747 B12R1.225 C[C@@H](N)[C@@H](O)c1cc(Br)ccc1 Amb24764175 [1,1,0,0,0,0|0,0,0]=2 3748 B12R1.225 C[C@@H](N)[C@@H](O)c1cc(Cl)c[n]c1 Amb24550855 [1,1,0,0,0,0|1,0,0]=3 3749 B12R1.225 C[C@@H](N)[C@@H](O)c1cc(N)cc[n]1 Amb25367496 [1,1,0,0,0,0|1,0,0]=3 3750 B12R1.225 C[C@@H](N)[C@@H](O)c1cc(N)ccc1 Amb24622471 [1,1,0,0,0,0|0,0,0]=2 3751 B12R1.225 C[C@@H](N)[C@@H](O)c1cc(O)ccc1 Amb25667059 [1,1,0,0,0,0|0,0,0]=2 3752 B12R1.225 C[C@@H](N)[C@H](O)c1cc(Br)ccc1 Amb25259372 [1,1,0,0,0,0|0,0,0]=2 3753 B12R1.225 C[C@@H](N)[C@H](O)c1cc(F)ccc1 Amb24542550 [1,1,0,0,0,0|0,0,0]=2 3754 B12R1.225 C[C@@H](N)[C@H](O)c1cc(N)cc[n]1 Amb24542732 [1,1,0,0,0,0|1,0,0]=3 3755 B12R1.225 C[C@@H](N)[C@H](O)c1cc(N)ccc1 Amb24622104 [1,1,0,0,0,0|0,0,0]=2 3756 B12R1.225 C[C@@H](N)[C@H](O)c1cc(O)ccc1 Amb25837431 [1,1,0,0,0,0|0,0,0]=2 3757 B12R1.225 C[C@@H](O)[C@@H](N)c1cc(Cl)ccc1 Amb24437217 [1,1,0,0,0,0|2,0,0]=4 3758 B12R1.225 C[C@@H](O)[C@@H](N)c1cc(O)ccc1 Amb25794132 [1,1,0,0,0,0|2,0,0]=4 3759 B12R1.225 C[C@@H](O)[C@@H](O)c1cc(Cl)ccc1 Amb24355161 [1,1,0,0,0,0|1,0,0]=3 3760 B12R1.225 C[C@@H](O)[C@H](N)c1cc(Br)ccc1 Amb24758910 [1,1,0,0,0,0|2,0,0]=4 3761 B12R1.225 C[C@@H](O)[C@H](N)c1cc(Cl)ccc1 Amb24368391 [1,1,0,0,0,0|2,0,0]=4 3762 B12R1.225 C[C@@H](O)[C@H](N)c1cc(N)ccc1 Amb25106841 [1,1,0,0,0,0|2,0,0]=4 3763 B12R1.225 C[C@@H](O)[C@H](O)c1cc(Cl)ccc1 Amb25158199 [1,1,0,0,0,0|1,0,0]=3 3764 B12R1.225 C[C@@H]([C@H](C)N)c1cc(O)ccc1 Amb25804222 [1,1,0,0,0,0|1,0,0]=3 3765 B12R1.225 C[C@H](N)C(O)c1cc(Br)ccc1 Amb24734916 [1,1,0,0,0,0|0,0,0]=2 3766 B12R1.225 C[C@H](N)[C@@H](N)c1cc(Br)ccc1 Amb24542730 [1,1,0,0,0,0|1,0,0]=3 3767 B12R1.225 C[C@H](N)[C@@H](N)c1cc(Cl)ccc1 Amb25300574 [1,1,0,0,0,0|1,0,0]=3 3768 B12R1.225 C[C@H](N)[C@@H](N)c1cc(F)ccc1 Amb24707906 [1,1,0,0,0,0|1,0,0]=3 3769 B12R1.225 C[C@H](N)[C@@H](N)c1cc(O)ccc1 Amb25201709 [1,1,0,0,0,0|1,0,0]=3 3770 B12R1.225 C[C@H](N)[C@@H](N)c1cccc(Br)[n]1 Amb25200177 [1,1,0,0,0,0|2,0,0]=4 3771 B12R1.225 C[C@H](N)[C@@H](O)c1cc(Cl)[n]cc1 Amb24558751 [1,1,0,0,0,0|1,0,0]=3 3772 B12R1.225 C[C@H](N)[C@@H](O)c1cc(F)c[n]c1 Amb25259358 [1,1,0,0,0,0|1,0,0]=3 3773 B12R1.225 C[C@H](N)[C@@H](O)c1cc(F)ccc1 Amb24412457 [1,1,0,0,0,0|0,0,0]=2 3774 B12R1.225 C[C@H](N)[C@@H](O)c1cccc(F)[n]1 Amb25302293 [1,1,0,0,0,0|1,0,0]=3 3775 B12R1.225 C[C@H](N)[C@H](O)c1cc(Cl)ccc1 Amb25322520 [1,1,0,0,0,0|0,0,0]=2 3776 B12R1.225 C[C@H](N)[C@H](O)c1cc(F)c[n]c1 Amb24540346 [1,1,0,0,0,0|1,0,0]=3 3777 B12R1.225 C[C@H](N)[C@H](O)c1cc(N)cc[n]1 Amb24542885 [1,1,0,0,0,0|1,0,0]=3 3778 B12R1.225 C[C@H](N)[C@H](O)c1cc(O)ccc1 Amb21855942 [1,1,0,0,0,0|0,0,0]=2 3779 B12R1.225 C[C@H](N)[C@H](O)c1cccc(F)[n]1 Amb24563567 [1,1,0,0,0,0|1,0,0]=3 3780 B12R1.225 C[C@H](O)[C@@H](F)c1cc(Cl)ccc1 Amb25343856 [1,1,0,0,0,0|2,0,0]=4 3781 B12R1.225 C[C@H](O)[C@@H](F)c1cc(F)ccc1 Amb24431044 [1,1,0,0,0,0|2,0,0]=4 3782 B12R1.225 C[C@H](O)[C@@H](N)c1cc(Br)ccc1 Amb25238682 [1,1,0,0,0,0|2,0,0]=4 3783 B12R1.225 C[C@H](O)[C@@H](N)c1cc(Cl)ccc1 Amb25076736 [1,1,0,0,0,0|2,0,0]=4 3784 B12R1.225 C[C@H](O)[C@@H](N)c1cc(S)ccc1 Amb24554119 [1,1,0,0,0,0|2,0,0]=4 3785 B12R1.225 C[C@H](O)[C@H](N)c1cc(Cl)ccc1 Amb25761316 [1,1,0,0,0,0|2,0,0]=4 3786 B12R1.225 C[C@H](O)[C@H](O)c1cc(F)ccc1 Amb25220949 [1,1,0,0,0,0|1,0,0]=3 3787 B12R1.225 C[C@H]([C@@H](C)O)c1cc(Cl)ccc1 Amb25803016 [1,1,0,0,0,0|2,0,0]=4 3788 B12R1.225 Cc1c[n]cc(c1)C(N)C(C)C Amb18828648 [1,1,0,0,0,0|2,0,0]=4 3789 B12R1.225 Cc1c[n]cc(c1)[C@@H](N)C(C)C Amb24411528 [1,1,0,0,0,0|2,0,0]=4 3790 B12R1.225 Cc1c[n]cc(c1)[C@@H](O)C(C)C Amb25847760 [1,1,0,0,0,0|1,0,0]=3 3791 B12R1.225 Cc1c[n]cc(c1)[C@@H](O)[C@@H](C)N Amb24742384 [1,1,0,0,0,0|1,0,0]=3 3792 B12R1.225 Cc1c[n]cc(c1)[C@H](O)[C@@H](C)N Amb25200171 [1,1,0,0,0,0|1,0,0]=3 3793 B12R1.225 Cc1cc(cc[n]1)C(N)C(C)C Amb25757126 [1,1,0,0,0,0|2,0,0]=4 3794 B12R1.225 Cc1cc(cc[n]1)[C@@H](O)[C@@H](C)N Amb24741320 [1,1,0,0,0,0|1,0,0]=3 3795 B12R1.225 Cc1cc(cc[n]1)[C@H](O)[C@@H](C)N Amb24746959 [1,1,0,0,0,0|1,0,0]=3 3796 B12R1.225 Cc1cc(ccc1)C(=O)C(C)N Amb18829244 [1,1,0,0,0,0|0,0,2]=4 3797 B12R1.225 Cc1cc(ccc1)C(O)C(F)F Amb25760781 [1,1,0,0,0,0|2,0,0]=4 3798 B12R1.225 Cc1cc(ccc1)C(O)C(N)=O Amb18800895 [1,1,0,0,0,0|1,0,1]=4 3799 B12R1.225 Cc1cc[n]c(c1)C(O)C(C)C Amb24364362 [1,1,0,0,0,0|1,0,0]=3 3800 B12R1.225 Cc1cc[n]c(c1)C(O)C(C)N Amb25294302 [1,1,0,0,0,0|1,0,0]=3 3801 B12R1.225 Cc1cc[n]c(c1)[C@@H](N)C(C)C Amb25087086 [1,1,0,0,0,0|2,0,0]=4 3802 B12R1.225 Cc1cc[n]c(c1)[C@@H](O)[C@H](C)N Amb24694461 [1,1,0,0,0,0|1,0,0]=3 3803 B12R1.225 Cc1cccc([n]1)C(C)C(C)C Amb25820612 [1,1,0,0,0,0|2,0,0]=4 3804 B12R1.225 Cc1cccc([n]1)C(N)C(C)C Amb18828649 [1,1,0,0,0,0|2,0,0]=4 3805 B12R1.225 Cc1cccc([n]1)C(O)C(C)C Amb25353477 [1,1,0,0,0,0|1,0,0]=3 3806 B12R1.225 Cc1cccc([n]1)[C@@H](N)C(C)C Amb24744392 [1,1,0,0,0,0|2,0,0]=4 3807 B12R1.225 Cc1cccc([n]1)[C@@H](O)[C@H](C)N Amb25379051 [1,1,0,0,0,0|1,0,0]=3 3808 B12R1.225 Cc1cccc([n]1)[C@H](N)C(C)C Amb25703054 [1,1,0,0,0,0|2,0,0]=4 3809 B12R1.225 Cc1cccc(c1)C(=O)C(C)C Amb17232416 [1,1,0,0,0,0|0,0,2]=4 3810 B12R1.225 Cc1cccc(c1)C(Br)C(C)C Amb25381207 [1,1,0,0,0,0|1,0,0]=3 3811 B12R1.225 Cc1cccc(c1)C(C)C(C)Cl Amb25316621 [1,1,0,0,0,0|2,0,0]=4 3812 B12R1.225 Cc1cccc(c1)C(Cl)C(C)C Amb24458718 [1,1,0,0,0,0|1,0,0]=3 3813 B12R1.225 Cc1cccc(c1)C(N)C(C)F Amb25202396 [1,1,0,0,0,0|2,0,0]=4 3814 B12R1.225 Cc1cccc(c1)C(O)C(C)=O Amb25801127 [1,1,0,0,0,0|1,0,1]=4 3815 B12R1.225 Cc1cccc(c1)N(C)C(C)C Amb25832581 [1,1,0,0,0,0|2,0,0]=4 3816 B12R1.225 Cc1cccc(c1)[C@@H](C)[C@@H](C)O Amb25357646 [1,1,0,0,0,0|2,0,0]=4 3817 B12R1.225 Cc1cccc(c1)[C@@H](N)C(C)C Amb22298585 [1,1,0,0,0,0|1,0,0]=3 3818 B12R1.225 Cc1cccc(c1)[C@@H](O)[C@@H](C)N Amb24542886 [1,1,0,0,0,0|0,0,0]=2 3819 B12R1.225 Cc1cccc(c1)[C@H](N)C(C)C Amb22298545 [1,1,0,0,0,0|1,0,0]=3 3820 B12R1.225 Cc1cccc(c1)[C@H](N)C(C)C Amb24763656 [1,1,0,0,0,0|1,0,0]=3 3821 B12R1.225 Cc1cccc(c1)[C@H](N)[C@@H](C)O Amb25081648 [1,1,0,0,0,0|2,0,0]=4 3822 B12R1.225 Cc1cccc(c1)[C@H](N)[C@H](C)O Amb24426831 [1,1,0,0,0,0|2,0,0]=4 3823 B12R1.225 Cc1cccc(c1)[C@H](O)[C@@H](C)N Amb25151141 [1,1,0,0,0,0|0,0,0]=2 3824 B12R1.225 Cc1cccc(c1)[C@H](O)[C@H](C)N Amb24524834 [1,1,0,0,0,0|0,0,0]=2 3825 B12R1.225 Clc1cccc(c1)C(=O)C(C)C Amb17233965 [1,1,0,0,0,0|0,0,2]=4 3826 B12R1.225 Clc1cccc(c1)C(=O)C(N)C Amb17610845 [1,1,0,0,0,0|0,0,2]=4 3827 B12R1.225 Fc1cccc(c1)C(=O)C(C)C Amb17232580 [1,1,0,0,0,0|0,0,2]=4 3828 B12R1.225 NC(=N)C(O)c1cccc(Cl)c1 Amb25144070 [1,1,0,0,0,0|1,0,1]=4 3829 B12R1.225 NC(=O)C(O)c1cc(O)ccc1 Amb18805579 [1,1,0,0,0,0|1,0,1]=4 3830 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [1,1,0,0,0,0|1,0,1]=4 3831 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [1,1,0,0,0,0|1,0,1]=4 3832 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [1,1,0,0,0,0|1,0,1]=4 3833 B12R1.225 NC(=O)C(O)c1cccc(I)c1 Amb24554086 [1,1,0,0,0,0|1,0,1]=4 3834 B12R1.225 NC(=O)[C@H](O)c1cccc(Cl)c1 Amb24443861 [1,1,0,0,0,0|1,0,1]=4 3835 B12R1.225 NC(=S)C(O)c1cccc(Cl)c1 Amb25041787 [1,1,0,0,0,0|1,0,1]=4 3836 B12R1.225 Nc1cc(ccc1)C(O)C(F)F Amb22387864 [1,1,0,0,0,0|2,0,0]=4 3837 B12R1.225 Nc1cccc(c1)C(=O)C(C)C Amb17138554 [1,1,0,0,0,0|0,0,2]=4 3838 B12R1.225 OC(C(F)F)c1cccc(F)c1 Amb24484243 [1,1,0,0,0,0|2,0,0]=4 3839 B12R1.225 O[C@@H](C(F)F)c1cccc(F)c1 Amb24447683 [1,1,0,0,0,0|2,0,0]=4 3840 B12R1.225 O[C@H](C(F)F)c1cccc(Cl)c1 Amb24492942 [1,1,0,0,0,0|2,0,0]=4 3841 B12R1.225 O[C@H](C(F)F)c1cccc(F)c1 Amb25126958 [1,1,0,0,0,0|2,0,0]=4 3842 B12R1.225 Oc1cccc(c1)[C@@H](O)C(F)F Amb25034926 [1,1,0,0,0,0|2,0,0]=4 3843 B12R1.253 CC(C)C(C)(N)c1c[n]ccc1 Amb18950471 [1,1,0,0,0,0|2,0,0]=4 3844 B12R1.253 CC(C)C(C)(N)c1cccc[n]1 Amb25289737 [1,1,0,0,0,0|2,0,0]=4 3845 B12R1.253 CC(C)C(C)(O)c1c[n]c[n]c1 Amb18801097 [1,1,0,0,0,0|2,0,0]=4 3846 B12R1.253 CC(C)C(C)(O)c1c[n]ccc1 Amb18792672 [1,1,0,0,0,0|1,0,0]=3 3847 B12R1.253 CC(C)C(F)(F)c1ccccc1 Amb19894547 [1,1,0,0,0,0|1,0,0]=3 3848 B12R1.253 CC(C)[C@@](C)(N)c1c[n]ccc1 Amb25715860 [1,1,0,0,0,0|2,0,0]=4 3849 B12R1.253 CC(C)[C@@](C)(N)c1cc[n]cc1 Amb25256024 [1,1,0,0,0,0|2,0,0]=4 3850 B12R1.253 CC(C)[C@@](C)(N)c1ccccc1 Amb19889809 [1,1,0,0,0,0|1,0,0]=3 3851 B12R1.253 CC(C)[C@](C)(N)c1cc[n]cc1 Amb24686900 [1,1,0,0,0,0|2,0,0]=4 3852 B12R1.253 CC(F)C(C)(N)c1ccccc1 Amb24381495 [1,1,0,0,0,0|2,0,0]=4 3853 B12R1.253 CC(N)C(C)(F)c1ccccc1 Amb25152439 [1,1,0,0,0,0|1,0,0]=3 3854 B12R1.253 CC(N)C(C)(O)c1c[n]cc[n]1 Amb25738948 [1,1,0,0,0,0|2,0,0]=4 3855 B12R1.253 CC(N)C(C)(O)c1c[n]ccc1 Amb18827649 [1,1,0,0,0,0|1,0,0]=3 3856 B12R1.253 CC(N)C(C)(O)c1ccccc1 Amb22460632 [1,1,0,0,0,0|0,0,0]=2 3857 B12R1.253 CC(N)[Si](C)(C)c1ccccc1 Amb25152485 [1,1,0,0,0,0|1,1,0]=4 3858 B12R1.253 CC(O)(C(F)F)c1ccccc1 Amb19895456 [1,1,0,0,0,0|2,0,0]=4 3859 B12R1.253 CC(O)C(C)(C)c1ccccc1 Amb18177805 [1,1,0,0,0,0|2,0,0]=4 3860 B12R1.253 CC(O)C(C)(N)c1ccccc1 Amb24678253 [1,1,0,0,0,0|2,0,0]=4 3861 B12R1.253 CC(O)C(C)(O)c1c[n]ccc1 Amb25158002 [1,1,0,0,0,0|2,0,0]=4 3862 B12R1.253 CC(O)P(O)(=O)c1ccccc1 Amb25681446 [1,1,0,0,0,0|2,0,0]=4 3863 B12R1.253 CN(C)C(C)(C)c1ccccc1 Amb25052796 [1,1,0,0,0,0|2,0,0]=4 3864 B12R1.253 C[C@@H](F)[C@](C)(N)c1ccccc1 Amb25152323 [1,1,0,0,0,0|2,0,0]=4 3865 B12R1.253 C[C@@H](N)C(C)(C)c1ccccc1 Amb25751364 [1,1,0,0,0,0|1,0,0]=3 3866 B12R1.253 C[C@@H](N)C(C)(F)c1ccccc1 Amb25090887 [1,1,0,0,0,0|1,0,0]=3 3867 B12R1.253 C[C@@H](N)[C@@](C)(F)c1ccccc1 Amb25106861 [1,1,0,0,0,0|1,0,0]=3 3868 B12R1.253 C[C@@H](N)[C@@](C)(N)c1ccccc1 Amb25212905 [1,1,0,0,0,0|1,0,0]=3 3869 B12R1.253 C[C@@H](N)[C@@](C)(O)c1ccccc1 Amb25068831 [1,1,0,0,0,0|0,0,0]=2 3870 B12R1.253 C[C@@H](N)[C@](C)(O)c1ccccc1 Amb25360926 [1,1,0,0,0,0|0,0,0]=2 3871 B12R1.253 C[C@@H](O)C(C)(C)c1ccccc1 Amb24459428 [1,1,0,0,0,0|2,0,0]=4 3872 B12R1.253 C[C@@H](O)[C@@](C)(O)c1ccccc1 Amb24421586 [1,1,0,0,0,0|1,0,0]=3 3873 B12R1.253 C[C@@H](O)[C@](C)(F)c1ccccc1 Amb25234752 [1,1,0,0,0,0|2,0,0]=4 3874 B12R1.253 C[C@@H](O)[C@](C)(O)c1ccccc1 Amb25098651 [1,1,0,0,0,0|1,0,0]=3 3875 B12R1.253 C[C@@](O)(C(N)=N)c1ccccc1 Amb25061216 [1,1,0,0,0,0|1,0,1]=4 3876 B12R1.253 C[C@@](O)(C(N)=O)c1ccccc1 Amb24595768 [1,1,0,0,0,0|1,0,1]=4 3877 B12R1.253 C[C@H](N)[C@@](C)(N)c1ccccc1 Amb24468395 [1,1,0,0,0,0|1,0,0]=3 3878 B12R1.253 C[C@H](N)[C@](C)(F)c1ccccc1 Amb25320985 [1,1,0,0,0,0|1,0,0]=3 3879 B12R1.253 C[C@H](O)C(C)(C)c1ccccc1 Amb24461815 [1,1,0,0,0,0|2,0,0]=4 3880 B12R1.253 C[C@H](O)[C@@](C)(F)c1ccccc1 Amb25356375 [1,1,0,0,0,0|2,0,0]=4 3881 B12R1.478 BrCC(c1ccccc1)C(C)C Amb17247625 [1,1,0,0,0,0|1,0,0]=3 3882 B12R1.478 CC(=C)[C@@H](CO)c1ccccc1 Amb25157975 [1,1,0,0,0,0|0,0,2]=4 3883 B12R1.478 CC(=O)C(CO)c1ccccc1 Amb21962499 [1,1,0,0,0,0|1,0,1]=4 3884 B12R1.478 CC(C)C(=C=C)c1ccccc1 Amb25148560 [1,1,0,0,0,0|1,0,1]=4 3885 B12R1.478 CC(C)C(=[N+]=[N-])c1ccccc1 Amb24095315 [1,1,0,0,0,0|1,0,1]=4 3886 B12R1.478 CC(C)C(C#N)c1cc[n]cc1 Amb25224872 [1,1,0,0,0,0|2,0,0]=4 3887 B12R1.478 CC(C)C(C#N)c1ccc[n]c1 Amb18645393 [1,1,0,0,0,0|2,0,0]=4 3888 B12R1.478 CC(C)C(C=O)c1cc[n]cc1 Amb24727519 [1,1,0,0,0,0|1,0,1]=4 3889 B12R1.478 CC(C)C(C=O)c1cccc[n]1 Amb25376240 [1,1,0,0,0,0|1,0,1]=4 3890 B12R1.478 CC(C)C(CC)c1ccccc1 Amb25281082 [1,1,0,0,0,0|1,0,0]=3 3891 B12R1.478 CC(C)C(CN)c1cc[n]cc1 Amb18828696 [1,1,0,0,0,0|2,0,0]=4 3892 B12R1.478 CC(C)C(CN)c1ccc[n]c1 Amb18828697 [1,1,0,0,0,0|2,0,0]=4 3893 B12R1.478 CC(C)C(NC)c1c[n]ccc1 Amb18968324 [1,1,0,0,0,0|2,0,0]=4 3894 B12R1.478 CC(C)C(NC)c1cc[n]cc1 Amb18968330 [1,1,0,0,0,0|2,0,0]=4 3895 B12R1.478 CC(C)C(NC)c1cccc[n]1 Amb18968305 [1,1,0,0,0,0|2,0,0]=4 3896 B12R1.478 CC(C)C(NN)c1cc[n]cc1 Amb25755549 [1,1,0,0,0,0|2,0,0]=4 3897 B12R1.478 CC(C)C(NN)c1ccccc1 Amb18792589 [1,1,0,0,0,0|1,0,0]=3 3898 B12R1.478 CC(C)C(OC)c1ccccc1 Amb23568503 [1,1,0,0,0,0|0,0,0]=2 3899 B12R1.478 CC(C)N(C#N)c1ccccc1 Amb25777071 [1,1,0,0,0,0|2,0,0]=4 3900 B12R1.478 CC(C)[C@@H](CCl)c1ccccc1 Amb24426185 [1,1,0,0,0,0|1,0,0]=3 3901 B12R1.478 CC(C)[C@@H](CN)c1ccccc1 Amb25072543 [1,1,0,0,0,0|1,0,0]=3 3902 B12R1.478 CC(C)[C@H](C=O)c1ccccc1 Amb24497169 [1,1,0,0,0,0|0,0,1]=3 3903 B12R1.478 CC(C)[C@H](CO)c1ccccc1 Amb25333656 [1,1,0,0,0,0|0,0,0]=2 3904 B12R1.478 CC(C)[C@H](NC)c1cccc[n]1 Amb24381570 [1,1,0,0,0,0|2,0,0]=4 3905 B12R1.478 CC(N)C(CC)c1cc[n]cc1 Amb24483609 [1,1,0,0,0,0|2,0,0]=4 3906 B12R1.478 CC(N)C(CC)c1ccccc1 Amb25667182 [1,1,0,0,0,0|1,0,0]=3 3907 B12R1.478 CC(N)C(CO)c1ccccc1 Amb25159957 [1,1,0,0,0,0|0,0,0]=2 3908 B12R1.478 CC(N)C(OC)c1c[n]ccc1 Amb18980566 [1,1,0,0,0,0|1,0,0]=3 3909 B12R1.478 CC(N)C(OC)c1cc[n]cc1 Amb18980590 [1,1,0,0,0,0|1,0,0]=3 3910 B12R1.478 CC(N)C(OC)c1cccc[n]1 Amb18980549 [1,1,0,0,0,0|1,0,0]=3 3911 B12R1.478 CC(N)C(OC)c1ccccc1 Amb18980113 [1,1,0,0,0,0|0,0,0]=2 3912 B12R1.478 CC(N)C(SC)c1c[n]ccc1 Amb18293258 [1,1,0,0,0,0|1,1,0]=4 3913 B12R1.478 CC(N)C(SC)c1cc[n]cc1 Amb18980592 [1,1,0,0,0,0|1,1,0]=4 3914 B12R1.478 CC(N)C(SC)c1cccc[n]1 Amb18293249 [1,1,0,0,0,0|1,1,0]=4 3915 B12R1.478 CC(N)C(SC)c1ccccc1 Amb18980114 [1,1,0,0,0,0|0,1,0]=3 3916 B12R1.478 CC(N)\C(=C\Cl)\c1ccccc1 Amb24670393 [1,1,0,0,0,0|1,0,1]=4 3917 B12R1.478 CC(N)\C(=N\O)\c1ccccc1 Amb25189628 [1,1,0,0,0,0|0,0,1]=3 3918 B12R1.478 CC(O)C(NC)c1ccccc1 Amb18646387 [1,1,0,0,0,0|2,0,0]=4 3919 B12R1.478 CC(O)C(OC)c1ccccc1 Amb25700350 [1,1,0,0,0,0|1,0,0]=3 3920 B12R1.478 CC(O)C(SC)c1ccccc1 Amb25796298 [1,1,0,0,0,0|1,1,0]=4 3921 B12R1.478 CC(O)\C(=N\O)\c1ccccc1 Amb24555507 [1,1,0,0,0,0|1,0,1]=4 3922 B12R1.478 CCN(C(C)C)c1ccccc1 Amb22351422 [1,1,0,0,0,0|2,0,0]=4 3923 B12R1.478 CCN(C(C)C)c1ccccc1 Amb22351908 [1,1,0,0,0,0|2,0,0]=4 3924 B12R1.478 CC[C@@H](c1ccccc1)N(C)C Amb24385295 [1,1,0,0,0,0|2,0,0]=4 3925 B12R1.478 CN(C(c1ccccc1)C#N)C Amb1397749 [1,1,0,0,0,0|2,0,0]=4 3926 B12R1.478 CN(C(c1ccccc1)C#N)C Amb17621589 [1,1,0,0,0,0|2,0,0]=4 3927 B12R1.478 CN(C)C(C=O)c1ccccc1 Amb24728369 [1,1,0,0,0,0|1,0,1]=4 3928 B12R1.478 CN(C)C(CO)c1cc[n]cc1 Amb23555583 [1,1,0,0,0,0|2,0,0]=4 3929 B12R1.478 CN(C)[C@@H](CN)c1ccccc1 Amb24649763 [1,1,0,0,0,0|2,0,0]=4 3930 B12R1.478 CN(C)[C@@H](CO)c1ccccc1 Amb25859368 [1,1,0,0,0,0|1,0,0]=3 3931 B12R1.478 CN(C)[C@H](CCl)c1ccccc1 Amb25053864 [1,1,0,0,0,0|2,0,0]=4 3932 B12R1.478 CN(N)C(CO)c1ccccc1 Amb25357517 [1,1,0,0,0,0|1,0,0]=3 3933 B12R1.478 COC(C(F)Cl)c1ccccc1 Amb25362062 [1,1,0,0,0,0|2,0,0]=4 3934 B12R1.478 COC(c1ccccc1)C(=O)C Amb10562726 [1,1,0,0,0,0|1,0,1]=4 3935 B12R1.478 COC(c1ccccc1)C(=O)N Amb10769824 [1,1,0,0,0,0|1,0,1]=4 3936 B12R1.478 CO[C@@H](C(N)=O)c1ccccc1 Amb25363386 [1,1,0,0,0,0|1,0,1]=4 3937 B12R1.478 CS(=O)[C@@H](CO)c1ccccc1 Amb25831961 [1,1,0,0,0,0|2,0,0]=4 3938 B12R1.478 C[C@@H](Cl)[C@@H](OC)c1ccccc1 Amb24390884 [1,1,0,0,0,0|1,0,0]=3 3939 B12R1.478 C[C@@H](O)[C@@H](C#N)c1ccccc1 Amb25357376 [1,1,0,0,0,0|2,0,0]=4 3940 B12R1.478 C[C@@H](O)[C@@H](C=C)c1ccccc1 Amb25069723 [1,1,0,0,0,0|2,0,0]=4 3941 B12R1.478 C[C@@H](O)[C@@H](CC)c1ccccc1 Amb25347649 [1,1,0,0,0,0|2,0,0]=4 3942 B12R1.478 C[C@@H](O)[C@@H](CN)c1ccccc1 Amb24627923 [1,1,0,0,0,0|2,0,0]=4 3943 B12R1.478 C[C@@H](O)[C@@H](SC)c1ccccc1 Amb25332276 [1,1,0,0,0,0|1,1,0]=4 3944 B12R1.478 C[C@H](Cl)[C@@H](OC)c1ccccc1 Amb24726335 [1,1,0,0,0,0|1,0,0]=3 3945 B12R1.478 C[C@H](N)C(OC)c1ccccc1 Amb25106860 [1,1,0,0,0,0|0,0,0]=2 3946 B12R1.478 C[C@H](N)[C@@H](OC)c1ccccc1 Amb25309446 [1,1,0,0,0,0|0,0,0]=2 3947 B12R1.478 C[C@H](N)[C@H](CN)c1ccccc1 Amb25132197 [1,1,0,0,0,0|1,0,0]=3 3948 B12R1.478 C[C@H](N)[C@H](OC)c1ccccc1 Amb24594937 [1,1,0,0,0,0|0,0,0]=2 3949 B12R1.478 C[C@H](O)[C@@H](CO)c1ccccc1 Amb25179958 [1,1,0,0,0,0|1,0,0]=3 3950 B12R1.478 C[C@H](O)[C@@H](OC)c1ccccc1 Amb24403890 [1,1,0,0,0,0|1,0,0]=3 3951 B12R1.478 C[C@H](O)[C@H](CC)c1ccccc1 Amb24497690 [1,1,0,0,0,0|2,0,0]=4 3952 B12R1.478 C[C@H](O)[C@H](NC)c1ccccc1 Amb24341991 [1,1,0,0,0,0|2,0,0]=4 3953 B12R1.478 C\C=C(/C(C)N)\c1ccccc1 Amb18645554 [1,1,0,0,0,0|1,0,1]=4 3954 B12R1.478 ClCC(c1ccccc1)C(C)C Amb17233967 [1,1,0,0,0,0|1,0,0]=3 3955 B12R1.478 ClCC(c1ccccc1)N(C)C Amb17234042 [1,1,0,0,0,0|2,0,0]=4 3956 B12R1.478 NC(=N)C(CO)c1ccccc1 Amb25061991 [1,1,0,0,0,0|1,0,1]=4 3957 B12R1.478 NC(=O)C(CO)c1ccccc1 Amb22233190 [1,1,0,0,0,0|1,0,1]=4 3958 B12R1.478 NC(=O)C(NO)c1ccccc1 Amb24373087 [1,1,0,0,0,0|1,0,1]=4 3959 B12R1.478 NCC(c1ccccc1)N(C)C Amb1216534 [1,1,0,0,0,0|2,0,0]=4 3960 B12R1.478 O=CC(c1ccccc1)C(C)C Amb17138541 [1,1,0,0,0,0|0,0,1]=3 3961 B12R1.478 OCC(c1ccccc1)N(C)C Amb17232542 [1,1,0,0,0,0|1,0,0]=3 3962 B12R1.478 OCC(c1cccnc1)N(C)C Amb17232604 [1,1,0,0,0,0|2,0,0]=4 3963 B12R1.478 ONC(c1ccccc1)C(C)C Amb10605007 [1,1,0,0,0,0|0,0,0]=2 3964 B12R1.478 [C@H](C)(O)C(CC)c1ccccc1 Amb17678947 [1,1,0,0,0,0|2,0,0]=4 3965 B12R1.564 CC(C(N)(C)C)c1ccccc1 Amb17594058 [1,1,0,0,0,0|1,0,0]=3 3966 B12R1.564 CC(C)(Br)C(Br)c1ccccc1 Amb25725984 [1,1,0,0,0,0|1,0,0]=3 3967 B12R1.564 CC(C)(C)B(O)c1ccccc1 Amb24553061 [1,1,0,0,0,0|1,0,0]=3 3968 B12R1.564 CC(C)(C)C(Cl)c1ccccc1 Amb19057047 [1,1,0,0,0,0|1,0,0]=3 3969 B12R1.564 CC(C)(C)C(N)c1c[n]ccc1 Amb18965330 [1,1,0,0,0,0|2,0,0]=4 3970 B12R1.564 CC(C)(C)C(N)c1c[n]ccc1 Amb22292256 [1,1,0,0,0,0|2,0,0]=4 3971 B12R1.564 CC(C)(C)C(N)c1cc[n]cc1 Amb18961435 [1,1,0,0,0,0|2,0,0]=4 3972 B12R1.564 CC(C)(C)C(N)c1cc[n]cc1 Amb22292255 [1,1,0,0,0,0|2,0,0]=4 3973 B12R1.564 CC(C)(C)C(N)c1cccc[n]1 Amb18961432 [1,1,0,0,0,0|2,0,0]=4 3974 B12R1.564 CC(C)(C)C(N)c1cccc[n]1 Amb22292257 [1,1,0,0,0,0|2,0,0]=4 3975 B12R1.564 CC(C)(C)C(O)c1[n]ccc[n]1 Amb18798616 [1,1,0,0,0,0|2,0,0]=4 3976 B12R1.564 CC(C)(C)C(O)c1c[n][n]cc1 Amb25832032 [1,1,0,0,0,0|2,0,0]=4 3977 B12R1.564 CC(C)(C)C(O)c1c[n]c[n]c1 Amb18801095 [1,1,0,0,0,0|2,0,0]=4 3978 B12R1.564 CC(C)(C)C(O)c1c[n]cc[n]1 Amb18798615 [1,1,0,0,0,0|2,0,0]=4 3979 B12R1.564 CC(C)(C)C(O)c1c[n]ccc1 Amb18792673 [1,1,0,0,0,0|1,0,0]=3 3980 B12R1.564 CC(C)(C)C(O)c1cc[n]c[n]1 Amb25305311 [1,1,0,0,0,0|2,0,0]=4 3981 B12R1.564 CC(C)(C)C(O)c1cc[n]cc1 Amb18798430 [1,1,0,0,0,0|1,0,0]=3 3982 B12R1.564 CC(C)(C)N(N)c1ccccc1 Amb18646167 [1,1,0,0,0,0|2,0,0]=4 3983 B12R1.564 CC(C)(C)P(Cl)c1ccccc1 Amb24312773 [1,1,0,0,0,0|2,0,0]=4 3984 B12R1.564 CC(C)(C)[C@@H](N)c1c[n]ccc1 Amb25353600 [1,1,0,0,0,0|2,0,0]=4 3985 B12R1.564 CC(C)(C)[C@@H](N)c1ccccc1 Amb23438853 [1,1,0,0,0,0|1,0,0]=3 3986 B12R1.564 CC(C)(C)[C@@H](O)c1c[n]ccc1 Amb25221114 [1,1,0,0,0,0|1,0,0]=3 3987 B12R1.564 CC(C)(C)[C@@H](O)c1cccc[n]1 Amb24496219 [1,1,0,0,0,0|1,0,0]=3 3988 B12R1.564 CC(C)(C)[C@H](O)c1c[n]ccc1 Amb25156800 [1,1,0,0,0,0|1,0,0]=3 3989 B12R1.564 CC(C)(C)[S@@+]([O-])c1ccccc1 Amb17844211 [1,1,0,0,0,0|1,0,1]=4 3990 B12R1.564 CC(C)(Cl)C(=O)c1ccccc1 Amb24635603 [1,1,0,0,0,0|0,0,2]=4 3991 B12R1.564 CC(C)(Cl)C(Cl)c1ccccc1 Amb25756185 [1,1,0,0,0,0|1,0,0]=3 3992 B12R1.564 CC(C)(Cl)C(O)c1ccccc1 Amb25284415 [1,1,0,0,0,0|0,0,0]=2 3993 B12R1.564 CC(C)(F)C(N)c1ccccc1 Amb25700993 [1,1,0,0,0,0|1,0,0]=3 3994 B12R1.564 CC(C)(F)C(O)c1c[n]ccc1 Amb24362876 [1,1,0,0,0,0|1,0,0]=3 3995 B12R1.564 CC(C)(F)C(O)c1ccccc1 Amb24403919 [1,1,0,0,0,0|0,0,0]=2 3996 B12R1.564 CC(C)(N)C(=C)c1ccccc1 Amb18645555 [1,1,0,0,0,0|1,0,1]=4 3997 B12R1.564 CC(C)(N)C(=O)c1ccccc1 Amb22886199 [1,1,0,0,0,0|0,0,2]=4 3998 B12R1.564 CC(C)(N)C(N)c1ccccc1 Amb18646148 [1,1,0,0,0,0|1,0,0]=3 3999 B12R1.564 CC(C)(N)C(O)c1cc[n]c[n]1 Amb25260581 [1,1,0,0,0,0|2,0,0]=4 4000 B12R1.564 CC(C)(O)C(N)c1c[n]ccc1 Amb18646605 [1,1,0,0,0,0|2,0,0]=4 4001 B12R1.564 CC(C)(O)C(N)c1cc[n]cc1 Amb18827555 [1,1,0,0,0,0|2,0,0]=4 4002 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb18646373 [1,1,0,0,0,0|1,0,0]=3 4003 B12R1.564 CC(C)(O)C(N)c1ccccc1 Amb22748963 [1,1,0,0,0,0|1,0,0]=3 4004 B12R1.564 CC(C)(O)C(O)c1c[n]ccc1 Amb24572270 [1,1,0,0,0,0|1,0,0]=3 4005 B12R1.564 CC(C)(O)C(O)c1ccccc1 Amb17776964 [1,1,0,0,0,0|0,0,0]=2 4006 B12R1.564 CC(C)(O)[C@@H](N)c1ccccc1 Amb23399663 [1,1,0,0,0,0|1,0,0]=3 4007 B12R1.564 CC(C)(O)[C@@H](O)c1ccccc1 Amb25065481 [1,1,0,0,0,0|0,0,0]=2 4008 B12R1.564 CC(C)(O)[C@H](N)c1ccccc1 Amb25667178 [1,1,0,0,0,0|1,0,0]=3 4009 B12R1.564 CC(F)(F)C(Br)c1ccccc1 Amb25173537 [1,1,0,0,0,0|2,0,0]=4 4010 B12R1.564 CC(F)(F)C(Cl)c1ccccc1 Amb24421961 [1,1,0,0,0,0|2,0,0]=4 4011 B12R1.564 CC(F)(F)C(N)c1ccccc1 Amb25857772 [1,1,0,0,0,0|2,0,0]=4 4012 B12R1.564 CC(c1c[n]ccc1)C(C)(C)N Amb24637150 [1,1,0,0,0,0|2,0,0]=4 4013 B12R1.564 CC(c1ccccc1)C(C)(C)C Amb24579473 [1,1,0,0,0,0|1,0,0]=3 4014 B12R1.564 CC(c1ccccc1)C(C)(C)N Amb22057442 [1,1,0,0,0,0|1,0,0]=3 4015 B12R1.564 CC(c1ccccc1)[N+](C)(C)C Amb22359327 [1,1,0,0,0,0|2,0,0]=4 4016 B12R1.564 CC(c1ccccc1)[N+](C)(C)C Amb22360591 [1,1,0,0,0,0|2,0,0]=4 4017 B12R1.564 C[C@H](c1ccccc1)C(C)(C)N Amb24678916 [1,1,0,0,0,0|1,0,0]=3 4018 B12R1.564 C[Si](C)(C)C(N)c1ccccc1 Amb25074599 [1,1,0,0,0,0|1,1,0]=4 4019 B12R1.564 ClC(C(N)(C)C)c1ccccc1 Amb17594730 [1,1,0,0,0,0|1,0,0]=3 4020 B12R1.564 NC(C(C)(C)C)c1ccccc1 Amb2372573 [1,1,0,0,0,0|1,0,0]=3 4021 B12R1.564 O=C(C(C)(C)C)c1ccccc1 Amb2447464 [1,1,0,0,0,0|0,0,2]=4 4022 B12R1.564 OC(C(C)(C)C)c1ccccn1 Amb10554038 [1,1,0,0,0,0|1,0,0]=3 4023 B12R1.564 OC(C(F)(F)F)c1ccccc1 Amb2419476 [1,1,0,0,0,0|2,0,0]=4 4024 B12R1.564 OC(C(N)(C)C)c1ccccc1 Amb17082094 [1,1,0,0,0,0|0,0,0]=2 4025 B12R1.564 OC(C(N)(C)C)c1ccccn1 Amb17082091 [1,1,0,0,0,0|1,0,0]=3 4026 B12R1.564 OC(C(N)(C)C)c1cccnc1 Amb17082092 [1,1,0,0,0,0|1,0,0]=3 4027 B12R1.564 OC(C(N)(C)C)c1ccncc1 Amb17082093 [1,1,0,0,0,0|1,0,0]=3 4028 B12R1.564 OC(c1ccccc1)C(F)(F)Br Amb22008291 [1,1,0,0,0,0|2,0,0]=4 4029 B12R1.564 O[C@@H](C(F)(F)F)c1ccccc1 Amb10838391 [1,1,0,0,0,0|2,0,0]=4 4030 B12R1.564 O[C@@H](c1ccccc1)C(F)(F)Cl Amb24733213 [1,1,0,0,0,0|2,0,0]=4 4031 B12R1.564 O[C@H](C(F)(F)F)c1ccccc1 Amb10838385 [1,1,0,0,0,0|2,0,0]=4 4032 B12R1.564 O[C@H](c1ccccc1)C(F)(F)Cl Amb24407461 [1,1,0,0,0,0|2,0,0]=4 4033 B12R1.564 [2H]C([2H])([2H])C(O)c1ccccc1 Amb22363115 [1,1,0,0,0,0|2,0,0]=4 4034 B12R1.564 [NH3+]C(C(C)(C)C)c1ccccc1 Amb10560247 [1,1,0,0,0,0|1,0,0]=3 4035 B12R1.32 BrCCC(Br)Cc1ccccc1 Amb23456171 [1,1,0,0,0,0|2,0,0]=4 4036 B12R1.32 CC#CC(C)Nc1ccccc1 Amb25040061 [1,1,0,0,0,0|2,0,0]=4 4037 B12R1.32 CC#CC(N)Cc1ccccc1 Amb24417700 [1,1,0,0,0,0|2,0,0]=4 4038 B12R1.32 CC#C[C@@H](C)Oc1ccccc1 Amb24068913 [1,1,0,0,0,0|2,0,0]=4 4039 B12R1.32 CC(CNN)Nc1ccccc1 Amb18646400 [1,1,0,0,0,0|2,0,0]=4 4040 B12R1.32 CC(CNN)Oc1ccccc1 Amb18563756 [1,1,0,0,0,0|2,0,0]=4 4041 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [1,1,0,0,0,0|0,0,2]=4 4042 B12R1.32 CC(Cc1ccccc1)N=C=S Amb18790890 [1,1,0,0,0,0|0,0,2]=4 4043 B12R1.32 CC(Cc1ccccc1)N=[N+]=[N-] Amb25249262 [1,1,0,0,0,0|1,0,1]=4 4044 B12R1.32 CC(Cc1ccccc1)NC#N Amb18177707 [1,1,0,0,0,0|0,0,1]=3 4045 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [1,1,0,0,0,0|0,0,1]=3 4046 B12R1.32 CC(NCC)Cc1cnccn1 Amb1995172 [1,1,0,0,0,0|2,0,0]=4 4047 B12R1.32 CCCC(C)Cc1c[n]ccc1 Amb24094032 [1,1,0,0,0,0|2,0,0]=4 4048 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [1,1,0,0,0,0|1,0,0]=3 4049 B12R1.32 CCCC(Cc1ccccc1)[NH3+] Amb10560244 [1,1,0,0,0,0|2,0,0]=4 4050 B12R1.32 CCCC(N)Cc1ccccc1 Amb18180073 [1,1,0,0,0,0|2,0,0]=4 4051 B12R1.32 CCNC(=S)Cc1ccccc1 Amb24066800 [1,1,0,0,0,0|1,0,1]=4 4052 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [1,1,0,0,0,0|0,0,0]=2 4053 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [1,1,0,0,0,0|0,0,0]=2 4054 B12R1.32 CCNC(Cc1ccccn1)C Amb1995151 [1,1,0,0,0,0|1,0,0]=3 4055 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [1,1,0,0,0,0|2,0,0]=4 4056 B12R1.32 CN(CCBr)Cc1ccccc1 Amb24357900 [1,1,0,0,0,0|2,0,0]=4 4057 B12R1.32 CN(CCCl)Cc1ccccc1 Amb19895292 [1,1,0,0,0,0|2,0,0]=4 4058 B12R1.32 CN(CCF)Cc1ccccc1 Amb25318241 [1,1,0,0,0,0|2,0,0]=4 4059 B12R1.32 CN(CCI)Cc1ccccc1 Amb25235494 [1,1,0,0,0,0|2,0,0]=4 4060 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [1,1,0,0,0,0|1,0,0]=3 4061 B12R1.32 CNCC(Cc1ccccc1)O Amb17193901 [1,1,0,0,0,0|1,0,0]=3 4062 B12R1.32 CNCC(Cc1cccnc1)O Amb17232605 [1,1,0,0,0,0|2,0,0]=4 4063 B12R1.32 CNCC(N)Cc1ccccc1 Amb19009730 [1,1,0,0,0,0|1,0,0]=3 4064 B12R1.32 CNC\C(=C\c1ccccc1)\C Amb17100030 [1,1,0,0,0,0|0,0,2]=4 4065 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [1,1,0,0,0,0|2,0,0]=4 4066 B12R1.32 COCC(N)Cc1ccccc1 Amb20623561 [1,1,0,0,0,0|2,0,0]=4 4067 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [1,1,0,0,0,0|1,0,1]=4 4068 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [1,1,0,0,0,0|2,0,0]=4 4069 B12R1.32 C[C@@H](CCO)Nc1ccccc1 Amb25124401 [1,1,0,0,0,0|2,0,0]=4 4070 B12R1.32 C[C@@H](Cc1ccccc1)N=[N+]=[N-] Amb24356215 [1,1,0,0,0,0|1,0,1]=4 4071 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [1,1,0,0,0,0|0,0,1]=3 4072 B12R1.32 C[C@H](CCO)Nc1ccccc1 Amb25324766 [1,1,0,0,0,0|2,0,0]=4 4073 B12R1.32 C[C@H](Cc1ccccc1)N=[N+]=[N-] Amb25667629 [1,1,0,0,0,0|1,0,1]=4 4074 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [1,1,0,0,0,0|1,0,1]=4 4075 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [1,1,0,0,0,0|2,0,0]=4 4076 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [1,1,0,0,0,0|2,0,0]=4 4077 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [1,1,0,0,0,0|2,0,0]=4 4078 B12R1.32 NCCC(Cc1ccccc1)C Amb17232439 [1,1,0,0,0,0|1,0,0]=3 4079 B12R1.32 NCCC(Cc1ccccc1)O Amb17232552 [1,1,0,0,0,0|2,0,0]=4 4080 B12R1.32 NCCC(Oc1ccccc1)C Amb17232556 [1,1,0,0,0,0|2,0,0]=4 4081 B12R1.32 OCCC(Cc1ccccc1)C Amb17232486 [1,1,0,0,0,0|1,0,0]=3 4082 B12R1.32 OCCC(O)Cc1ccccc1 Amb22491209 [1,1,0,0,0,0|2,0,0]=4 4083 B12R1.32 OCCC(Oc1ccccc1)C Amb17232598 [1,1,0,0,0,0|2,0,0]=4 4084 B12R1.32 SCCN(Cc1ccccc1)C Amb13881720 [1,1,0,0,0,0|2,0,0]=4 4085 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [1,1,0,0,0,0|2,0,0]=4 4086 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [1,1,0,0,0,0|2,0,0]=4 4087 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [1,1,0,0,0,0|2,0,0]=4 4088 B12R1.43 CC(=O)C(C)Cc1cc[n]cc1 Amb25303664 [1,1,0,0,0,0|2,0,0]=4 4089 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [1,1,0,0,0,0|2,0,0]=4 4090 B12R1.43 CC(=O)[C@@H](C)Cc1cc[n]cc1 Amb25358977 [1,1,0,0,0,0|2,0,0]=4 4091 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [1,1,0,0,0,0|1,0,0]=3 4092 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [1,1,0,0,0,0|2,0,0]=4 4093 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [1,1,0,0,0,0|2,0,0]=4 4094 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [1,1,0,0,0,0|2,0,0]=4 4095 B12R1.43 CC(=O)[C@H](C)Cc1cc[n]cc1 Amb24380859 [1,1,0,0,0,0|2,0,0]=4 4096 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [1,1,0,0,0,0|1,0,0]=3 4097 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [1,1,0,0,0,0|2,0,0]=4 4098 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [1,1,0,0,0,0|1,0,0]=3 4099 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [1,1,0,0,0,0|2,0,0]=4 4100 B12R1.43 CC(C(N)C)Cc1ccccc1 Amb17232438 [1,1,0,0,0,0|1,0,0]=3 4101 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [1,1,0,0,0,0|1,0,0]=3 4102 B12R1.43 CC(C)C(Br)Cc1ccccc1 Amb25690703 [1,1,0,0,0,0|2,0,0]=4 4103 B12R1.43 CC(C)C(Cl)Cc1ccccc1 Amb19045146 [1,1,0,0,0,0|2,0,0]=4 4104 B12R1.43 CC(C)[C@@H](C)Nc1ccccc1 Amb25375808 [1,1,0,0,0,0|2,0,0]=4 4105 B12R1.43 CC(Cc1c[n]ccc1)C(C)Cl Amb25711097 [1,1,0,0,0,0|2,0,0]=4 4106 B12R1.43 CC(Cc1cc[n]cc1)C(C)Cl Amb25827015 [1,1,0,0,0,0|2,0,0]=4 4107 B12R1.43 CC(Cc1cc[n]cc1)C(C)N Amb18828714 [1,1,0,0,0,0|2,0,0]=4 4108 B12R1.43 CC(Cc1cc[n]cc1)C(C)O Amb25710238 [1,1,0,0,0,0|2,0,0]=4 4109 B12R1.43 CC(Cc1cccc[n]1)C(C)Br Amb25732857 [1,1,0,0,0,0|2,0,0]=4 4110 B12R1.43 CC(Cc1cccc[n]1)C(C)Cl Amb24640097 [1,1,0,0,0,0|2,0,0]=4 4111 B12R1.43 CC(Cc1cccc[n]1)C(C)N Amb25277034 [1,1,0,0,0,0|2,0,0]=4 4112 B12R1.43 CC(Cc1cccc[n]1)C(C)O Amb24341829 [1,1,0,0,0,0|2,0,0]=4 4113 B12R1.43 CC(Cc1cccc[n]1)N(C)C Amb24554569 [1,1,0,0,0,0|1,0,0]=3 4114 B12R1.43 CC(Cc1ccccc1)C(C)Br Amb24751375 [1,1,0,0,0,0|1,0,0]=3 4115 B12R1.43 CC(Cc1ccccc1)C(C)Cl Amb19074260 [1,1,0,0,0,0|1,0,0]=3 4116 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [1,1,0,0,0,0|1,0,1]=4 4117 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb1086747 [1,1,0,0,0,0|0,0,0]=2 4118 B12R1.43 CC(N(C)C)Cc1ccccc1 Amb2099764 [1,1,0,0,0,0|0,0,0]=2 4119 B12R1.43 CC(N)C(F)Cc1ccccc1 Amb25850180 [1,1,0,0,0,0|2,0,0]=4 4120 B12R1.43 CC(N)C(O)Cc1ccccc1 Amb18828237 [1,1,0,0,0,0|2,0,0]=4 4121 B12R1.43 CC(N)[C@H](O)Cc1ccccc1 Amb24389484 [1,1,0,0,0,0|2,0,0]=4 4122 B12R1.43 CC(Nc1ccccc1)C(C)N Amb18646160 [1,1,0,0,0,0|2,0,0]=4 4123 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [1,1,0,0,0,0|2,0,0]=4 4124 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [1,1,0,0,0,0|2,0,0]=4 4125 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [1,1,0,0,0,0|2,0,0]=4 4126 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [1,1,0,0,0,0|2,0,0]=4 4127 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [1,1,0,0,0,0|2,0,0]=4 4128 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [1,1,0,0,0,0|2,0,0]=4 4129 B12R1.43 CC(Oc1ccccc1)C(C)Cl Amb24532569 [1,1,0,0,0,0|2,0,0]=4 4130 B12R1.43 CC(Oc1ccccc1)C(C)N Amb18291409 [1,1,0,0,0,0|2,0,0]=4 4131 B12R1.43 CC(Oc1ccccc1)C(C)O Amb18801039 [1,1,0,0,0,0|2,0,0]=4 4132 B12R1.43 CC(Oc1ccccc1)[C@H](C)N Amb25089792 [1,1,0,0,0,0|2,0,0]=4 4133 B12R1.43 CC(Sc1ccccc1)C(C)Cl Amb25290258 [1,1,0,0,0,0|2,0,0]=4 4134 B12R1.43 CC(Sc1ccccc1)C(C)N Amb18648553 [1,1,0,0,0,0|2,0,0]=4 4135 B12R1.43 CN(C(=O)Cc1ccccc1)C Amb1803686 [1,1,0,0,0,0|1,0,1]=4 4136 B12R1.43 CN(C(=S)Cc1ccccc1)C Amb1078624 [1,1,0,0,0,0|1,0,1]=4 4137 B12R1.43 CN(C)C(=N)Cc1ccccc1 Amb23447116 [1,1,0,0,0,0|1,0,1]=4 4138 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [1,1,0,0,0,0|2,0,0]=4 4139 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [1,1,0,0,0,0|1,0,0]=3 4140 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [1,1,0,0,0,0|2,0,0]=4 4141 B12R1.43 C[C@@H](Cc1ccccc1)N(C)C Amb22747859 [1,1,0,0,0,0|0,0,0]=2 4142 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [1,1,0,0,0,0|1,0,0]=3 4143 B12R1.43 C[C@@H](Cc1ccccc1)[C@H](C)Cl Amb25275062 [1,1,0,0,0,0|1,0,0]=3 4144 B12R1.43 C[C@@H](N)[C@@H](N)Cc1ccccc1 Amb24407278 [1,1,0,0,0,0|2,0,0]=4 4145 B12R1.43 C[C@@H](N)[C@@H](O)Cc1ccccc1 Amb25202137 [1,1,0,0,0,0|2,0,0]=4 4146 B12R1.43 C[C@@H](N)[C@H](O)Cc1ccccc1 Amb25258010 [1,1,0,0,0,0|2,0,0]=4 4147 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)N Amb25237533 [1,1,0,0,0,0|2,0,0]=4 4148 B12R1.43 C[C@@H](Nc1ccccc1)[C@H](C)O Amb24382503 [1,1,0,0,0,0|2,0,0]=4 4149 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [1,1,0,0,0,0|2,0,0]=4 4150 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [1,1,0,0,0,0|2,0,0]=4 4151 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [1,1,0,0,0,0|2,0,0]=4 4152 B12R1.43 C[C@@H](Oc1ccccc1)[C@@H](C)O Amb25687748 [1,1,0,0,0,0|2,0,0]=4 4153 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)N Amb24407272 [1,1,0,0,0,0|2,0,0]=4 4154 B12R1.43 C[C@@H](Oc1ccccc1)[C@H](C)O Amb25284620 [1,1,0,0,0,0|2,0,0]=4 4155 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)N Amb25074048 [1,1,0,0,0,0|2,0,0]=4 4156 B12R1.43 C[C@@H](Sc1ccccc1)[C@@H](C)O Amb24414998 [1,1,0,0,0,0|2,0,0]=4 4157 B12R1.43 C[C@@H](Sc1ccccc1)[C@H](C)Cl Amb24444921 [1,1,0,0,0,0|2,0,0]=4 4158 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [1,1,0,0,0,0|2,0,0]=4 4159 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [1,1,0,0,0,0|1,0,0]=3 4160 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [1,1,0,0,0,0|1,0,0]=3 4161 B12R1.43 C[C@H](N)[C@@H](N)Cc1ccccc1 Amb25152488 [1,1,0,0,0,0|2,0,0]=4 4162 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [1,1,0,0,0,0|2,0,0]=4 4163 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [1,1,0,0,0,0|2,0,0]=4 4164 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [1,1,0,0,0,0|2,0,0]=4 4165 B12R1.43 C[C@H](Sc1ccccc1)[C@H](C)O Amb24661261 [1,1,0,0,0,0|2,0,0]=4 4166 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [1,1,0,0,0,0|2,0,0]=4 4167 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [1,1,0,0,0,0|2,0,0]=4 4168 B12R1.43 NC(C(C)C)Cc1ccccc1 Amb17138565 [1,1,0,0,0,0|2,0,0]=4 4169 B12R1.43 OC(C(C)C)Cc1ccccc1 Amb17138584 [1,1,0,0,0,0|2,0,0]=4 4170 B12R1.49 CC(CN)Cc1ccc(Br)cc1 Amb18992228 [1,1,0,0,0,0|2,0,0]=4 4171 B12R1.49 CC(CN)Cc1ccc(I)cc1 Amb25054279 [1,1,0,0,0,0|2,0,0]=4 4172 B12R1.49 CC(CN)Cc1ccc(O)cc1 Amb25738797 [1,1,0,0,0,0|2,0,0]=4 4173 B12R1.49 CC(CO)Cc1ccc(I)cc1 Amb25711706 [1,1,0,0,0,0|2,0,0]=4 4174 B12R1.49 CC(Cc1ccc(Br)c[n]1)NN Amb24586238 [1,1,0,0,0,0|2,0,0]=4 4175 B12R1.49 CC(Cc1ccc(Br)cc1)C#N Amb24540446 [1,1,0,0,0,0|2,0,0]=4 4176 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [1,1,0,0,0,0|2,0,0]=4 4177 B12R1.49 CC(Cc1ccc(Br)cc1)CBr Amb25366059 [1,1,0,0,0,0|2,0,0]=4 4178 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [1,1,0,0,0,0|2,0,0]=4 4179 B12R1.49 CC(Cc1ccc(Cl)cc1)NN Amb25152282 [1,1,0,0,0,0|1,0,0]=3 4180 B12R1.49 CC(Cc1ccc(F)cc1)C#N Amb25050633 [1,1,0,0,0,0|2,0,0]=4 4181 B12R1.49 CC(Cc1ccc(F)cc1)CBr Amb25115291 [1,1,0,0,0,0|2,0,0]=4 4182 B12R1.49 CC(Cc1ccc(F)cc1)NN Amb25709190 [1,1,0,0,0,0|1,0,0]=3 4183 B12R1.49 CC(Cc1ccc(I)cc1)NN Amb24716530 [1,1,0,0,0,0|1,0,0]=3 4184 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [1,1,0,0,0,0|2,0,0]=4 4185 B12R1.49 CC(Cc1ccc(O)cc1)CO Amb25770294 [1,1,0,0,0,0|2,0,0]=4 4186 B12R1.49 CC(Cc1ccc(O)cc1)NN Amb25189495 [1,1,0,0,0,0|1,0,0]=3 4187 B12R1.49 CCC(Br)Cc1ccc(Br)cc1 Amb18049412 [1,1,0,0,0,0|2,0,0]=4 4188 B12R1.49 CCC(C)CN1C=CC(=O)C=C1 Amb25809661 [1,1,0,0,0,0|2,0,0]=4 4189 B12R1.49 CCC(C)Cc1ccc(N)cc1 Amb25798952 [1,1,0,0,0,0|1,0,0]=3 4190 B12R1.49 CCC(C)Oc1ccc(F)cc1 Amb24568831 [1,1,0,0,0,0|2,0,0]=4 4191 B12R1.49 CCC(C)Sc1ccc(Cl)cc1 Amb25284129 [1,1,0,0,0,0|2,0,0]=4 4192 B12R1.49 CCC(C)Sc1ccc(O)cc1 Amb18321724 [1,1,0,0,0,0|2,0,0]=4 4193 B12R1.49 CCC(Cc1ccc(cc1)Br)Cl Amb17477596 [1,1,0,0,0,0|2,0,0]=4 4194 B12R1.49 CCC(Cc1ccc(cc1)Br)O Amb17477579 [1,1,0,0,0,0|2,0,0]=4 4195 B12R1.49 CCC(Cc1ccc(cc1)C)Cl Amb17477426 [1,1,0,0,0,0|2,0,0]=4 4196 B12R1.49 CCC(Cc1ccc(cc1)C)O Amb17138583 [1,1,0,0,0,0|2,0,0]=4 4197 B12R1.49 CCC(Cc1ccc(cc1)Cl)Cl Amb17477604 [1,1,0,0,0,0|2,0,0]=4 4198 B12R1.49 CCC(Cc1ccc(cc1)Cl)O Amb17139103 [1,1,0,0,0,0|2,0,0]=4 4199 B12R1.49 CCC(Cc1ccc(cc1)F)Cl Amb17477606 [1,1,0,0,0,0|2,0,0]=4 4200 B12R1.49 CCC(Cc1ccc(cc1)F)O Amb17138637 [1,1,0,0,0,0|2,0,0]=4 4201 B12R1.49 CCC(Cl)Cc1ccc(I)cc1 Amb25157799 [1,1,0,0,0,0|2,0,0]=4 4202 B12R1.49 CCC(N)Cc1ccc(Cl)cc1 Amb19374189 [1,1,0,0,0,0|2,0,0]=4 4203 B12R1.49 CCC(N)Cc1ccc(I)cc1 Amb24711014 [1,1,0,0,0,0|2,0,0]=4 4204 B12R1.49 CCC(N)Cc1ccc(N)cc1 Amb24738382 [1,1,0,0,0,0|2,0,0]=4 4205 B12R1.49 CCC(Oc1ccc(cc1)N)C Amb2189169 [1,1,0,0,0,0|2,0,0]=4 4206 B12R1.49 CCN(C)Cc1ccc(Br)cc1 Amb20784350 [1,1,0,0,0,0|2,0,0]=4 4207 B12R1.49 CCN(C)Cc1ccc(F)cc1 Amb25284151 [1,1,0,0,0,0|2,0,0]=4 4208 B12R1.49 CCN(C)Cc1ccc(F)cc1 Amb25706021 [1,1,0,0,0,0|2,0,0]=4 4209 B12R1.49 CCN(C)Cc1ccc(N)cc1 Amb20622466 [1,1,0,0,0,0|2,0,0]=4 4210 B12R1.49 CC[C@@H](C)Oc1ccc(N)cc1 Amb24103201 [1,1,0,0,0,0|2,0,0]=4 4211 B12R1.49 CC[C@@H](N)Cc1ccc(Cl)cc1 Amb24357569 [1,1,0,0,0,0|2,0,0]=4 4212 B12R1.49 CC[C@H](N)Cc1ccc(Cl)cc1 Amb25313710 [1,1,0,0,0,0|2,0,0]=4 4213 B12R1.49 CN(Cc1ccc(Br)cc1)OC Amb25283954 [1,1,0,0,0,0|2,0,0]=4 4214 B12R1.49 CNC(=O)Cc1ccc(I)cc1 Amb25680399 [1,1,0,0,0,0|1,0,1]=4 4215 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [1,1,0,0,0,0|1,0,1]=4 4216 B12R1.49 CNC(=O)Cc1ccc(S)cc1 Amb24346465 [1,1,0,0,0,0|1,0,1]=4 4217 B12R1.49 CNC(=O)Cc1ccc(cc1)C Amb1795465 [1,1,0,0,0,0|1,0,1]=4 4218 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb1117771 [1,1,0,0,0,0|1,0,1]=4 4219 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb15740907 [1,1,0,0,0,0|1,0,1]=4 4220 B12R1.49 CNC(C)CN1C=CC(=O)C=C1 Amb18999201 [1,1,0,0,0,0|1,0,0]=3 4221 B12R1.49 CNC(C)Cc1ccc(Br)c[n]1 Amb24483572 [1,1,0,0,0,0|1,0,0]=3 4222 B12R1.49 CNC(C)Cc1ccc(F)[n]c1 Amb24485445 [1,1,0,0,0,0|1,0,0]=3 4223 B12R1.49 CNC(C)Cc1ccc(F)cc1 Amb22055302 [1,1,0,0,0,0|0,0,0]=2 4224 B12R1.49 CNC(C)Cc1ccc(N)cc1 Amb18050449 [1,1,0,0,0,0|0,0,0]=2 4225 B12R1.49 CNC(Cc1ccc(cc1)O)C Amb17619384 [1,1,0,0,0,0|0,0,0]=2 4226 B12R1.49 CN[C@@H](C)Cc1ccc(Cl)cc1 Amb25123418 [1,1,0,0,0,0|0,0,0]=2 4227 B12R1.49 CN[C@@H](C)Cc1ccc(N)cc1 Amb24710324 [1,1,0,0,0,0|0,0,0]=2 4228 B12R1.49 CN[C@@H](C)Cc1ccc(O)cc1 Amb24451652 [1,1,0,0,0,0|0,0,0]=2 4229 B12R1.49 COC(C)CN1C=CC(=O)C=C1 Amb25291800 [1,1,0,0,0,0|2,0,0]=4 4230 B12R1.49 COC(C)C[n+]1ccc(C)cc1 Amb25663674 [1,1,0,0,0,0|2,0,0]=4 4231 B12R1.49 C[C@@H](CO)Cc1ccc(Cl)cc1 Amb25847856 [1,1,0,0,0,0|2,0,0]=4 4232 B12R1.49 C[C@@H](Cc1ccc(O)cc1)CO Amb24647774 [1,1,0,0,0,0|2,0,0]=4 4233 B12R1.49 C[C@H](CO)Cc1ccc(F)cc1 Amb24387764 [1,1,0,0,0,0|2,0,0]=4 4234 B12R1.49 C[C@H](Cc1ccc(O)cc1)CO Amb25371827 [1,1,0,0,0,0|2,0,0]=4 4235 B12R1.49 C\C(\NC)=N/c1ccc(N)cc1 Amb25109918 [1,1,0,0,0,0|1,0,1]=4 4236 B12R1.49 Cc1ccc(CC(=N)NC)cc1 Amb25187482 [1,1,0,0,0,0|1,0,1]=4 4237 B12R1.49 Cc1ccc(CC(Br)CC)cc1 Amb24399086 [1,1,0,0,0,0|2,0,0]=4 4238 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [1,1,0,0,0,0|2,0,0]=4 4239 B12R1.49 Cc1ccc(CC(C)CBr)cc1 Amb25152481 [1,1,0,0,0,0|2,0,0]=4 4240 B12R1.49 Cc1ccc(CC(C)CC)cc1 Amb25241788 [1,1,0,0,0,0|1,0,0]=3 4241 B12R1.49 Cc1ccc(CC(C)CCl)cc1 Amb24390124 [1,1,0,0,0,0|2,0,0]=4 4242 B12R1.49 Cc1ccc(CC(C)CO)cc1 Amb24354502 [1,1,0,0,0,0|2,0,0]=4 4243 B12R1.49 Cc1ccc(CN(C)CC)cc1 Amb25115746 [1,1,0,0,0,0|2,0,0]=4 4244 B12R1.49 Cc1ccc(CN(C)OC)cc1 Amb25048286 [1,1,0,0,0,0|2,0,0]=4 4245 B12R1.49 Cc1ccc(C[C@@H](C)CO)cc1 Amb25687834 [1,1,0,0,0,0|2,0,0]=4 4246 B12R1.49 Cc1ccc(C[C@@H](C)NC)cc1 Amb25233407 [1,1,0,0,0,0|0,0,0]=2 4247 B12R1.49 Cc1ccc(C[C@H](C)CO)cc1 Amb25221031 [1,1,0,0,0,0|2,0,0]=4 4248 B12R1.49 Cc1ccc(cc1)N[C@@H](C)CC Amb24635875 [1,1,0,0,0,0|2,0,0]=4 4249 B12R1.50 CC(CCl)Cc1cc(Br)ccc1 Amb24728303 [1,1,0,0,0,0|2,0,0]=4 4250 B12R1.50 CC(CN)Cc1cc(Br)ccc1 Amb18992227 [1,1,0,0,0,0|2,0,0]=4 4251 B12R1.50 CC(CN)Cc1cc(F)ccc1 Amb18299465 [1,1,0,0,0,0|2,0,0]=4 4252 B12R1.50 CC(CN)Cc1cc(O)ccc1 Amb24537853 [1,1,0,0,0,0|2,0,0]=4 4253 B12R1.50 CC(CO)Cc1cc(Br)ccc1 Amb25729945 [1,1,0,0,0,0|2,0,0]=4 4254 B12R1.50 CC(CO)Cc1cc(Cl)ccc1 Amb25212222 [1,1,0,0,0,0|2,0,0]=4 4255 B12R1.50 CC(CO)Cc1cc(F)ccc1 Amb25228330 [1,1,0,0,0,0|2,0,0]=4 4256 B12R1.50 CC(Cc1cc(O)ccc1)CO Amb24579423 [1,1,0,0,0,0|2,0,0]=4 4257 B12R1.50 CC(Cc1cccc(Br)c1)C#N Amb25159927 [1,1,0,0,0,0|2,0,0]=4 4258 B12R1.50 CC(Cc1cccc(Br)c1)NN Amb25342052 [1,1,0,0,0,0|1,0,0]=3 4259 B12R1.50 CC(Cc1cccc(Cl)c1)C#N Amb25762801 [1,1,0,0,0,0|2,0,0]=4 4260 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [1,1,0,0,0,0|2,0,0]=4 4261 B12R1.50 CC(Cc1cccc(Cl)c1)NN Amb24434144 [1,1,0,0,0,0|1,0,0]=3 4262 B12R1.50 CC(Cc1cccc(F)c1)NN Amb25056305 [1,1,0,0,0,0|1,0,0]=3 4263 B12R1.50 CC(Cc1cccc(F)c1)NO Amb25056304 [1,1,0,0,0,0|1,0,0]=3 4264 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [1,1,0,0,0,0|2,0,0]=4 4265 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [1,1,0,0,0,0|2,0,0]=4 4266 B12R1.50 CC(Cc1cccc(O)c1)CBr Amb24444691 [1,1,0,0,0,0|2,0,0]=4 4267 B12R1.50 CC(Cc1cccc(O)c1)CCl Amb24537852 [1,1,0,0,0,0|2,0,0]=4 4268 B12R1.50 CCC(Br)Cc1cc(Br)ccc1 Amb18049408 [1,1,0,0,0,0|2,0,0]=4 4269 B12R1.50 CCC(Br)Cc1cc(F)ccc1 Amb25039883 [1,1,0,0,0,0|2,0,0]=4 4270 B12R1.50 CCC(C)Oc1cccc(I)c1 Amb24422625 [1,1,0,0,0,0|2,0,0]=4 4271 B12R1.50 CCC(C)Sc1cccc(Br)c1 Amb25706089 [1,1,0,0,0,0|2,0,0]=4 4272 B12R1.50 CCC(C)Sc1cccc(N)c1 Amb18289356 [1,1,0,0,0,0|2,0,0]=4 4273 B12R1.50 CCC(C)Sc1cccc(O)c1 Amb25136875 [1,1,0,0,0,0|2,0,0]=4 4274 B12R1.50 CCC(Cc1cccc(c1)Br)Cl Amb17477597 [1,1,0,0,0,0|2,0,0]=4 4275 B12R1.50 CCC(Cc1cccc(c1)Br)O Amb17477580 [1,1,0,0,0,0|2,0,0]=4 4276 B12R1.50 CCC(Cc1cccc(c1)C)Cl Amb17477424 [1,1,0,0,0,0|2,0,0]=4 4277 B12R1.50 CCC(Cc1cccc(c1)C)O Amb17138582 [1,1,0,0,0,0|2,0,0]=4 4278 B12R1.50 CCC(Cc1cccc(c1)Cl)Cl Amb17477605 [1,1,0,0,0,0|2,0,0]=4 4279 B12R1.50 CCC(Cc1cccc(c1)Cl)O Amb17139102 [1,1,0,0,0,0|2,0,0]=4 4280 B12R1.50 CCC(Cc1cccc(c1)F)O Amb17138636 [1,1,0,0,0,0|2,0,0]=4 4281 B12R1.50 CCC(Cl)Cc1cc(F)ccc1 Amb19046367 [1,1,0,0,0,0|2,0,0]=4 4282 B12R1.50 CCC(N)Cc1cc(I)ccc1 Amb25800100 [1,1,0,0,0,0|2,0,0]=4 4283 B12R1.50 CCC(Oc1cccc(c1)N)C Amb2189170 [1,1,0,0,0,0|2,0,0]=4 4284 B12R1.50 CCN(C)Cc1cccc(Cl)c1 Amb24619073 [1,1,0,0,0,0|2,0,0]=4 4285 B12R1.50 CCN(C)Cc1cccc(Cl)c1 Amb25769163 [1,1,0,0,0,0|2,0,0]=4 4286 B12R1.50 CC[C@@H](N)Cc1cc(F)ccc1 Amb24535474 [1,1,0,0,0,0|2,0,0]=4 4287 B12R1.50 CC[C@H](C)Oc1cccc(O)c1 Amb24497029 [1,1,0,0,0,0|2,0,0]=4 4288 B12R1.50 CC[C@H](N)Cc1cc(Cl)ccc1 Amb24668259 [1,1,0,0,0,0|2,0,0]=4 4289 B12R1.50 CN(Cc1cccc(Br)c1)OC Amb25317009 [1,1,0,0,0,0|2,0,0]=4 4290 B12R1.50 CN(Cc1cccc(Cl)c1)OC Amb24557097 [1,1,0,0,0,0|2,0,0]=4 4291 B12R1.50 CNC(=N)Cc1cccc(Br)c1 Amb25830995 [1,1,0,0,0,0|1,0,1]=4 4292 B12R1.50 CNC(=O)Cc1cccc(Br)c1 Amb23111023 [1,1,0,0,0,0|1,0,1]=4 4293 B12R1.50 CNC(=O)Cc1cccc(Cl)c1 Amb22984156 [1,1,0,0,0,0|1,0,1]=4 4294 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [1,1,0,0,0,0|1,0,1]=4 4295 B12R1.50 CNC(=O)Cc1cccc(c1)C Amb2106610 [1,1,0,0,0,0|1,0,1]=4 4296 B12R1.50 CNC(C)Cc1cc[n]c(N)c1 Amb24604361 [1,1,0,0,0,0|1,0,0]=3 4297 B12R1.50 CNC(C)Cc1cccc(F)c1 Amb18792939 [1,1,0,0,0,0|0,0,0]=2 4298 B12R1.50 CNC(C)Cc1cccc(S)c1 Amb24542790 [1,1,0,0,0,0|0,0,0]=2 4299 B12R1.50 CNC(Cc1cccc(c1)F)C Amb17614425 [1,1,0,0,0,0|0,0,0]=2 4300 B12R1.50 CNC(Cc1cccc(n1)C)C Amb1995163 [1,1,0,0,0,0|1,0,0]=3 4301 B12R1.50 CNC(Cc1nccc(c1)C)C Amb1995160 [1,1,0,0,0,0|1,0,0]=3 4302 B12R1.50 CN[C@@H](C)Cc1cccc(O)c1 Amb25697180 [1,1,0,0,0,0|0,0,0]=2 4303 B12R1.50 Cc1cccc(CC(Br)CC)c1 Amb24483315 [1,1,0,0,0,0|2,0,0]=4 4304 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [1,1,0,0,0,0|2,0,0]=4 4305 B12R1.50 Cc1cccc(CC(C)CO)c1 Amb24341616 [1,1,0,0,0,0|2,0,0]=4 4306 B12R1.50 Cc1cccc(CN(C)CC)c1 Amb25749187 [1,1,0,0,0,0|2,0,0]=4 4307 B12R1.50 Cc1cccc(CN(C)OC)c1 Amb24474494 [1,1,0,0,0,0|2,0,0]=4 4308 B12R1.50 Cc1cccc(c1)OC(C)CC Amb24484235 [1,1,0,0,0,0|2,0,0]=4 4309 B12R1.118 C#CC(CO)Cc1ccccc1 Amb25105982 [1,1,0,0,0,0|1,0,1]=4 4310 B12R1.118 CCC(CN)Oc1ccccc1 Amb18311092 [1,1,0,0,0,0|2,0,0]=4 4311 B12R1.118 CCC(CO)Oc1ccccc1 Amb23538023 [1,1,0,0,0,0|2,0,0]=4 4312 B12R1.118 CCC(Cc1c[n]ccc1)CC Amb24090136 [1,1,0,0,0,0|2,0,0]=4 4313 B12R1.118 CCC(Cc1ccccc1)CN Amb10778756 [1,1,0,0,0,0|1,0,0]=3 4314 B12R1.118 CCC(Cc1ccccc1)NC Amb18792514 [1,1,0,0,0,0|0,0,0]=2 4315 B12R1.118 CCC(Nc1ccccc1)CO Amb13952611 [1,1,0,0,0,0|2,0,0]=4 4316 B12R1.118 CCN(Cc1ccccc1)CC Amb22348278 [1,1,0,0,0,0|2,0,0]=4 4317 B12R1.118 CNC(Cc1c[n]ccc1)C#C Amb25692745 [1,1,0,0,0,0|1,0,1]=4 4318 B12R1.118 CNC(Cc1cc[n]cc1)C#C Amb25698692 [1,1,0,0,0,0|1,0,1]=4 4319 B12R1.118 CNC(Cc1ccccc1)C#C Amb25797878 [1,1,0,0,0,0|0,0,1]=3 4320 B12R1.118 CN[C@@H](CO)Cc1ccccc1 Amb22745072 [1,1,0,0,0,0|0,0,0]=2 4321 B12R1.118 CN\C(=N\C)\Sc1ccccc1 Amb24451577 [1,1,0,0,0,0|1,0,1]=4 4322 B12R1.118 CN\C(\Cc1ccccc1)=N/N Amb18788196 [1,1,0,0,0,0|1,0,1]=4 4323 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [1,1,0,0,0,0|1,0,1]=4 4324 B12R1.118 COC(CN)Cc1ccccc1 Amb21954040 [1,1,0,0,0,0|1,0,0]=3 4325 B12R1.118 COC(CN)Oc1ccccc1 Amb24061283 [1,1,0,0,0,0|2,0,0]=4 4326 B12R1.118 COC(Cc1ccccc1)C#N Amb25681947 [1,1,0,0,0,0|1,0,1]=4 4327 B12R1.118 COC(OC)Sc1ccccc1 Amb22347498 [1,1,0,0,0,0|2,0,0]=4 4328 B12R1.118 CSC(Cc1ccccc1)C#N Amb17594511 [1,1,0,0,0,0|1,0,1]=4 4329 B12R1.118 C\N=C(\Cc1ccc[n]c1)/NC Amb24062496 [1,1,0,0,0,0|1,0,1]=4 4330 B12R1.118 N#CC(CBr)Cc1ccccc1 Amb25821723 [1,1,0,0,0,0|2,0,0]=4 4331 B12R1.118 N#CC(CCl)Cc1ccccc1 Amb24753458 [1,1,0,0,0,0|2,0,0]=4 4332 B12R1.118 N#CC(CO)Cc1ccccc1 Amb18110109 [1,1,0,0,0,0|2,0,0]=4 4333 B12R1.118 NCC(CO)Cc1ccccc1 Amb22899484 [1,1,0,0,0,0|2,0,0]=4 4334 B12R1.118 NCC(Cc1ccccc1)C#N Amb18908588 [1,1,0,0,0,0|2,0,0]=4 4335 B12R1.194 C#CC(Cc1ccccc1)(O)C Amb1083082 [1,1,0,0,0,0|1,0,1]=4 4336 B12R1.194 CC(C)(CN)Cc1ccccc1 Amb19310600 [1,1,0,0,0,0|2,0,0]=4 4337 B12R1.194 CC(C)(Cc1ccccc1)N=O Amb22055953 [1,1,0,0,0,0|1,0,1]=4 4338 B12R1.194 CC(C)(Cc1ccccc1)NC Amb22349936 [1,1,0,0,0,0|0,0,0]=2 4339 B12R1.194 CC(C)(Cc1ccccc1)NN Amb18646155 [1,1,0,0,0,0|1,0,0]=3 4340 B12R1.194 CC(C)(Cc1ccccc1)NO Amb24411489 [1,1,0,0,0,0|1,0,0]=3 4341 B12R1.194 CC(Cl)(CO)Cc1ccccc1 Amb25115909 [1,1,0,0,0,0|2,0,0]=4 4342 B12R1.194 CC(Cl)(Cc1ccccc1)C#N Amb18791085 [1,1,0,0,0,0|2,0,0]=4 4343 B12R1.194 CC(N)(CO)Cc1ccccc1 Amb19001800 [1,1,0,0,0,0|2,0,0]=4 4344 B12R1.194 CC(N)(Cc1ccccc1)CN Amb19001789 [1,1,0,0,0,0|2,0,0]=4 4345 B12R1.194 CC(O)(Cc1ccccc1)C#N Amb18177733 [1,1,0,0,0,0|2,0,0]=4 4346 B12R1.194 CC(O)(Cc1ccccc1)NN Amb25361538 [1,1,0,0,0,0|1,0,0]=3 4347 B12R1.194 CCC(C)(Cl)Cc1ccccc1 Amb25080041 [1,1,0,0,0,0|1,0,0]=3 4348 B12R1.194 CCC(C)(N)Cc1cc[n]cc1 Amb24483651 [1,1,0,0,0,0|2,0,0]=4 4349 B12R1.194 CCC(C)(O)Cc1cc[n]cc1 Amb25075866 [1,1,0,0,0,0|2,0,0]=4 4350 B12R1.194 CNC(C)(C)Cc1c[n]ccc1 Amb24544019 [1,1,0,0,0,0|1,0,0]=3 4351 B12R1.194 CNS(=O)(=O)Cc1ccccc1 Amb1125735 [1,1,0,0,0,0|2,0,0]=4 4352 B12R1.194 COC(Cc1ccccc1)(C)C Amb10555866 [1,1,0,0,0,0|1,0,0]=3 4353 B12R1.194 CO[Si](C)(C)Cc1ccccc1 Amb22167044 [1,1,0,0,0,0|1,1,0]=4 4354 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [1,1,0,0,0,0|2,0,0]=4 4355 B12R1.194 C[C@@](O)(Cc1ccccc1)CO Amb25817130 [1,1,0,0,0,0|2,0,0]=4 4356 B12R1.194 C[C@](O)(Cc1ccccc1)CO Amb24474165 [1,1,0,0,0,0|2,0,0]=4 4357 B12R1.194 N#CC(Cc1ccccc1)(C)C Amb17333794 [1,1,0,0,0,0|2,0,0]=4 4358 B12R1.194 N#CC(Cc1ccccc1)(N)C Amb17232330 [1,1,0,0,0,0|2,0,0]=4 4359 B12R1.194 NCC(Cc1ccccc1)(C)C Amb17333839 [1,1,0,0,0,0|2,0,0]=4 4360 B12R1.194 NCC(Cc1ccccc1)(O)C Amb17082131 [1,1,0,0,0,0|2,0,0]=4 4361 B12R1.194 ONC(Cc1ccccc1)(C)C Amb17615684 [1,1,0,0,0,0|1,0,0]=3 4362 B12R1.371 CC(CN)Cc1ccccc1Br Amb18992226 [1,1,0,0,0,0|2,0,0]=4 4363 B12R1.371 CC(CO)Cc1ccccc1Br Amb25208316 [1,1,0,0,0,0|2,0,0]=4 4364 B12R1.371 CC(CO)Cc1ccccc1Cl Amb25039912 [1,1,0,0,0,0|2,0,0]=4 4365 B12R1.371 CC(Cc1c[n]ccc1N)NN Amb24681844 [1,1,0,0,0,0|2,0,0]=4 4366 B12R1.371 CC(Cc1ccc[n]c1N)NN Amb25121417 [1,1,0,0,0,0|2,0,0]=4 4367 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [1,1,0,0,0,0|2,0,0]=4 4368 B12R1.371 CC(Cc1ccccc1Br)CBr Amb25040689 [1,1,0,0,0,0|2,0,0]=4 4369 B12R1.371 CC(Cc1ccccc1Cl)C#N Amb25717018 [1,1,0,0,0,0|2,0,0]=4 4370 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [1,1,0,0,0,0|2,0,0]=4 4371 B12R1.371 CC(Cc1ccccc1F)CBr Amb25741700 [1,1,0,0,0,0|2,0,0]=4 4372 B12R1.371 CC(Cc1ccccc1F)CCl Amb25349982 [1,1,0,0,0,0|2,0,0]=4 4373 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [1,1,0,0,0,0|2,0,0]=4 4374 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [1,1,0,0,0,0|2,0,0]=4 4375 B12R1.371 CCC(Br)Cc1ccccc1Cl Amb24675424 [1,1,0,0,0,0|2,0,0]=4 4376 B12R1.371 CCC(C)CN1C=CC=CC1=O Amb25667279 [1,1,0,0,0,0|2,0,0]=4 4377 B12R1.371 CCC(C)Cc1ccccc1N Amb25034567 [1,1,0,0,0,0|1,0,0]=3 4378 B12R1.371 CCC(C)Oc1ccccc1I Amb24531541 [1,1,0,0,0,0|2,0,0]=4 4379 B12R1.371 CCC(C)Sc1ccccc1O Amb19045078 [1,1,0,0,0,0|2,0,0]=4 4380 B12R1.371 CCC(Cc1ccccc1C)Cl Amb17477425 [1,1,0,0,0,0|2,0,0]=4 4381 B12R1.371 CCC(Cc1ccccc1C)O Amb17138581 [1,1,0,0,0,0|2,0,0]=4 4382 B12R1.371 CCC(Cc1ccccc1Cl)Cl Amb17477603 [1,1,0,0,0,0|2,0,0]=4 4383 B12R1.371 CCC(Cc1ccccc1Cl)O Amb17139101 [1,1,0,0,0,0|2,0,0]=4 4384 B12R1.371 CCC(Cc1ccccc1F)O Amb17138635 [1,1,0,0,0,0|2,0,0]=4 4385 B12R1.371 CCC(Cl)Cc1ccccc1F Amb19046368 [1,1,0,0,0,0|2,0,0]=4 4386 B12R1.371 CCC(N)Cc1ccccc1Br Amb20627508 [1,1,0,0,0,0|2,0,0]=4 4387 B12R1.371 CCC(O)Cc1ccccc1Br Amb24465632 [1,1,0,0,0,0|2,0,0]=4 4388 B12R1.371 CCC(O)Cc1ccccc1N Amb25335274 [1,1,0,0,0,0|2,0,0]=4 4389 B12R1.371 CCN(C)Cc1ccccc1Br Amb24370391 [1,1,0,0,0,0|2,0,0]=4 4390 B12R1.371 CCN(C)Cc1ccccc1Cl Amb25107530 [1,1,0,0,0,0|2,0,0]=4 4391 B12R1.371 CCN(C)Cc1ccccc1F Amb25749463 [1,1,0,0,0,0|2,0,0]=4 4392 B12R1.371 CCN(C)Cc1ccccc1F Amb25846054 [1,1,0,0,0,0|2,0,0]=4 4393 B12R1.371 CCN(C)Cc1ccccc1O Amb24493028 [1,1,0,0,0,0|2,0,0]=4 4394 B12R1.371 CN(Cc1ccccc1Cl)OC Amb25284132 [1,1,0,0,0,0|2,0,0]=4 4395 B12R1.371 CNC(=N)Cc1ccccc1F Amb24483570 [1,1,0,0,0,0|1,0,1]=4 4396 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [1,1,0,0,0,0|1,0,1]=4 4397 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [1,1,0,0,0,0|1,0,1]=4 4398 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [1,1,0,0,0,0|1,0,1]=4 4399 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [1,1,0,0,0,0|1,0,1]=4 4400 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [1,1,0,0,0,0|1,0,1]=4 4401 B12R1.371 CNC(C)CN1C=CC=CC1=O Amb18982094 [1,1,0,0,0,0|1,0,0]=3 4402 B12R1.371 CNC(C)CN1C=CC=NC1=O Amb18982049 [1,1,0,0,0,0|2,0,0]=4 4403 B12R1.371 CNC(C)CN1C=NC=CC1=O Amb25751317 [1,1,0,0,0,0|2,0,0]=4 4404 B12R1.371 CNC(C)CN1N=CC=CC1=O Amb18301681 [1,1,0,0,0,0|2,0,0]=4 4405 B12R1.371 CNC(C)Cc1c[n]ccc1N Amb24763568 [1,1,0,0,0,0|1,0,0]=3 4406 B12R1.371 CNC(C)Cc1cc[n]cc1Cl Amb24379712 [1,1,0,0,0,0|1,0,0]=3 4407 B12R1.371 CNC(C)Cc1ccc[n]c1F Amb24648892 [1,1,0,0,0,0|1,0,0]=3 4408 B12R1.371 CNC(C)Cc1ccc[n]c1N Amb24715833 [1,1,0,0,0,0|1,0,0]=3 4409 B12R1.371 CNC(C)Cc1ccccc1Br Amb25149882 [1,1,0,0,0,0|0,0,0]=2 4410 B12R1.371 CNC(Cc1ncccc1C)C Amb1995153 [1,1,0,0,0,0|1,0,0]=3 4411 B12R1.371 CN[C@@H](C)Cc1ccccc1F Amb25264769 [1,1,0,0,0,0|0,0,0]=2 4412 B12R1.371 COC(C)C[n+]1ccccc1C Amb25663675 [1,1,0,0,0,0|2,0,0]=4 4413 B12R1.371 COC(C)Cc1c[n]ccc1N Amb25691169 [1,1,0,0,0,0|2,0,0]=4 4414 B12R1.371 COC(C)Cc1ccccc1O Amb18646540 [1,1,0,0,0,0|1,0,0]=3 4415 B12R1.371 COC(C)Oc1ccccc1O Amb25334885 [1,1,0,0,0,0|2,0,0]=4 4416 B12R1.371 C[C@@H](Cc1ccccc1O)CO Amb24633514 [1,1,0,0,0,0|2,0,0]=4 4417 B12R1.371 C[C@H](CO)Cc1ccccc1Cl Amb25157925 [1,1,0,0,0,0|2,0,0]=4 4418 B12R1.371 C[C@H](CO)Cc1ccccc1F Amb25837933 [1,1,0,0,0,0|2,0,0]=4 4419 B12R1.371 C[C@H](Cc1ccccc1O)CO Amb25094364 [1,1,0,0,0,0|2,0,0]=4 4420 B12R1.371 C\C(\Cc1ccccc1O)=C/C Amb25130619 [1,1,0,0,0,0|1,0,1]=4 4421 B12R1.371 C\C(\Cc1ccccc1O)=C\C Amb24380771 [1,1,0,0,0,0|1,0,1]=4 4422 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [1,1,0,0,0,0|2,0,0]=4 4423 B12R1.371 Cc1ccccc1CC(C)CBr Amb25733982 [1,1,0,0,0,0|2,0,0]=4 4424 B12R1.371 Cc1ccccc1CC(C)CO Amb25152371 [1,1,0,0,0,0|2,0,0]=4 4425 B12R1.371 Cc1ccccc1CC(C)NC Amb24271197 [1,1,0,0,0,0|0,0,0]=2 4426 B12R1.371 Cc1ccccc1C[C@@H](N)CC Amb24410901 [1,1,0,0,0,0|2,0,0]=4 4427 B12R1.371 Cc1ccccc1C[C@H](O)CC Amb25157887 [1,1,0,0,0,0|2,0,0]=4 4428 B12R1.33 CC(CC)C(O)c1c[s]c(I)c1 Amb25188258 [0,1,0,0,1,0|2,0,0]=4 4429 B12R1.33 CC(CC)C(O)c1cc(Cl)c[s]1 Amb25848781 [0,1,0,0,1,0|2,0,0]=4 4430 B12R1.33 CC(CC)C(O)c1ccc(Br)o1 Amb25677884 [0,1,0,0,1,0|2,0,0]=4 4431 B12R1.33 CC(CC)C(O)c1coc(Br)c1 Amb24582396 [0,1,0,0,1,0|2,0,0]=4 4432 B12R1.33 CC(OC)C(O)c1ccc(Cl)[s]1 Amb24684227 [0,1,0,0,1,0|2,0,0]=4 4433 B12R1.33 Cc1c[s]c([n]1)C(O)C(C)NC Amb25159384 [0,1,0,0,1,0|2,0,0]=4 4434 B12R1.33 Cc1cc(c[s]1)C(O)C(C)CC Amb25703369 [0,1,0,0,1,0|2,0,0]=4 4435 B12R1.33 Cc1cc(c[s]1)C(O)C(C)OC Amb24342011 [0,1,0,0,1,0|2,0,0]=4 4436 B12R1.33 Cc1ccc([s]1)C(C)C(C)NC Amb25827938 [0,1,0,0,1,0|2,0,0]=4 4437 B12R1.33 Cc1ccc([s]1)C(O)C(C)CC Amb19057644 [0,1,0,0,1,0|2,0,0]=4 4438 B12R1.33 Cc1ccc([s]1)C(O)C(C)OC Amb24387260 [0,1,0,0,1,0|2,0,0]=4 4439 B12R1.55 CC(NC=O)C(O)c1cc[s]c1 Amb25756683 [0,1,0,0,1,0|1,0,1]=4 4440 B12R1.55 CC(NC=O)C(O)c1ccco1 Amb24385996 [0,1,0,0,1,0|1,0,1]=4 4441 B12R1.55 C[C@@H](NC=O)[C@@H](O)c1ccc[s]1 Amb25364949 [0,1,0,0,1,0|1,0,1]=4 4442 B12R1.55 C[C@H](NC=O)[C@H](O)c1ccco1 Amb25046827 [0,1,0,0,1,0|1,0,1]=4 4443 B12R1.55 C[C@H](NC=O)[C@H](O)c1ccoc1 Amb25702489 [0,1,0,0,1,0|1,0,1]=4 4444 B12R1.55 C[C@H](\C=C\C)[C@@H](O)c1ccco1 Amb25284606 [0,1,0,0,1,0|2,0,0]=4 4445 B12R1.74 CCC(NC)C(O)c1ccc[s]1 Amb18606184 [0,1,0,0,1,0|1,0,0]=3 4446 B12R1.120 CC(=C)C(C)C(O)c1ccco1 Amb25144471 [0,1,0,0,1,0|2,0,0]=4 4447 B12R1.120 CC(=O)C(C)C(O)c1ccco1 Amb25132598 [0,1,0,0,1,0|2,0,0]=4 4448 B12R1.120 CC(=O)C(C)[C@@H](O)c1ccco1 Amb24662439 [0,1,0,0,1,0|2,0,0]=4 4449 B12R1.120 CC(=O)[C@@H](C)[C@@H](O)c1ccco1 Amb24721715 [0,1,0,0,1,0|2,0,0]=4 4450 B12R1.120 CC(=O)[C@H](C)[C@@H](O)c1ccco1 Amb25128259 [0,1,0,0,1,0|2,0,0]=4 4451 B12R1.120 CC(=O)[C@H](C)[C@H](O)c1ccc[s]1 Amb24457891 [0,1,0,0,1,0|2,0,0]=4 4452 B12R1.120 CC(C)C(C)C(O)c1c[s]cc1 Amb25076084 [0,1,0,0,1,0|2,0,0]=4 4453 B12R1.120 CC(C)C(C)C(O)c1cocc1 Amb24713256 [0,1,0,0,1,0|2,0,0]=4 4454 B12R1.120 CC(O)C(C)C(O)c1ccco1 Amb25065525 [0,1,0,0,1,0|2,0,0]=4 4455 B12R1.120 C[C@@H](O)C(C)C(O)c1ccco1 Amb24343492 [0,1,0,0,1,0|2,0,0]=4 4456 B12R1.200 CCC(C)(C)C(O)c1ccc[nH]1 Amb25794878 [0,1,0,0,1,0|2,0,0]=4 4457 B12R1.200 CCC(C)(C)C(O)c1ccc[s]1 Amb19068976 [0,1,0,0,1,0|2,0,0]=4 4458 B12R1.200 CCC(C)(O)C(O)c1c[s]cc1 Amb25816317 [0,1,0,0,1,0|2,0,0]=4 4459 B12R1.200 CCC(C)(O)C(O)c1ccc[s]1 Amb25720680 [0,1,0,0,1,0|2,0,0]=4 4460 B12R1.200 CNC(C)(C)C(F)c1c[s]cc1 Amb24693649 [0,1,0,0,1,0|2,0,0]=4 4461 B12R1.200 CNC(C)(C)C(F)c1ccc[nH]1 Amb24710999 [0,1,0,0,1,0|2,0,0]=4 4462 B12R1.200 CNC(C)(C)C(O)c1ccc[nH]1 Amb25036336 [0,1,0,0,1,0|1,0,0]=3 4463 B12R1.200 CNC(C)(C)C(O)c1ccco1 Amb24419483 [0,1,0,0,1,0|1,0,0]=3 4464 B12R1.200 CNC(C)(C)C(O)c1cocc1 Amb25053731 [0,1,0,0,1,0|1,0,0]=3 4465 B12R1.200 COC(C)(C)C(O)c1ccc[nH]1 Amb24525596 [0,1,0,0,1,0|2,0,0]=4 4466 B12R1.200 COC(C)(C)C(O)c1ccc[s]1 Amb25138327 [0,1,0,0,1,0|2,0,0]=4 4467 B12R1.200 COC(C)(C)C(O)c1cocc1 Amb24741158 [0,1,0,0,1,0|2,0,0]=4 4468 B12R1.200 CSC(C)(C)C(O)c1ccc[nH]1 Amb25172443 [0,1,0,0,1,0|2,0,0]=4 4469 B12R1.468 CC(CC)C(O)c1[s]ccc1I Amb24475237 [0,1,0,0,1,0|2,0,0]=4 4470 B12R1.468 CC(CC)C(O)c1occc1Br Amb25211329 [0,1,0,0,1,0|2,0,0]=4 4471 B12R1.468 CC(OC)C(O)c1cc[s]c1Cl Amb24650430 [0,1,0,0,1,0|2,0,0]=4 4472 B12R1.468 Cc1[s]ccc1C(O)C(C)OC Amb24647144 [0,1,0,0,1,0|2,0,0]=4 4473 B12R1.468 Cc1cc[s]c1C(O)C(C)CC Amb19057659 [0,1,0,0,1,0|2,0,0]=4 4474 B12R1.468 Cc1ccoc1C(O)C(C)CC Amb25716608 [0,1,0,0,1,0|2,0,0]=4 4475 B12R1.468 Cc1cocc1C(O)C(C)CC Amb24612308 [0,1,0,0,1,0|2,0,0]=4 4476 B12R1.468 Cc1cocc1C(O)C(C)OC Amb24580576 [0,1,0,0,1,0|2,0,0]=4 4477 B12R1.473 CCC(C)C(C)(O)c1c[s]cc1 Amb25312786 [0,1,0,0,1,0|2,0,0]=4 4478 B12R1.473 CCC(C)C(C)(O)c1ccc[nH]1 Amb25817429 [0,1,0,0,1,0|2,0,0]=4 4479 B12R1.473 CCC(C)C(C)(O)c1ccc[s]1 Amb19057641 [0,1,0,0,1,0|2,0,0]=4 4480 B12R1.473 CCC(C)C(C)(O)c1cocc1 Amb25283539 [0,1,0,0,1,0|2,0,0]=4 4481 B12R1.473 COC(C)C(C)(O)c1ccc[s]1 Amb25074276 [0,1,0,0,1,0|2,0,0]=4 4482 B12R1.473 COC(C)C(C)(O)c1ccco1 Amb25362980 [0,1,0,0,1,0|2,0,0]=4 4483 B12R1.473 COC(C)C(C)(O)c1cocc1 Amb24635336 [0,1,0,0,1,0|2,0,0]=4 4484 B14R1.10 CNC(=O)CC(O)c1ccc(F)cc1 Amb25166087 [0,1,0,0,0,1|1,0,1]=4 4485 B14R1.10 Cc1ccc(cc1)C(O)CC(=O)NC Amb24566206 [0,1,0,0,0,1|1,0,1]=4 4486 B14R1.10 OC(c1ccc(cc1)Br)CC(C#N)C Amb17354632 [0,1,0,0,0,1|2,0,0]=4 4487 B14R1.10 OC(c1ccc(cc1)C)CC(C#N)C Amb17336111 [0,1,0,0,0,1|2,0,0]=4 4488 B14R1.10 OC(c1ccc(cc1)Cl)CC(C#N)C Amb17339415 [0,1,0,0,0,1|2,0,0]=4 4489 B14R1.10 OC(c1ccc(cc1)F)CC(C#N)C Amb17336579 [0,1,0,0,0,1|2,0,0]=4 4490 B14R1.10 OC(c1ccc(cc1)O)CC(C#N)C Amb17336303 [0,1,0,0,0,1|2,0,0]=4 4491 B14R1.11 N#CC(CC(c1cccc(c1)Br)O)C Amb17354630 [0,1,0,0,0,1|2,0,0]=4 4492 B14R1.11 N#CC(CC(c1cccc(c1)C)O)C Amb17336109 [0,1,0,0,0,1|2,0,0]=4 4493 B14R1.11 N#CC(CC(c1cccc(c1)Cl)O)C Amb17339413 [0,1,0,0,0,1|2,0,0]=4 4494 B14R1.11 N#CC(CC(c1cccc(c1)O)O)C Amb17336305 [0,1,0,0,0,1|2,0,0]=4 4495 B14R1.29 CC#C[C@@H](O)C[C@@H](O)c1ccccc1 Amb25306285 [0,1,0,0,0,1|2,0,0]=4 4496 B14R1.29 CC(NC(C)CCN)c1ccccc1 Amb20090497 [0,1,0,0,0,1|2,0,0]=4 4497 B14R1.29 CCCN(C)CC(O)c1ccccc1 Amb19051169 [0,1,0,0,0,1|2,0,0]=4 4498 B14R1.29 OCCN(CC(c1ccccc1)O)C Amb1210917 [0,1,0,0,0,1|2,0,0]=4 4499 B14R1.58 CCN(CC(c1ccccc1)O)CC Amb10563752 [0,1,0,0,0,1|2,0,0]=4 4500 B14R1.58 CNC(NC(C)c1ccccc1)=NC Amb20631907 [0,1,0,0,0,1|1,0,1]=4 4501 B14R1.58 CN\C(=N\C)\SC(C)c1ccccc1 Amb25293833 [0,1,0,0,0,1|1,0,1]=4 4502 B14R1.58 CN\C(\N[C@@H](C)c1ccccc1)=N\C Amb24603079 [0,1,0,0,0,1|1,0,1]=4 4503 B14R1.58 C[C@H]([NH2+]C(CC)CC)c1ccccc1 Amb22049557 [0,1,0,0,0,1|2,0,0]=4 4504 B14R1.85 CC(C(O)c1ccccc1)C(=O)NC Amb25166106 [0,1,0,0,0,1|1,0,1]=4 4505 B14R1.85 CC(C(O)c1ccccc1)N(C)CC Amb19079599 [0,1,0,0,0,1|2,0,0]=4 4506 B14R1.85 CC(C(O)c1ccccc1)N(C)CC Amb22055194 [0,1,0,0,0,1|2,0,0]=4 4507 B14R1.85 CNC(=O)C(Cl)C(O)c1ccccc1 Amb25790564 [0,1,0,0,0,1|1,0,1]=4 4508 B14R1.85 CNC(=O)C(O)C(O)c1ccccc1 Amb25035731 [0,1,0,0,0,1|1,0,1]=4 4509 B14R1.85 C\C(=C\C)\C(=O)C(O)c1ccccc1 Amb25852903 [0,1,0,0,0,1|1,0,1]=4 4510 B14R1.85 C\C(=C\C)\[C@H](C)[C@H](O)c1ccccc1 Amb25788111 [0,1,0,0,0,1|1,0,1]=4 4511 B14R1.290 CC(C)(CC(O)c1ccccc1)C#N Amb24715227 [0,1,0,0,0,1|2,0,0]=4 4512 B14R1.415 CC(C)C(C)N[C@@H](C)c1ccccc1 Amb24309142 [0,1,0,0,0,1|2,0,0]=4 4513 B14R1.415 CC(C)[C@@H](N)C[C@H](O)c1ccccc1 Amb19929620 [0,1,0,0,0,1|2,0,0]=4 4514 B14R1.587 N#CC(CC(c1ccccc1C)O)C Amb17336107 [0,1,0,0,0,1|2,0,0]=4 4515 B14R1.587 N#CC(CC(c1ccccc1Cl)O)C Amb17339411 [0,1,0,0,0,1|2,0,0]=4 4516 B14R1.587 N#CC(CC(c1ccccc1F)O)C Amb17336577 [0,1,0,0,0,1|2,0,0]=4 4517 B14R1.741 CC(O)(CC(=O)NC)c1ccccc1 Amb25800022 [0,1,0,0,0,1|1,0,1]=4 4518 B14R1.60 CNCC(C)C(=O)Nc1ccccc1 Amb25742670 [0,1,0,0,0,1|0,0,2]=4 4519 B14R1.60 CNCC(C)N(C)Cc1ccccc1 Amb19061544 [0,1,0,0,0,1|2,0,0]=4 4520 B14R1.134 CC(C#C)C(O)Cc1ccc(F)cc1 Amb25847845 [0,1,0,0,0,1|1,0,1]=4 4521 B14R1.134 CC(OC)C(C)Nc1ccc(Cl)cc1 Amb25038094 [0,1,0,0,0,1|2,0,0]=4 4522 B14R1.134 CC(OC)C(C)Nc1ccc(I)cc1 Amb24740548 [0,1,0,0,0,1|2,0,0]=4 4523 B14R1.134 CCC(C)C(C)Nc1ccc(N)cc1 Amb19050879 [0,1,0,0,0,1|2,0,0]=4 4524 B14R1.134 CNC(=O)C(O)Cc1ccc(F)cc1 Amb25202672 [0,1,0,0,0,1|1,0,1]=4 4525 B14R1.134 CNC(=O)[C@H](O)Cc1ccc(F)cc1 Amb25805971 [0,1,0,0,0,1|1,0,1]=4 4526 B14R1.134 CNC(C)C(=O)Nc1ccc(Cl)cc1 Amb18993253 [0,1,0,0,0,1|0,0,2]=4 4527 B14R1.134 CNC(C)C(=O)Nc1ccc(F)cc1 Amb18993251 [0,1,0,0,0,1|0,0,2]=4 4528 B14R1.134 CNC(C)C(=O)Nc1ccc(O)cc1 Amb18993852 [0,1,0,0,0,1|0,0,2]=4 4529 B14R1.134 CN[C@@H](C)C(=O)Nc1ccc(Br)cc1 Amb25038565 [0,1,0,0,0,1|0,0,2]=4 4530 B14R1.134 CN[C@@H](C)C(=O)Nc1ccc(F)cc1 Amb24381139 [0,1,0,0,0,1|0,0,2]=4 4531 B14R1.134 C\C(=C/c1ccc(Br)cc1)\C(C)NC Amb24385877 [0,1,0,0,0,1|1,0,1]=4 4532 B14R1.134 C\C(=C/c1ccc(Cl)cc1)\C(C)NC Amb25062358 [0,1,0,0,0,1|1,0,1]=4 4533 B14R1.134 C\C(=C/c1ccc(F)cc1)\C(C)NC Amb24460092 [0,1,0,0,0,1|1,0,1]=4 4534 B14R1.134 Cc1ccc(CC(O)C(=O)NC)cc1 Amb25094388 [0,1,0,0,0,1|1,0,1]=4 4535 B14R1.134 Cc1ccc(CC(O)C(C)C#C)cc1 Amb24592575 [0,1,0,0,0,1|1,0,1]=4 4536 B14R1.134 Cc1ccc(C[C@@H](O)C(=O)NC)cc1 Amb25690415 [0,1,0,0,0,1|1,0,1]=4 4537 B14R1.134 Cc1ccc(cc1)NC(=O)C(C)NC Amb18993239 [0,1,0,0,0,1|0,0,2]=4 4538 B14R1.134 Cc1ccc(cc1)NC(C)C(C)OC Amb25166395 [0,1,0,0,0,1|2,0,0]=4 4539 B14R1.135 CC(OC)C(C)Nc1cccc(Br)c1 Amb25166285 [0,1,0,0,0,1|2,0,0]=4 4540 B14R1.135 CC(OC)C(C)Nc1cccc(Cl)c1 Amb25221315 [0,1,0,0,0,1|2,0,0]=4 4541 B14R1.135 CC(OC)C(C)Nc1cccc(F)c1 Amb25166457 [0,1,0,0,0,1|2,0,0]=4 4542 B14R1.135 CC(OC)C(C)Nc1cccc(I)c1 Amb25166507 [0,1,0,0,0,1|2,0,0]=4 4543 B14R1.135 CC(OC)C(C)Nc1cccc(O)c1 Amb25852218 [0,1,0,0,0,1|2,0,0]=4 4544 B14R1.135 CCC(C)C(C)Nc1cccc(N)c1 Amb19050867 [0,1,0,0,0,1|2,0,0]=4 4545 B14R1.135 CNC(C)C(=O)Nc1cccc(Br)c1 Amb25856560 [0,1,0,0,0,1|0,0,2]=4 4546 B14R1.135 CNC(C)C(=O)Nc1cccc(Cl)c1 Amb18993235 [0,1,0,0,0,1|0,0,2]=4 4547 B14R1.135 CNC(C)C(=O)Nc1cccc(F)c1 Amb18993265 [0,1,0,0,0,1|0,0,2]=4 4548 B14R1.135 CNC(C)C(=O)Nc1cccc(O)c1 Amb18993893 [0,1,0,0,0,1|0,0,2]=4 4549 B14R1.135 CN[C@@H](C)C(=O)Nc1cccc(Cl)c1 Amb24740666 [0,1,0,0,0,1|0,0,2]=4 4550 B14R1.135 CN[C@@H](C)C(=O)Nc1cccc(I)c1 Amb25170594 [0,1,0,0,0,1|0,0,2]=4 4551 B14R1.135 CN[C@@H](C)C(=O)Nc1cccc(O)c1 Amb25110349 [0,1,0,0,0,1|0,0,2]=4 4552 B14R1.135 C\C(=C/c1cccc(O)c1)\C(C)NC Amb25764948 [0,1,0,0,0,1|1,0,1]=4 4553 B14R1.135 Cc1cc(ccc1)NC(=O)C(C)NC Amb18993247 [0,1,0,0,0,1|0,0,2]=4 4554 B14R1.135 Cc1cc(ccc1)NC(=O)[C@H](C)NC Amb24530833 [0,1,0,0,0,1|0,0,2]=4 4555 B14R1.135 Cc1cccc(c1)NC(C)C(C)OC Amb25083602 [0,1,0,0,0,1|2,0,0]=4 4556 B14R1.296 CC(C)(C#C)C(O)Cc1ccccc1 Amb25343841 [0,1,0,0,0,1|1,0,1]=4 4557 B14R1.296 CNC(C)(C)C(=O)Nc1ccccc1 Amb18998467 [0,1,0,0,0,1|0,0,2]=4 4558 B14R1.296 CNC(C)(C)C(C)Nc1cccc[n]1 Amb18651631 [0,1,0,0,0,1|2,0,0]=4 4559 B14R1.1007 CC(OC)C(C)Nc1ccccc1Br Amb25166378 [0,1,0,0,0,1|2,0,0]=4 4560 B14R1.1007 CC(OC)C(C)Nc1ccccc1Cl Amb25166421 [0,1,0,0,0,1|2,0,0]=4 4561 B14R1.1007 CC(OC)C(C)Nc1ccccc1F Amb25166286 [0,1,0,0,0,1|2,0,0]=4 4562 B14R1.1007 CC(OC)C(C)Nc1ccccc1I Amb24352938 [0,1,0,0,0,1|2,0,0]=4 4563 B14R1.1007 CCC(C)C(C)Nc1ccccc1N Amb19050876 [0,1,0,0,0,1|2,0,0]=4 4564 B14R1.1007 CNC(C)C(=O)Nc1ccccc1Br Amb25316527 [0,1,0,0,0,1|0,0,2]=4 4565 B14R1.1007 CNC(C)C(=O)Nc1ccccc1Cl Amb18993261 [0,1,0,0,0,1|0,0,2]=4 4566 B14R1.1007 CNC(C)C(=O)Nc1ccccc1F Amb18993241 [0,1,0,0,0,1|0,0,2]=4 4567 B14R1.1007 CN[C@@H](C)C(=O)Nc1ccccc1Cl Amb24366435 [0,1,0,0,0,1|0,0,2]=4 4568 B14R1.1007 CN[C@@H](C)C(=O)Nc1ccccc1O Amb25102370 [0,1,0,0,0,1|0,0,2]=4 4569 B14R1.1007 C\C(=C/c1ccccc1Br)\C(C)NC Amb24746236 [0,1,0,0,0,1|1,0,1]=4 4570 B14R1.1007 C\C(=C/c1ccccc1Cl)\C(C)NC Amb25233914 [0,1,0,0,0,1|1,0,1]=4 4571 B14R1.1007 Cc1ccccc1NC(=O)C(C)NC Amb18993256 [0,1,0,0,0,1|0,0,2]=4 4572 B14R1.1007 Cc1ccccc1NC(=O)[C@H](C)NC Amb24693732 [0,1,0,0,0,1|0,0,2]=4 4573 B14R1.1007 Cc1ccccc1NC(C)C(C)OC Amb25705910 [0,1,0,0,0,1|2,0,0]=4 4574 B14R1.1031 CC(CC)C(C#N)Nc1ccccc1 Amb19047201 [0,1,0,0,0,1|2,0,0]=4 4575 B14R1.1031 CC(OC)C(C#N)Nc1ccccc1 Amb25347229 [0,1,0,0,0,1|2,0,0]=4 4576 B14R1.7 CC(C=C)C(O)c1ccc(cc1)C#N Amb18649624 [0,2,0,0,0,0|1,0,1]=4 4577 B14R1.7 CC(CC)C(N)c1ccc(cc1)C#N Amb24585952 [0,2,0,0,0,0|2,0,0]=4 4578 B14R1.7 CC(CC)C(O)c1ccc(cc1)C#N Amb24461453 [0,2,0,0,0,0|1,0,0]=3 4579 B14R1.7 CC(CC)[C@H](N)c1ccc(cc1)C#N Amb25200069 [0,2,0,0,0,0|2,0,0]=4 4580 B14R1.7 CC(CO)C(O)c1ccc(cc1)OC Amb22479239 [0,2,0,0,0,0|2,0,0]=4 4581 B14R1.7 CC[C@@H](N)[C@@H](O)c1ccc(cc1)OC Amb24310223 [0,2,0,0,0,0|2,0,0]=4 4582 B14R1.7 CCc1ccc(cc1)C(=O)C(C)NC Amb22055213 [0,2,0,0,0,0|0,0,2]=4 4583 B14R1.7 CNC(=O)C(c1ccc(cc1)OC)O Amb17402007 [0,2,0,0,0,0|1,0,1]=4 4584 B14R1.7 CNC(=O)[C@@H](O)c1ccc(cc1)OC Amb24336450 [0,2,0,0,0,0|1,0,1]=4 4585 B14R1.7 CNC(C(=O)c1ccc(cc1)OC)C Amb16185412 [0,2,0,0,0,0|0,0,2]=4 4586 B14R1.7 CNC(C(=O)c1ccc(cc1)OC)C Amb17601314 [0,2,0,0,0,0|0,0,2]=4 4587 B14R1.7 CNC(C)C(=O)c1ccc(cc1)SC Amb18896148 [0,2,0,0,0,0|0,0,2]=4 4588 B14R1.7 C[C@@H](C=O)[C@@H](O)c1ccc(cc1)C#N Amb24736262 [0,2,0,0,0,0|2,0,0]=4 4589 B14R1.7 C[C@@H](C=O)[C@H](O)c1ccc(cc1)C#N Amb25166170 [0,2,0,0,0,0|2,0,0]=4 4590 B14R1.7 C[C@@H](CO)C(O)c1ccc(cc1)OC Amb22477718 [0,2,0,0,0,0|2,0,0]=4 4591 B14R1.7 C[C@@H](CO)[C@@H](O)c1ccc(cc1)C#N Amb25813903 [0,2,0,0,0,0|2,0,0]=4 4592 B14R1.7 C[C@@H](CO)[C@H](O)c1ccc(cc1)C#N Amb25333668 [0,2,0,0,0,0|2,0,0]=4 4593 B14R1.7 C[C@H](C=O)[C@H](O)c1ccc(cc1)C#N Amb24342573 [0,2,0,0,0,0|2,0,0]=4 4594 B14R1.35 CC(C#CC)C(O)c1ccc(F)cc1 Amb25680501 [0,2,0,0,0,0|1,0,0]=3 4595 B14R1.35 CC(CCN)C(O)c1ccc(F)cc1 Amb18812299 [0,2,0,0,0,0|1,0,0]=3 4596 B14R1.35 CCNC(=O)C(c1ccc(cc1)C)O Amb17401751 [0,2,0,0,0,0|1,0,1]=4 4597 B14R1.35 CCNC(=O)C(c1ccc(cc1)Cl)O Amb17404286 [0,2,0,0,0,0|1,0,1]=4 4598 B14R1.35 CCNC(=O)C(c1ccc(cc1)F)O Amb17402178 [0,2,0,0,0,0|1,0,1]=4 4599 B14R1.35 CCNC(C(=O)c1ccc(cc1)Br)C Amb17312901 [0,2,0,0,0,0|0,0,2]=4 4600 B14R1.35 CCNC(C(=O)c1ccc(cc1)Cl)C Amb17312922 [0,2,0,0,0,0|0,0,2]=4 4601 B14R1.35 CCNC(C(=O)c1ccc(cc1)F)C Amb17312980 [0,2,0,0,0,0|0,0,2]=4 4602 B14R1.35 CCNC(C)C(=O)c1ccc(N)cc1 Amb18051396 [0,2,0,0,0,0|0,0,2]=4 4603 B14R1.35 C\C=C\C(O)C(O)c1ccc(O)cc1 Amb25775796 [0,2,0,0,0,0|2,0,0]=4 4604 B14R1.35 Cc1ccc(cc1)C(=O)C(C)NCC Amb18368596 [0,2,0,0,0,0|0,0,2]=4 4605 B14R1.35 Cc1ccc(cc1)C(O)C(=O)NOC Amb24474160 [0,2,0,0,0,0|1,0,1]=4 4606 B14R1.35 OC(c1ccc(cc1)Br)C(CC#N)C Amb17354631 [0,2,0,0,0,0|1,0,1]=4 4607 B14R1.35 OC(c1ccc(cc1)C)C(CC#N)C Amb17336110 [0,2,0,0,0,0|1,0,1]=4 4608 B14R1.35 OC(c1ccc(cc1)Cl)C(CC#N)C Amb17339414 [0,2,0,0,0,0|1,0,1]=4 4609 B14R1.35 OC(c1ccc(cc1)F)C(CC#N)C Amb17336578 [0,2,0,0,0,0|1,0,1]=4 4610 B14R1.35 OC(c1ccc(cc1)O)C(CC#N)C Amb17336302 [0,2,0,0,0,0|1,0,1]=4 4611 B14R1.88 CCC(C#N)C(O)c1ccc(F)cc1 Amb24394753 [0,2,0,0,0,0|1,0,1]=4 4612 B14R1.88 CCC(NC)C(=O)c1ccc(Br)cc1 Amb18585777 [0,2,0,0,0,0|0,0,2]=4 4613 B14R1.88 CCC(NC)C(=O)c1ccc(Cl)cc1 Amb18569398 [0,2,0,0,0,0|0,0,2]=4 4614 B14R1.88 CCC(NC)C(=O)c1ccc(F)cc1 Amb18565685 [0,2,0,0,0,0|0,0,2]=4 4615 B14R1.88 CCC(NC)C(=O)c1ccc(N)cc1 Amb18051476 [0,2,0,0,0,0|0,0,2]=4 4616 B14R1.88 CCC(NC)C(O)c1ccc(Br)cc1 Amb18604998 [0,2,0,0,0,0|0,0,0]=2 4617 B14R1.88 CCC(NC)C(O)c1ccc(Cl)cc1 Amb18605051 [0,2,0,0,0,0|0,0,0]=2 4618 B14R1.88 CCC(NC)C(O)c1ccc(F)cc1 Amb18605161 [0,2,0,0,0,0|0,0,0]=2 4619 B14R1.88 CNC(C#N)C(F)c1ccc(Cl)cc1 Amb25824686 [0,2,0,0,0,0|1,0,1]=4 4620 B14R1.88 Cc1ccc(cc1)C(=O)C(CC)NC Amb18564930 [0,2,0,0,0,0|0,0,2]=4 4621 B14R1.88 Cc1ccc(cc1)C(=O)C(CC)NC Amb22055751 [0,2,0,0,0,0|0,0,2]=4 4622 B14R1.88 Cc1ccc(cc1)C(C)C(OC)OC Amb24066881 [0,2,0,0,0,0|2,0,0]=4 4623 B14R1.88 Cc1ccc(cc1)[C@H](O)[C@@H](CC)C#N Amb24397997 [0,2,0,0,0,0|1,0,1]=4 4624 B14R1.132 CC(=O)[C@@H](Cl)[C@@H](O)c1ccc(F)cc1 Amb24539280 [0,2,0,0,0,0|2,0,0]=4 4625 B14R1.132 CC(=O)[C@@H](O)[C@@H](O)c1ccc(F)cc1 Amb25803025 [0,2,0,0,0,0|2,0,0]=4 4626 B14R1.132 CC(=O)[C@H](Cl)[C@H](O)c1ccc(F)cc1 Amb25309554 [0,2,0,0,0,0|2,0,0]=4 4627 B14R1.132 CC(=O)[C@H](O)[C@@H](O)c1ccc(F)cc1 Amb25069715 [0,2,0,0,0,0|2,0,0]=4 4628 B14R1.132 CC(=O)[C@H](O)[C@H](O)c1ccc(F)cc1 Amb25343905 [0,2,0,0,0,0|2,0,0]=4 4629 B14R1.132 CC(C(C(c1ccc(cc1)C)O)N)C Amb17139403 [0,2,0,0,0,0|2,0,0]=4 4630 B14R1.132 CC(C(O)c1ccc(Cl)cc1)C(N)=O Amb25229544 [0,2,0,0,0,0|2,0,0]=4 4631 B14R1.132 CC(C(O)c1ccc(Cl)cc1)C(O)=O Amb18990622 [0,2,0,0,0,0|2,0,0]=4 4632 B14R1.132 CC(C(O)c1ccc(F)cc1)C(O)=O Amb18990625 [0,2,0,0,0,0|2,0,0]=4 4633 B14R1.132 CC(C)C(C)C(Br)c1ccc(Cl)cc1 Amb25814546 [0,2,0,0,0,0|2,0,0]=4 4634 B14R1.132 CC(C)C(C)C(Br)c1ccc(F)cc1 Amb25183048 [0,2,0,0,0,0|2,0,0]=4 4635 B14R1.132 CC(C)C(C)C(Cl)c1ccc(Br)cc1 Amb24366180 [0,2,0,0,0,0|2,0,0]=4 4636 B14R1.132 CC(C)C(C)C(Cl)c1ccc(Cl)cc1 Amb25814490 [0,2,0,0,0,0|2,0,0]=4 4637 B14R1.132 CC(C)C(C)C(N)c1ccc(Br)cc1 Amb24435770 [0,2,0,0,0,0|2,0,0]=4 4638 B14R1.132 CC(C)C(C)C(O)c1ccc(Br)c[n]1 Amb25044929 [0,2,0,0,0,0|2,0,0]=4 4639 B14R1.132 CC(C)C(C)C(O)c1ccc(Cl)cc1 Amb25124636 [0,2,0,0,0,0|1,0,0]=3 4640 B14R1.132 CC(C)C(C)C(O)c1ccc(N)cc1 Amb24501602 [0,2,0,0,0,0|1,0,0]=3 4641 B14R1.132 CC(C)[C@@H](N)[C@@H](O)c1ccc(Cl)cc1 Amb25258572 [0,2,0,0,0,0|2,0,0]=4 4642 B14R1.132 CC(C)[C@@H](N)[C@@H](O)c1ccc(O)cc1 Amb25258969 [0,2,0,0,0,0|2,0,0]=4 4643 B14R1.132 CC(C)[C@@H](N)[C@H](O)c1ccc(O)cc1 Amb24558459 [0,2,0,0,0,0|2,0,0]=4 4644 B14R1.132 CC(C)[C@H](N)[C@@H](O)c1ccc(Br)cc1 Amb25200192 [0,2,0,0,0,0|2,0,0]=4 4645 B14R1.132 CC(C)[C@H](N)[C@H](O)c1ccc(Br)cc1 Amb25222756 [0,2,0,0,0,0|2,0,0]=4 4646 B14R1.132 CC(C)[C@H](N)[C@H](O)c1ccc(Cl)cc1 Amb25292334 [0,2,0,0,0,0|2,0,0]=4 4647 B14R1.132 CN(C(C(c1ccc(cc1)C)N)C)C Amb1124115 [0,2,0,0,0,0|1,0,0]=3 4648 B14R1.132 CN(C)C(=O)C(O)c1ccc(Br)cc1 Amb24535654 [0,2,0,0,0,0|1,0,1]=4 4649 B14R1.132 CN(C)C(=O)C(O)c1ccc(O)cc1 Amb25668290 [0,2,0,0,0,0|1,0,1]=4 4650 B14R1.132 CN(C)C(C)C(=O)c1ccc(N)cc1 Amb18549934 [0,2,0,0,0,0|0,0,2]=4 4651 B14R1.132 C[C@@H]([C@H](O)c1ccc(C)cc1)C(C)=O Amb25357373 [0,2,0,0,0,0|1,0,0]=3 4652 B14R1.132 C[C@@H]([C@H](O)c1ccc(Cl)cc1)C(N)=O Amb24447117 [0,2,0,0,0,0|2,0,0]=4 4653 B14R1.132 C[C@@H]([C@H](O)c1ccc(F)cc1)C(O)=O Amb25134261 [0,2,0,0,0,0|2,0,0]=4 4654 B14R1.132 Cc1ccc([n]c1)C(O)C(C)C(C)C Amb25773149 [0,2,0,0,0,0|2,0,0]=4 4655 B14R1.132 Cc1ccc(cc1)C(C(=O)N(C)C)O Amb17401752 [0,2,0,0,0,0|1,0,1]=4 4656 B14R1.132 Cc1ccc(cc1)C(N)C(C)C(C)C Amb18190726 [0,2,0,0,0,0|2,0,0]=4 4657 B14R1.132 Cc1ccc(cc1)C(O)C(C)N(C)C Amb19079595 [0,2,0,0,0,0|0,0,0]=2 4658 B14R1.132 Cc1ccc(cc1)C(O)C(O)C(C)=C Amb24704322 [0,2,0,0,0,0|2,0,0]=4 4659 B14R1.132 Cc1ccc(cc1)C(O)C(O)C(C)=O Amb24575586 [0,2,0,0,0,0|2,0,0]=4 4660 B14R1.132 Cc1ccc(cc1)C(O)C(O)C(C)C Amb25343131 [0,2,0,0,0,0|2,0,0]=4 4661 B14R1.132 Cc1ccc(cc1)[C@@H](O)[C@@H](C)C(O)=O Amb25807681 [0,2,0,0,0,0|2,0,0]=4 4662 B14R1.132 Cc1ccc(cc1)[C@H](O)[C@@H](O)C(C)=O Amb24353141 [0,2,0,0,0,0|2,0,0]=4 4663 B14R1.132 Cc1ccc(cc1)[C@H](O)[C@H](N)C(C)C Amb25255531 [0,2,0,0,0,0|2,0,0]=4 4664 B14R1.132 NC(C(N(C)C)C)c1ccc(cc1)F Amb1139027 [0,2,0,0,0,0|1,0,0]=3 4665 B14R1.132 OC(C(=O)N(C)C)c1ccc(cc1)Cl Amb17404287 [0,2,0,0,0,0|1,0,1]=4 4666 B14R1.132 OC(C(=O)N(C)C)c1ccc(cc1)F Amb17402179 [0,2,0,0,0,0|1,0,1]=4 4667 B14R1.132 OC(c1ccc(cc1)Br)C(C(C)C)N Amb17162860 [0,2,0,0,0,0|2,0,0]=4 4668 B14R1.132 OC(c1ccc(cc1)Cl)C(C(C)C)N Amb17140814 [0,2,0,0,0,0|2,0,0]=4 4669 B14R1.132 OC(c1ccc(cc1)F)C(C(C)C)N Amb17139660 [0,2,0,0,0,0|2,0,0]=4 4670 B14R1.305 CC(C)(C#N)C(O)c1ccc(Cl)cc1 Amb25750021 [0,2,0,0,0,0|2,0,0]=4 4671 B14R1.305 CC(C)(C#N)C(O)c1ccc(O)cc1 Amb25285578 [0,2,0,0,0,0|2,0,0]=4 4672 B14R1.305 CC(C)(CC)C(Br)c1ccc(F)cc1 Amb24380282 [0,2,0,0,0,0|2,0,0]=4 4673 B14R1.305 CC(C)(CC)C(N)c1ccc(Br)cc1 Amb24693638 [0,2,0,0,0,0|2,0,0]=4 4674 B14R1.305 CC(C)(CC)C(N)c1ccc(Cl)cc1 Amb25287829 [0,2,0,0,0,0|2,0,0]=4 4675 B14R1.305 CC(C)(CC)C(N)c1ccc(F)cc1 Amb19063903 [0,2,0,0,0,0|2,0,0]=4 4676 B14R1.305 CC(C)(CC)C(O)c1ccc(Br)cc1 Amb24370336 [0,2,0,0,0,0|1,0,0]=3 4677 B14R1.305 CC(C)(CC)C(O)c1ccc(F)cc1 Amb19064886 [0,2,0,0,0,0|1,0,0]=3 4678 B14R1.305 CC(C)(CN)C(O)c1ccc(Cl)cc1 Amb18914854 [0,2,0,0,0,0|2,0,0]=4 4679 B14R1.305 CC(C)(CN)C(O)c1ccc(F)cc1 Amb18911119 [0,2,0,0,0,0|2,0,0]=4 4680 B14R1.305 CC(C)(CO)[C@H](O)c1ccc(F)cc1 Amb24384266 [0,2,0,0,0,0|2,0,0]=4 4681 B14R1.305 CC(C)(NC)C(=O)c1ccc(F)cc1 Amb25283059 [0,2,0,0,0,0|0,0,2]=4 4682 B14R1.305 CC(C)(NC)C(O)c1ccc(F)cc1 Amb25098932 [0,2,0,0,0,0|0,0,0]=2 4683 B14R1.305 CC(C)(OC)C(N)c1ccc(Cl)cc1 Amb24498725 [0,2,0,0,0,0|2,0,0]=4 4684 B14R1.305 CC(C)(OC)C(N)c1ccc(F)cc1 Amb25341971 [0,2,0,0,0,0|2,0,0]=4 4685 B14R1.305 CC(C)(OC)C(O)c1ccc(F)cc1 Amb25334213 [0,2,0,0,0,0|1,0,0]=3 4686 B14R1.305 CC(C)(SC)C(N)c1ccc(F)cc1 Amb25172562 [0,2,0,0,0,0|2,0,0]=4 4687 B14R1.305 CC(C)(SC)C(O)c1ccc(F)cc1 Amb25172508 [0,2,0,0,0,0|1,0,0]=3 4688 B14R1.305 CC(O)(CC)C(O)c1ccc(Cl)cc1 Amb24424411 [0,2,0,0,0,0|1,0,0]=3 4689 B14R1.305 CC(O)(CC)C(O)c1ccc(F)cc1 Amb24345807 [0,2,0,0,0,0|1,0,0]=3 4690 B14R1.305 CCC(C)(C)C(Br)c1ccc(Br)cc1 Amb25164316 [0,2,0,0,0,0|2,0,0]=4 4691 B14R1.305 CCC(C)(C)C(Cl)c1ccc(Cl)cc1 Amb24660546 [0,2,0,0,0,0|2,0,0]=4 4692 B14R1.305 CNC(C)(C)C(O)c1ccc(O)cc1 Amb25729997 [0,2,0,0,0,0|0,0,0]=2 4693 B14R1.305 Cc1ccc(cc1)C(=O)C(C)(C)NC Amb24401190 [0,2,0,0,0,0|0,0,2]=4 4694 B14R1.305 Cc1ccc(cc1)C(Br)C(C)(C)CC Amb24751389 [0,2,0,0,0,0|2,0,0]=4 4695 B14R1.305 Cc1ccc(cc1)C(F)C(C)(C)NC Amb25306962 [0,2,0,0,0,0|1,0,0]=3 4696 B14R1.305 Cc1ccc(cc1)C(N)C(C)(C)CC Amb19073682 [0,2,0,0,0,0|2,0,0]=4 4697 B14R1.305 Cc1ccc(cc1)C(N)C(C)(C)SC Amb24353729 [0,2,0,0,0,0|2,0,0]=4 4698 B14R1.305 Cc1ccc(cc1)C(O)C(C)(C)CC Amb19061511 [0,2,0,0,0,0|1,0,0]=3 4699 B14R1.305 Cc1ccc(cc1)C(O)C(C)(C)CN Amb18910511 [0,2,0,0,0,0|2,0,0]=4 4700 B14R1.305 Cc1ccc(cc1)C(O)C(C)(C)CO Amb25084505 [0,2,0,0,0,0|2,0,0]=4 4701 B14R1.305 Cc1ccc(cc1)C(O)C(C)(C)OC Amb25805526 [0,2,0,0,0,0|1,0,0]=3 4702 B14R1.305 Cc1ccc(cc1)C(O)C(C)(C)SC Amb24665522 [0,2,0,0,0,0|1,0,0]=3 4703 B14R1.305 Cc1ccc(cc1)C(O)C(C)(O)C=C Amb25697529 [0,2,0,0,0,0|1,0,1]=4 4704 B14R1.305 Cc1ccc(cc1)C(O)C(C)(O)CC Amb25251417 [0,2,0,0,0,0|1,0,0]=3 4705 B14R1.305 Cc1ccc(cc1)[C@H](O)C(C)(C)CO Amb25085139 [0,2,0,0,0,0|2,0,0]=4 4706 B14R1.710 CC(CC)C(C#N)c1ccc(Br)cc1 Amb25826405 [0,2,0,0,0,0|2,0,0]=4 4707 B14R1.710 CC(CC)C(C#N)c1ccc(F)cc1 Amb25105311 [0,2,0,0,0,0|2,0,0]=4 4708 B14R1.1003 CC(C#N)C(O)c1cc(C)c(C)cc1 Amb24456258 [0,2,0,0,0,0|2,0,0]=4 4709 B14R1.1003 CC(C#N)C(O)c1ccc(Br)c(Cl)c1 Amb24638730 [0,2,0,0,0,0|2,0,0]=4 4710 B14R1.1003 CC(C#N)C(O)c1ccc(Cl)c(Cl)c1 Amb24423111 [0,2,0,0,0,0|2,0,0]=4 4711 B14R1.1003 CC(C#N)C(O)c1ccc(Cl)c(F)c1 Amb24644833 [0,2,0,0,0,0|2,0,0]=4 4712 B14R1.1003 CC(CC)C(Br)c1cc(Br)c(F)cc1 Amb25193450 [0,2,0,0,0,0|2,0,0]=4 4713 B14R1.1003 CC(CC)C(Br)c1cc(F)c(F)cc1 Amb25847209 [0,2,0,0,0,0|2,0,0]=4 4714 B14R1.1003 CC(CC)C(Cl)c1cc(Cl)c(Cl)cc1 Amb25164278 [0,2,0,0,0,0|2,0,0]=4 4715 B14R1.1003 CC(CC)C(Cl)c1cc(F)c(F)cc1 Amb24505835 [0,2,0,0,0,0|2,0,0]=4 4716 B14R1.1003 CC(CC)C(Cl)c1ccc(F)c(Br)c1 Amb25723995 [0,2,0,0,0,0|2,0,0]=4 4717 B14R1.1003 CC(CC)C(N)c1ccc(Br)c(F)c1 Amb25166887 [0,2,0,0,0,0|2,0,0]=4 4718 B14R1.1003 CC(CC)C(N)c1ccc(Cl)c(Br)c1 Amb25767217 [0,2,0,0,0,0|2,0,0]=4 4719 B14R1.1003 CC(CC)C(N)c1ccc(F)c(Cl)c1 Amb25070425 [0,2,0,0,0,0|2,0,0]=4 4720 B14R1.1003 CC(CC)C(N)c1ccc(I)c(Cl)c1 Amb24654582 [0,2,0,0,0,0|2,0,0]=4 4721 B14R1.1003 CC(CC)C(N)c1ccc(O)c(Cl)c1 Amb24568028 [0,2,0,0,0,0|2,0,0]=4 4722 B14R1.1003 CC(CC)C(N)c1ccc(O)c(F)c1 Amb24592793 [0,2,0,0,0,0|2,0,0]=4 4723 B14R1.1003 CC(CC)C(O)c1cc(Br)c(Br)cc1 Amb25046961 [0,2,0,0,0,0|1,0,0]=3 4724 B14R1.1003 CC(CC)C(O)c1cc(C)c(C)[n]c1 Amb25294855 [0,2,0,0,0,0|2,0,0]=4 4725 B14R1.1003 CC(CC)C(O)c1cc(C)c(C)cc1 Amb19050760 [0,2,0,0,0,0|1,0,0]=3 4726 B14R1.1003 CC(CC)C(O)c1cc(F)c(F)cc1 Amb19047927 [0,2,0,0,0,0|1,0,0]=3 4727 B14R1.1003 CC(CC)C(O)c1ccc(Br)c(Cl)c1 Amb24718795 [0,2,0,0,0,0|1,0,0]=3 4728 B14R1.1003 CC(CC)C(O)c1ccc(C)c(C)[n]1 Amb25161952 [0,2,0,0,0,0|2,0,0]=4 4729 B14R1.1003 CC(CC)C(O)c1ccc(Cl)c(Br)c1 Amb25712384 [0,2,0,0,0,0|1,0,0]=3 4730 B14R1.1003 CC(CC)[C@@H](N)c1cc(Br)c(Br)cc1 Amb25200338 [0,2,0,0,0,0|2,0,0]=4 4731 B14R1.1003 CC(CC)[C@@H](N)c1cc(Cl)c(Cl)cc1 Amb25199975 [0,2,0,0,0,0|2,0,0]=4 4732 B14R1.1003 CC(CC)[C@@H](N)c1cc(F)c(F)cc1 Amb24561714 [0,2,0,0,0,0|2,0,0]=4 4733 B14R1.1003 CC(CC)[C@@H](N)c1ccc(F)c(Cl)c1 Amb24744860 [0,2,0,0,0,0|2,0,0]=4 4734 B14R1.1003 CC(CC)[C@@H](N)c1ccc(O)c(Cl)c1 Amb24699638 [0,2,0,0,0,0|2,0,0]=4 4735 B14R1.1003 CC(CC)[C@H](N)c1cc(Cl)c(Cl)cc1 Amb25241670 [0,2,0,0,0,0|2,0,0]=4 4736 B14R1.1003 CC(CC)[C@H](N)c1ccc(Br)c(F)c1 Amb24565921 [0,2,0,0,0,0|2,0,0]=4 4737 B14R1.1003 CC(CC)[C@H](N)c1ccc(Cl)c(F)c1 Amb25288583 [0,2,0,0,0,0|2,0,0]=4 4738 B14R1.1003 CC(CN)C(O)c1ccc(Br)c(Br)c1 Amb24589040 [0,2,0,0,0,0|2,0,0]=4 4739 B14R1.1003 CC(CN)C(O)c1ccc(Br)c(Cl)c1 Amb25242341 [0,2,0,0,0,0|2,0,0]=4 4740 B14R1.1003 CC(CN)C(O)c1ccc(Cl)c(Br)c1 Amb24617420 [0,2,0,0,0,0|2,0,0]=4 4741 B14R1.1003 CC(CN)C(O)c1ccc(F)c(Cl)c1 Amb25691820 [0,2,0,0,0,0|2,0,0]=4 4742 B14R1.1003 CC(CN)C(O)c1ccc(F)c(F)c1 Amb25802304 [0,2,0,0,0,0|2,0,0]=4 4743 B14R1.1003 CC(NC)C(C)c1ccc(F)c(Cl)c1 Amb25107207 [0,2,0,0,0,0|1,0,0]=3 4744 B14R1.1003 CC(NC)C(O)c1cc(C)c(C)cc1 Amb18565358 [0,2,0,0,0,0|0,0,0]=2 4745 B14R1.1003 CC(OC)C(N)c1cc(Cl)c(Cl)cc1 Amb25069428 [0,2,0,0,0,0|2,0,0]=4 4746 B14R1.1003 CC(OC)C(N)c1cc(F)c(F)cc1 Amb24392406 [0,2,0,0,0,0|2,0,0]=4 4747 B14R1.1003 CC(OC)C(O)c1cc(C)c(C)cc1 Amb24394831 [0,2,0,0,0,0|1,0,0]=3 4748 B14R1.1003 CC(OC)C(O)c1cc(Cl)c(Cl)cc1 Amb24459637 [0,2,0,0,0,0|1,0,0]=3 4749 B14R1.1003 CCC(C(c1ccc(c(c1)C)F)O)N Amb17139659 [0,2,0,0,0,0|2,0,0]=4 4750 B14R1.1003 CCC(C(c1ccc(c(c1)O)O)O)N Amb10843773 [0,2,0,0,0,0|2,0,0]=4 4751 B14R1.1003 CCC(N)C(O)c1cc(Cl)c(O)cc1 Amb18980955 [0,2,0,0,0,0|2,0,0]=4 4752 B14R1.1003 CCC(N)C(O)c1ccc(Cl)c(F)c1 Amb18980644 [0,2,0,0,0,0|2,0,0]=4 4753 B14R1.1003 CCC(N)C(O)c1ccc(Cl)c(O)c1 Amb25326826 [0,2,0,0,0,0|2,0,0]=4 4754 B14R1.1003 CCC(N)C(O)c1ccc(F)c(O)c1 Amb24550256 [0,2,0,0,0,0|2,0,0]=4 4755 B14R1.1003 CCC(O)C(O)c1cc(C)c(C)cc1 Amb25302496 [0,2,0,0,0,0|2,0,0]=4 4756 B14R1.1003 CCC(O)C(O)c1cc(F)c(F)cc1 Amb25169875 [0,2,0,0,0,0|2,0,0]=4 4757 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(Cl)c(Cl)c1 Amb25288646 [0,2,0,0,0,0|2,0,0]=4 4758 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(Cl)c(O)c1 Amb24595954 [0,2,0,0,0,0|2,0,0]=4 4759 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(F)c(F)c1 Amb25241649 [0,2,0,0,0,0|2,0,0]=4 4760 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(F)c(O)c1 Amb24694428 [0,2,0,0,0,0|2,0,0]=4 4761 B14R1.1003 CC[C@@H](N)[C@@H](O)c1ccc(N)c(F)c1 Amb25276591 [0,2,0,0,0,0|2,0,0]=4 4762 B14R1.1003 CC[C@@H](N)[C@H](O)c1cc(F)c(O)cc1 Amb24629244 [0,2,0,0,0,0|2,0,0]=4 4763 B14R1.1003 CC[C@@H](N)[C@H](O)c1cc(N)c(F)cc1 Amb25255460 [0,2,0,0,0,0|2,0,0]=4 4764 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(Cl)c(O)c1 Amb25201749 [0,2,0,0,0,0|2,0,0]=4 4765 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(F)c(F)c1 Amb24563587 [0,2,0,0,0,0|2,0,0]=4 4766 B14R1.1003 CC[C@@H](N)[C@H](O)c1ccc(F)c(O)c1 Amb25200060 [0,2,0,0,0,0|2,0,0]=4 4767 B14R1.1003 CC[C@H](N)[C@@H](O)c1cc(F)c(O)cc1 Amb24604199 [0,2,0,0,0,0|2,0,0]=4 4768 B14R1.1003 CC[C@H](N)[C@@H](O)c1cc(N)c(F)cc1 Amb25288647 [0,2,0,0,0,0|2,0,0]=4 4769 B14R1.1003 CC[C@H](N)[C@@H](O)c1cc(N)c(N)cc1 Amb24670329 [0,2,0,0,0,0|2,0,0]=4 4770 B14R1.1003 CC[C@H](N)[C@@H](O)c1cc(N)c(O)cc1 Amb25238504 [0,2,0,0,0,0|2,0,0]=4 4771 B14R1.1003 CC[C@H](N)[C@@H](O)c1ccc(F)c(Cl)c1 Amb25349636 [0,2,0,0,0,0|2,0,0]=4 4772 B14R1.1003 CC[C@H](N)[C@H](O)c1cc(F)c(O)cc1 Amb25349608 [0,2,0,0,0,0|2,0,0]=4 4773 B14R1.1003 CC[C@H](N)[C@H](O)c1cc(N)c(F)cc1 Amb24542667 [0,2,0,0,0,0|2,0,0]=4 4774 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(Cl)c(F)c1 Amb25252253 [0,2,0,0,0,0|2,0,0]=4 4775 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(Cl)c(O)c1 Amb24542656 [0,2,0,0,0,0|2,0,0]=4 4776 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(F)c(O)c1 Amb24707969 [0,2,0,0,0,0|2,0,0]=4 4777 B14R1.1003 CC[C@H](N)[C@H](O)c1ccc(N)c(F)c1 Amb25350623 [0,2,0,0,0,0|2,0,0]=4 4778 B14R1.1003 CNC(=O)C(O)c1cc(F)c(F)cc1 Amb24687028 [0,2,0,0,0,0|1,0,1]=4 4779 B14R1.1003 CNC(=O)C(c1ccc(c(c1)C)C)O Amb17401754 [0,2,0,0,0,0|1,0,1]=4 4780 B14R1.1003 CNC(=O)C(c1ccc(c(c1)C)F)O Amb17402180 [0,2,0,0,0,0|1,0,1]=4 4781 B14R1.1003 CNC(C(=O)c1ccc(c(c1)C)C)C Amb17312723 [0,2,0,0,0,0|0,0,2]=4 4782 B14R1.1003 CNC(C(=O)c1ccc(c(c1)C)Cl)C Amb17313190 [0,2,0,0,0,0|0,0,2]=4 4783 B14R1.1003 CNC(C(=O)c1ccc(c(c1)Cl)Cl)C Amb17313303 [0,2,0,0,0,0|0,0,2]=4 4784 B14R1.1003 CNC(C)C(=O)c1cc(F)c(F)cc1 Amb18566084 [0,2,0,0,0,0|0,0,2]=4 4785 B14R1.1003 CNC(C)C(=O)c1ccc(F)c(Cl)c1 Amb18244255 [0,2,0,0,0,0|0,0,2]=4 4786 B14R1.1003 CNC(C)C(=O)c1ccc(O)c(O)c1 Amb18652092 [0,2,0,0,0,0|0,0,2]=4 4787 B14R1.1003 CNC(C)C(C)c1cc(Cl)c(Cl)cc1 Amb25750036 [0,2,0,0,0,0|1,0,0]=3 4788 B14R1.1003 C[C@@H](NC)[C@@H](O)c1cc(C)c(C)cc1 Amb25702454 [0,2,0,0,0,0|0,0,0]=2 4789 B14R1.1003 C[C@H](NC)[C@@H](O)c1cc(C)c(C)cc1 Amb25664200 [0,2,0,0,0,0|0,0,0]=2 4790 B14R1.1003 Cc1cc(ccc1Br)C(O)C(C)CC Amb24384627 [0,2,0,0,0,0|1,0,0]=3 4791 B14R1.1003 Cc1cc(ccc1Br)C(O)C(C)CN Amb24385495 [0,2,0,0,0,0|2,0,0]=4 4792 B14R1.1003 Cc1cc(ccc1C)C(=O)C(C)NC Amb18368594 [0,2,0,0,0,0|0,0,2]=4 4793 B14R1.1003 Cc1cc(ccc1C)[C@H](O)[C@H](N)CC Amb24542661 [0,2,0,0,0,0|2,0,0]=4 4794 B14R1.1003 Cc1cc(ccc1Cl)C(N)C(C)CC Amb25314008 [0,2,0,0,0,0|2,0,0]=4 4795 B14R1.1003 Cc1cc(ccc1Cl)C(O)C(C)CC Amb25167179 [0,2,0,0,0,0|1,0,0]=3 4796 B14R1.1003 Cc1cc(ccc1Cl)C(O)C(C)NC Amb18605441 [0,2,0,0,0,0|0,0,0]=2 4797 B14R1.1003 Cc1cc(ccc1Cl)C(O)C(N)CC Amb25233620 [0,2,0,0,0,0|2,0,0]=4 4798 B14R1.1003 Cc1cc(ccc1Cl)[C@H](O)[C@H](N)CC Amb24542818 [0,2,0,0,0,0|2,0,0]=4 4799 B14R1.1003 Cc1cc(ccc1F)C(=O)C(C)NC Amb18565688 [0,2,0,0,0,0|0,0,2]=4 4800 B14R1.1003 Cc1cc(ccc1F)C(N)C(C)OC Amb18812300 [0,2,0,0,0,0|2,0,0]=4 4801 B14R1.1003 Cc1cc(ccc1F)C(O)C(C)CN Amb18812292 [0,2,0,0,0,0|2,0,0]=4 4802 B14R1.1003 Cc1cc(ccc1F)[C@@H](N)C(C)CC Amb24542828 [0,2,0,0,0,0|2,0,0]=4 4803 B14R1.1003 Cc1cc(ccc1F)[C@@H](O)[C@@H](N)CC Amb24744657 [0,2,0,0,0,0|2,0,0]=4 4804 B14R1.1003 Cc1cc(ccc1F)[C@@H](O)[C@H](N)CC Amb25328790 [0,2,0,0,0,0|2,0,0]=4 4805 B14R1.1003 Cc1cc(ccc1N)[C@@H](O)[C@@H](N)CC Amb25252239 [0,2,0,0,0,0|2,0,0]=4 4806 B14R1.1003 Cc1cc(ccc1N)[C@H](O)[C@H](N)CC Amb25326753 [0,2,0,0,0,0|2,0,0]=4 4807 B14R1.1003 Cc1cc(ccc1O)[C@H](O)[C@H](N)CC Amb24595957 [0,2,0,0,0,0|2,0,0]=4 4808 B14R1.1003 Cc1ccc(cc1Cl)C(Cl)C(C)CC Amb25734580 [0,2,0,0,0,0|2,0,0]=4 4809 B14R1.1003 Cc1ccc(cc1Cl)C(N)C(C)OC Amb24435257 [0,2,0,0,0,0|2,0,0]=4 4810 B14R1.1003 Cc1ccc(cc1Cl)C(O)C(C)C#N Amb24500440 [0,2,0,0,0,0|2,0,0]=4 4811 B14R1.1003 Cc1ccc(cc1Cl)C(O)C(O)CC Amb25293600 [0,2,0,0,0,0|2,0,0]=4 4812 B14R1.1003 Cc1ccc(cc1Cl)[C@@H](N)C(C)CC Amb25326806 [0,2,0,0,0,0|2,0,0]=4 4813 B14R1.1003 Cc1ccc(cc1Cl)[C@@H](O)[C@@H](N)CC Amb25248044 [0,2,0,0,0,0|2,0,0]=4 4814 B14R1.1003 Cc1ccc(cc1Cl)[C@@H](O)[C@H](N)CC Amb25200325 [0,2,0,0,0,0|2,0,0]=4 4815 B14R1.1003 Cc1ccc(cc1F)C(O)C(C)CN Amb24348206 [0,2,0,0,0,0|2,0,0]=4 4816 B14R1.1003 Cc1ccc(cc1F)C(O)C(N)CC Amb25112511 [0,2,0,0,0,0|2,0,0]=4 4817 B14R1.1003 Cc1ccc(cc1F)[C@H](N)C(C)CC Amb25367809 [0,2,0,0,0,0|2,0,0]=4 4818 B14R1.1003 Cc1ccc(cc1F)[C@H](O)[C@H](N)CC Amb25258590 [0,2,0,0,0,0|2,0,0]=4 4819 B14R1.1003 Cc1ccc(cc1N)[C@H](O)[C@@H](N)CC Amb25211795 [0,2,0,0,0,0|2,0,0]=4 4820 B14R1.1003 Cc1ccc(cc1N)[C@H](O)[C@H](N)CC Amb25275602 [0,2,0,0,0,0|2,0,0]=4 4821 B14R1.1003 Cc1ccc(cc1O)C(O)C(N)CC Amb24655107 [0,2,0,0,0,0|2,0,0]=4 4822 B14R1.1013 CC(C)(C(C)CC)c1ccc(N)cc1 Amb25814819 [0,2,0,0,0,0|2,0,0]=4 4823 B14R1.1013 CC(C)(C(C)NC)c1ccc(F)cc1 Amb24350264 [0,2,0,0,0,0|1,0,0]=3 4824 B14R1.1013 CC(C)(C(C)NN)c1ccc(F)cc1 Amb24716531 [0,2,0,0,0,0|2,0,0]=4 4825 B14R1.1013 CC(N)(C(C)CC)c1ccc(Cl)cc1 Amb24730162 [0,2,0,0,0,0|2,0,0]=4 4826 B14R1.1013 CC(N)(C(C)CC)c1ccc(F)cc1 Amb19052656 [0,2,0,0,0,0|2,0,0]=4 4827 B14R1.1013 CC(O)(C(C)C#N)c1ccc(Br)cc1 Amb24742868 [0,2,0,0,0,0|2,0,0]=4 4828 B14R1.1013 CC(O)(C(C)CC)c1ccc(Br)cc1 Amb24498715 [0,2,0,0,0,0|1,0,0]=3 4829 B14R1.1013 CC(O)(C(C)CC)c1ccc(F)c[n]1 Amb25812014 [0,2,0,0,0,0|2,0,0]=4 4830 B14R1.1013 CC(O)(C(C)CC)c1ccc(F)cc1 Amb19053400 [0,2,0,0,0,0|1,0,0]=3 4831 B14R1.1013 CC(O)(C(C)OC)c1ccc(Cl)cc1 Amb25073691 [0,2,0,0,0,0|1,0,0]=3 4832 B14R1.1013 Cc1ccc(cc1)C(C)(N)C(C)CC Amb19050350 [0,2,0,0,0,0|2,0,0]=4 4833 B14R1.1013 Cc1ccc(cc1)C(C)(O)C(C)CC Amb19050748 [0,2,0,0,0,0|1,0,0]=3 4834 B14R1.1013 Cc1ccc(cc1)C(C)(O)C(C)OC Amb24499428 [0,2,0,0,0,0|1,0,0]=3 4835 B14R1.1013 Cc1ccc(cc1)S(=O)(=O)C(C)NC Amb25139515 [0,2,0,0,0,0|1,0,1]=4 4836 B14R1.2819 CC(C#C)C(O)c1ccc(F)cc1F Amb25676756 [0,2,0,0,0,0|1,0,1]=4 4837 B14R1.2819 CC(C#N)C(O)c1ccc(Br)cc1Cl Amb25688125 [0,2,0,0,0,0|2,0,0]=4 4838 B14R1.2819 CC(C#N)C(O)c1ccc(Cl)cc1Br Amb25804588 [0,2,0,0,0,0|2,0,0]=4 4839 B14R1.2819 CC(C#N)C(O)c1ccc(Cl)cc1Cl Amb25375256 [0,2,0,0,0,0|2,0,0]=4 4840 B14R1.2819 CC(C#N)C(O)c1ccc(F)cc1F Amb25224875 [0,2,0,0,0,0|2,0,0]=4 4841 B14R1.2819 CC(CC)C(Br)c1ccc(F)cc1F Amb24751393 [0,2,0,0,0,0|2,0,0]=4 4842 B14R1.2819 CC(CC)C(Cl)c1ccc(Cl)cc1Cl Amb25769619 [0,2,0,0,0,0|2,0,0]=4 4843 B14R1.2819 CC(CC)C(Cl)c1ccc(Cl)cc1F Amb25796712 [0,2,0,0,0,0|2,0,0]=4 4844 B14R1.2819 CC(CC)C(N)c1ccc(Br)cc1Cl Amb25166813 [0,2,0,0,0,0|2,0,0]=4 4845 B14R1.2819 CC(CC)C(N)c1ccc(Cl)cc1Br Amb25070002 [0,2,0,0,0,0|2,0,0]=4 4846 B14R1.2819 CC(CC)C(N)c1ccc(Cl)cc1Cl Amb25671136 [0,2,0,0,0,0|2,0,0]=4 4847 B14R1.2819 CC(CC)C(N)c1ccc(F)cc1Br Amb24669992 [0,2,0,0,0,0|2,0,0]=4 4848 B14R1.2819 CC(CC)C(N)c1ccc(O)cc1F Amb25328981 [0,2,0,0,0,0|2,0,0]=4 4849 B14R1.2819 CC(CC)C(O)c1[n]cc(C)cc1C Amb25312993 [0,2,0,0,0,0|2,0,0]=4 4850 B14R1.2819 CC(CC)C(O)c1c[n]c(C)cc1C Amb25368644 [0,2,0,0,0,0|2,0,0]=4 4851 B14R1.2819 CC(CC)C(O)c1ccc(C)cc1C Amb19050766 [0,2,0,0,0,0|1,0,0]=3 4852 B14R1.2819 CC(CC)C(O)c1ccc(Cl)cc1Cl Amb25753471 [0,2,0,0,0,0|1,0,0]=3 4853 B14R1.2819 CC(CC)C(O)c1ccc(Cl)cc1F Amb25764316 [0,2,0,0,0,0|1,0,0]=3 4854 B14R1.2819 CC(CC)C(O)c1ccc(F)cc1F Amb19047924 [0,2,0,0,0,0|1,0,0]=3 4855 B14R1.2819 CC(CC)C(O)c1ccc(F)cc1I Amb24661509 [0,2,0,0,0,0|1,0,0]=3 4856 B14R1.2819 CC(CC)[C@@H](N)c1ccc(C)cc1C Amb24599760 [0,2,0,0,0,0|2,0,0]=4 4857 B14R1.2819 CC(CC)[C@@H](N)c1ccc(Cl)cc1Cl Amb24550582 [0,2,0,0,0,0|2,0,0]=4 4858 B14R1.2819 CC(CC)[C@@H](N)c1ccc(Cl)cc1F Amb25249293 [0,2,0,0,0,0|2,0,0]=4 4859 B14R1.2819 CC(CC)[C@@H](N)c1ccc(F)cc1Br Amb24630045 [0,2,0,0,0,0|2,0,0]=4 4860 B14R1.2819 CC(CC)[C@@H](N)c1ccc(O)cc1O Amb24634745 [0,2,0,0,0,0|2,0,0]=4 4861 B14R1.2819 CC(CC)[C@H](N)c1ccc(Br)cc1F Amb24565984 [0,2,0,0,0,0|2,0,0]=4 4862 B14R1.2819 CC(CC)[C@H](N)c1ccc(Br)cc1O Amb25199978 [0,2,0,0,0,0|2,0,0]=4 4863 B14R1.2819 CC(CC)[C@H](N)c1ccc(C)cc1C Amb24617817 [0,2,0,0,0,0|2,0,0]=4 4864 B14R1.2819 CC(CC)[C@H](N)c1ccc(Cl)cc1Cl Amb25200337 [0,2,0,0,0,0|2,0,0]=4 4865 B14R1.2819 CC(CC)[C@H](N)c1ccc(F)cc1Cl Amb24555716 [0,2,0,0,0,0|2,0,0]=4 4866 B14R1.2819 CC(CC)[C@H](N)c1ccc(O)cc1F Amb24592846 [0,2,0,0,0,0|2,0,0]=4 4867 B14R1.2819 CC(CN)C(O)c1ccc(Br)cc1Cl Amb25193352 [0,2,0,0,0,0|2,0,0]=4 4868 B14R1.2819 CC(CN)C(O)c1ccc(C)cc1C Amb18815813 [0,2,0,0,0,0|2,0,0]=4 4869 B14R1.2819 CC(CN)C(O)c1ccc(Cl)cc1F Amb25743794 [0,2,0,0,0,0|2,0,0]=4 4870 B14R1.2819 CC(CN)C(O)c1ccc(F)cc1Br Amb24353725 [0,2,0,0,0,0|2,0,0]=4 4871 B14R1.2819 CC(NC)C(C)c1ccc(F)cc1Br Amb25268072 [0,2,0,0,0,0|1,0,0]=3 4872 B14R1.2819 CC(NC)C(C)c1ccc(F)cc1Cl Amb25193472 [0,2,0,0,0,0|1,0,0]=3 4873 B14R1.2819 CC(NC)C(O)c1ccc(Cl)cc1Cl Amb18605229 [0,2,0,0,0,0|0,0,0]=2 4874 B14R1.2819 CC(OC)C(N)c1ccc(C)cc1C Amb18815818 [0,2,0,0,0,0|2,0,0]=4 4875 B14R1.2819 CC(OC)C(N)c1ccc(Cl)cc1Cl Amb25837239 [0,2,0,0,0,0|2,0,0]=4 4876 B14R1.2819 CC(OC)C(N)c1ccc(F)cc1F Amb24362171 [0,2,0,0,0,0|2,0,0]=4 4877 B14R1.2819 CC(OC)C(O)c1ccc(F)cc1F Amb24392523 [0,2,0,0,0,0|1,0,0]=3 4878 B14R1.2819 CCC(N)C(O)c1ccc(Cl)cc1Br Amb24661763 [0,2,0,0,0,0|2,0,0]=4 4879 B14R1.2819 CCC(N)C(O)c1ccc(Cl)cc1F Amb25044744 [0,2,0,0,0,0|2,0,0]=4 4880 B14R1.2819 CCC(N)C(O)c1ccc(F)cc1N Amb24627314 [0,2,0,0,0,0|2,0,0]=4 4881 B14R1.2819 CCC(N)C(O)c1ccc(N)cc1Cl Amb25328809 [0,2,0,0,0,0|2,0,0]=4 4882 B14R1.2819 CCC(N)C(O)c1ccc(N)cc1F Amb24744861 [0,2,0,0,0,0|2,0,0]=4 4883 B14R1.2819 CCC(N)C(O)c1ccc(O)cc1F Amb24587455 [0,2,0,0,0,0|2,0,0]=4 4884 B14R1.2819 CCC(N)C(O)c1ccc(O)cc1O Amb24559293 [0,2,0,0,0,0|2,0,0]=4 4885 B14R1.2819 CCC(O)C(O)c1ccc(F)cc1F Amb25339987 [0,2,0,0,0,0|2,0,0]=4 4886 B14R1.2819 CC[C@@H](N)[C@@H](O)c1ccc(Cl)cc1Cl Amb24697946 [0,2,0,0,0,0|2,0,0]=4 4887 B14R1.2819 CC[C@@H](N)[C@@H](O)c1ccc(F)cc1Cl Amb24542815 [0,2,0,0,0,0|2,0,0]=4 4888 B14R1.2819 CC[C@@H](N)[C@@H](O)c1ccc(F)cc1N Amb24598979 [0,2,0,0,0,0|2,0,0]=4 4889 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(F)cc1F Amb24542934 [0,2,0,0,0,0|2,0,0]=4 4890 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(N)cc1Cl Amb24694529 [0,2,0,0,0,0|2,0,0]=4 4891 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(N)cc1F Amb25275568 [0,2,0,0,0,0|2,0,0]=4 4892 B14R1.2819 CC[C@@H](N)[C@H](O)c1ccc(O)cc1O Amb24653886 [0,2,0,0,0,0|2,0,0]=4 4893 B14R1.2819 CC[C@H](N)[C@@H](O)c1ccc(F)cc1F Amb24564532 [0,2,0,0,0,0|2,0,0]=4 4894 B14R1.2819 CC[C@H](N)[C@@H](O)c1ccc(F)cc1N Amb25338686 [0,2,0,0,0,0|2,0,0]=4 4895 B14R1.2819 CC[C@H](N)[C@@H](O)c1ccc(N)cc1F Amb25275486 [0,2,0,0,0,0|2,0,0]=4 4896 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(Cl)cc1Cl Amb25367367 [0,2,0,0,0,0|2,0,0]=4 4897 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(F)cc1Cl Amb24655032 [0,2,0,0,0,0|2,0,0]=4 4898 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(F)cc1F Amb25255529 [0,2,0,0,0,0|2,0,0]=4 4899 B14R1.2819 CC[C@H](N)[C@H](O)c1ccc(F)cc1N Amb25291086 [0,2,0,0,0,0|2,0,0]=4 4900 B14R1.2819 CNC(=O)C(O)c1ccc(Cl)cc1Cl Amb25848451 [0,2,0,0,0,0|1,0,1]=4 4901 B14R1.2819 CNC(=O)C(O)c1ccc(F)cc1F Amb24718391 [0,2,0,0,0,0|1,0,1]=4 4902 B14R1.2819 CNC(=O)C(c1ccc(cc1C)C)O Amb17401753 [0,2,0,0,0,0|1,0,1]=4 4903 B14R1.2819 CNC(C(=O)c1ccc(cc1C)C)C Amb17313102 [0,2,0,0,0,0|0,0,2]=4 4904 B14R1.2819 CNC(C(=O)c1ccc(cc1Cl)Cl)C Amb17313051 [0,2,0,0,0,0|0,0,2]=4 4905 B14R1.2819 CNC(C)C(=O)c1ccc(Cl)cc1F Amb24698367 [0,2,0,0,0,0|0,0,2]=4 4906 B14R1.2819 CNC(C)C(=O)c1ccc(F)cc1F Amb18566087 [0,2,0,0,0,0|0,0,2]=4 4907 B14R1.2819 Cc1cc(Br)ccc1C(N)C(C)CC Amb25757223 [0,2,0,0,0,0|2,0,0]=4 4908 B14R1.2819 Cc1cc(Cl)ccc1C(N)C(C)CC Amb24368296 [0,2,0,0,0,0|2,0,0]=4 4909 B14R1.2819 Cc1cc(Cl)ccc1C(O)C(C)CC Amb25266147 [0,2,0,0,0,0|1,0,0]=3 4910 B14R1.2819 Cc1cc(Cl)ccc1C(O)C(C)CN Amb25857613 [0,2,0,0,0,0|2,0,0]=4 4911 B14R1.2819 Cc1cc(Cl)ccc1[C@@H](N)C(C)CC Amb24670467 [0,2,0,0,0,0|2,0,0]=4 4912 B14R1.2819 Cc1cc(Cl)ccc1[C@@H](O)[C@H](N)CC Amb25200190 [0,2,0,0,0,0|2,0,0]=4 4913 B14R1.2819 Cc1cc(Cl)ccc1[C@H](N)C(C)CC Amb24542825 [0,2,0,0,0,0|2,0,0]=4 4914 B14R1.2819 Cc1cc(Cl)ccc1[C@H](O)[C@@H](N)CC Amb24565982 [0,2,0,0,0,0|2,0,0]=4 4915 B14R1.2819 Cc1cc(F)ccc1C(N)C(C)CC Amb24697358 [0,2,0,0,0,0|2,0,0]=4 4916 B14R1.2819 Cc1cc(F)ccc1C(O)C(C)CN Amb25699764 [0,2,0,0,0,0|2,0,0]=4 4917 B14R1.2819 Cc1cc(F)ccc1C(O)C(N)CC Amb18295696 [0,2,0,0,0,0|2,0,0]=4 4918 B14R1.2819 Cc1cc(F)ccc1C(O)C(O)CC Amb24378657 [0,2,0,0,0,0|2,0,0]=4 4919 B14R1.2819 Cc1cc(F)ccc1[C@@H](N)C(C)CC Amb25200335 [0,2,0,0,0,0|2,0,0]=4 4920 B14R1.2819 Cc1cc(F)ccc1[C@@H](O)[C@@H](N)CC Amb24595551 [0,2,0,0,0,0|2,0,0]=4 4921 B14R1.2819 Cc1cc(F)ccc1[C@@H](O)[C@H](N)CC Amb24628905 [0,2,0,0,0,0|2,0,0]=4 4922 B14R1.2819 Cc1cc(F)ccc1[C@H](N)C(C)CC Amb25366630 [0,2,0,0,0,0|2,0,0]=4 4923 B14R1.2819 Cc1cc(F)ccc1[C@H](O)[C@@H](N)CC Amb24595959 [0,2,0,0,0,0|2,0,0]=4 4924 B14R1.2819 Cc1cc(F)ccc1[C@H](O)[C@H](N)CC Amb24595941 [0,2,0,0,0,0|2,0,0]=4 4925 B14R1.2819 Cc1cc(N)ccc1[C@H](O)[C@@H](N)CC Amb25264990 [0,2,0,0,0,0|2,0,0]=4 4926 B14R1.2819 Cc1cc(N)ccc1[C@H](O)[C@H](N)CC Amb24542925 [0,2,0,0,0,0|2,0,0]=4 4927 B14R1.2819 Cc1ccc(C(N)C(C)CC)c(Br)c1 Amb25790842 [0,2,0,0,0,0|2,0,0]=4 4928 B14R1.2819 Cc1ccc(C(N)C(C)CC)c(Cl)c1 Amb25681872 [0,2,0,0,0,0|2,0,0]=4 4929 B14R1.2819 Cc1ccc(C(N)C(C)CC)c(F)c1 Amb24436188 [0,2,0,0,0,0|2,0,0]=4 4930 B14R1.2819 Cc1ccc(C(O)C(C)C#N)c(Br)c1 Amb25283510 [0,2,0,0,0,0|2,0,0]=4 4931 B14R1.2819 Cc1ccc(C(O)C(C)CC)c(Br)c1 Amb25350023 [0,2,0,0,0,0|1,0,0]=3 4932 B14R1.2819 Cc1ccc(C(O)C(C)CC)c(F)c1 Amb24457175 [0,2,0,0,0,0|1,0,0]=3 4933 B14R1.2819 Cc1ccc(C(O)C(N)CC)c(Br)c1 Amb24390151 [0,2,0,0,0,0|2,0,0]=4 4934 B14R1.2819 Cc1ccc(C(O)C(N)CC)c(Cl)c1 Amb25222683 [0,2,0,0,0,0|2,0,0]=4 4935 B14R1.2819 Cc1ccc(C(O)C(N)CC)c(F)c1 Amb25200121 [0,2,0,0,0,0|2,0,0]=4 4936 B14R1.2819 Cc1ccc(C(O)C(N)CC)c(N)c1 Amb24604905 [0,2,0,0,0,0|2,0,0]=4 4937 B14R1.2819 Cc1ccc([C@@H](N)C(C)CC)c(Br)c1 Amb25258535 [0,2,0,0,0,0|2,0,0]=4 4938 B14R1.2819 Cc1ccc([C@@H](O)[C@@H](N)CC)c(Cl)c1 Amb24542809 [0,2,0,0,0,0|2,0,0]=4 4939 B14R1.2819 Cc1ccc([C@@H](O)[C@@H](N)CC)c(N)c1 Amb24542805 [0,2,0,0,0,0|2,0,0]=4 4940 B14R1.2819 Cc1ccc([C@@H](O)[C@H](N)CC)c(C)c1 Amb25241720 [0,2,0,0,0,0|2,0,0]=4 4941 B14R1.2819 Cc1ccc([C@@H](O)[C@H](N)CC)c(Cl)c1 Amb24564023 [0,2,0,0,0,0|2,0,0]=4 4942 B14R1.2819 Cc1ccc([C@@H](O)[C@H](N)CC)c(F)c1 Amb24565965 [0,2,0,0,0,0|2,0,0]=4 4943 B14R1.2819 Cc1ccc([C@H](N)C(C)CC)c(Br)c1 Amb24618490 [0,2,0,0,0,0|2,0,0]=4 4944 B14R1.2819 Cc1ccc([C@H](O)[C@@H](N)CC)c(F)c1 Amb24542653 [0,2,0,0,0,0|2,0,0]=4 4945 B14R1.2819 Cc1ccc([C@H](O)[C@@H](N)CC)c(N)c1 Amb25291187 [0,2,0,0,0,0|2,0,0]=4 4946 B14R1.2819 Cc1ccc([C@H](O)[C@H](N)CC)c(Cl)c1 Amb24542935 [0,2,0,0,0,0|2,0,0]=4 4947 B14R1.18 CC(CC)C(Cl)c1cccc(Cl)c1Cl Amb24413114 [0,2,0,0,0,0|2,0,0]=4 4948 B14R1.18 CC(CC)C(N)c1cccc(C)c1C Amb25377748 [0,2,0,0,0,0|2,0,0]=4 4949 B14R1.18 CC(CC)C(N)c1cccc(Cl)c1Cl Amb24735362 [0,2,0,0,0,0|2,0,0]=4 4950 B14R1.18 CC(CC)C(N)c1cccc(Cl)c1F Amb24498683 [0,2,0,0,0,0|2,0,0]=4 4951 B14R1.18 CC(CC)C(N)c1cccc(Cl)c1O Amb24652719 [0,2,0,0,0,0|2,0,0]=4 4952 B14R1.18 CC(CC)C(N)c1cccc(F)c1Cl Amb24604332 [0,2,0,0,0,0|2,0,0]=4 4953 B14R1.18 CC(CC)C(O)c1cccc(Br)c1F Amb25672778 [0,2,0,0,0,0|1,0,0]=3 4954 B14R1.18 CC(CC)C(O)c1cccc(F)c1Cl Amb24430360 [0,2,0,0,0,0|1,0,0]=3 4955 B14R1.18 CC(CC)[C@@H](N)c1cccc(Br)c1O Amb25314569 [0,2,0,0,0,0|2,0,0]=4 4956 B14R1.18 CC(CC)[C@@H](N)c1cccc(C)c1C Amb25200198 [0,2,0,0,0,0|2,0,0]=4 4957 B14R1.18 CC(CC)[C@@H](N)c1cccc(Cl)c1F Amb24742377 [0,2,0,0,0,0|2,0,0]=4 4958 B14R1.18 CC(CC)[C@@H](N)c1cccc(Cl)c1O Amb25233256 [0,2,0,0,0,0|2,0,0]=4 4959 B14R1.18 CC(CC)[C@@H](N)c1cccc(F)c1Br Amb25200118 [0,2,0,0,0,0|2,0,0]=4 4960 B14R1.18 CC(CC)[C@@H](N)c1cccc(F)c1F Amb25377893 [0,2,0,0,0,0|2,0,0]=4 4961 B14R1.18 CC(CC)[C@H](N)c1cccc(C)c1C Amb25200115 [0,2,0,0,0,0|2,0,0]=4 4962 B14R1.18 CC(CC)[C@H](N)c1cccc(Cl)c1Cl Amb24595567 [0,2,0,0,0,0|2,0,0]=4 4963 B14R1.18 CC(CC)[C@H](N)c1cccc(Cl)c1O Amb24540280 [0,2,0,0,0,0|2,0,0]=4 4964 B14R1.18 CC(CC)[C@H](N)c1cccc(F)c1O Amb24653887 [0,2,0,0,0,0|2,0,0]=4 4965 B14R1.18 CC(CN)C(O)c1cccc(Br)c1Cl Amb25166660 [0,2,0,0,0,0|2,0,0]=4 4966 B14R1.18 CC(CN)C(O)c1cccc(Cl)c1Cl Amb25814992 [0,2,0,0,0,0|2,0,0]=4 4967 B14R1.18 CC(OC)C(N)c1cccc(C)c1C Amb25268094 [0,2,0,0,0,0|2,0,0]=4 4968 B14R1.18 CC(OC)C(O)c1cccc(Br)c1F Amb25825756 [0,2,0,0,0,0|1,0,0]=3 4969 B14R1.18 CC(OC)C(O)c1cccc(Cl)c1Cl Amb25664424 [0,2,0,0,0,0|1,0,0]=3 4970 B14R1.18 CCC(N)C(O)c1cccc(Br)c1F Amb25211414 [0,2,0,0,0,0|2,0,0]=4 4971 B14R1.18 CCC(N)C(O)c1cccc(Cl)c1F Amb25674971 [0,2,0,0,0,0|2,0,0]=4 4972 B14R1.18 CCC(N)C(O)c1cccc(F)c1Cl Amb24542628 [0,2,0,0,0,0|2,0,0]=4 4973 B14R1.18 CCC(N)C(O)c1cccc(F)c1F Amb18187240 [0,2,0,0,0,0|2,0,0]=4 4974 B14R1.18 CCC(N)C(O)c1cccc(F)c1N Amb25233622 [0,2,0,0,0,0|2,0,0]=4 4975 B14R1.18 CCC(N)C(O)c1cccc(O)c1Cl Amb24526454 [0,2,0,0,0,0|2,0,0]=4 4976 B14R1.18 CC[C@@H](N)[C@@H](O)c1cccc(Cl)c1Cl Amb25228001 [0,2,0,0,0,0|2,0,0]=4 4977 B14R1.18 CC[C@@H](N)[C@@H](O)c1cccc(N)c1O Amb25276606 [0,2,0,0,0,0|2,0,0]=4 4978 B14R1.18 CC[C@@H](N)[C@H](O)c1cccc(F)c1O Amb25238417 [0,2,0,0,0,0|2,0,0]=4 4979 B14R1.18 CC[C@H](N)[C@@H](O)c1cccc(Cl)c1F Amb25349562 [0,2,0,0,0,0|2,0,0]=4 4980 B14R1.18 CC[C@H](N)[C@@H](O)c1cccc(N)c1O Amb24678350 [0,2,0,0,0,0|2,0,0]=4 4981 B14R1.18 CC[C@H](N)[C@H](O)c1cccc(Cl)c1F Amb24678246 [0,2,0,0,0,0|2,0,0]=4 4982 B14R1.18 CC[C@H](N)[C@H](O)c1cccc(F)c1Cl Amb25211859 [0,2,0,0,0,0|2,0,0]=4 4983 B14R1.18 CNC(C)C(=O)c1cccc(F)c1F Amb25698014 [0,2,0,0,0,0|0,0,2]=4 4984 B14R1.18 CNC(C)C(C)c1cccc(F)c1F Amb25683694 [0,2,0,0,0,0|1,0,0]=3 4985 B14R1.18 Cc1c(Cl)cccc1C(N)C(C)CC Amb24644879 [0,2,0,0,0,0|2,0,0]=4 4986 B14R1.18 Cc1c(Cl)cccc1C(O)C(C)CC Amb24378685 [0,2,0,0,0,0|1,0,0]=3 4987 B14R1.18 Cc1c(Cl)cccc1C(O)C(C)CN Amb25813657 [0,2,0,0,0,0|2,0,0]=4 4988 B14R1.18 Cc1c(F)cccc1C(N)C(C)CC Amb25238442 [0,2,0,0,0,0|2,0,0]=4 4989 B14R1.18 Cc1c(F)cccc1C(O)C(C)CN Amb24560790 [0,2,0,0,0,0|2,0,0]=4 4990 B14R1.18 Cc1c(F)cccc1[C@H](N)C(C)CC Amb25322515 [0,2,0,0,0,0|2,0,0]=4 4991 B14R1.18 Cc1c(cccc1Cl)C(O)C(N)CC Amb24542853 [0,2,0,0,0,0|2,0,0]=4 4992 B14R1.18 Cc1c(cccc1Cl)[C@H](O)[C@@H](N)CC Amb24542778 [0,2,0,0,0,0|2,0,0]=4 4993 B14R1.18 Cc1c(cccc1N)C(O)C(N)CC Amb25246731 [0,2,0,0,0,0|2,0,0]=4 4994 B14R1.18 Cc1c(cccc1N)[C@@H](O)[C@@H](N)CC Amb25249277 [0,2,0,0,0,0|2,0,0]=4 4995 B14R1.18 Cc1cccc(C(N)C(C)CC)c1Br Amb25103901 [0,2,0,0,0,0|2,0,0]=4 4996 B14R1.18 Cc1cccc(C(N)C(C)CC)c1Cl Amb25166886 [0,2,0,0,0,0|2,0,0]=4 4997 B14R1.18 Cc1cccc(C(N)C(C)CC)c1F Amb24351009 [0,2,0,0,0,0|2,0,0]=4 4998 B14R1.18 Cc1cccc(C(N)C(C)CC)c1O Amb24699589 [0,2,0,0,0,0|2,0,0]=4 4999 B14R1.18 Cc1cccc(C(O)C(C)CC)c1Br Amb25672784 [0,2,0,0,0,0|1,0,0]=3 5000 B14R1.18 Cc1cccc(C(O)C(C)CN)c1Br Amb24436992 [0,2,0,0,0,0|2,0,0]=4 5001 B14R1.18 Cc1cccc(C(O)C(C)CN)c1Cl Amb25080307 [0,2,0,0,0,0|2,0,0]=4 5002 B14R1.18 Cc1cccc(C(O)C(N)CC)c1C Amb18980368 [0,2,0,0,0,0|2,0,0]=4 5003 B14R1.18 Cc1cccc([C@@H](N)C(C)CC)c1O Amb24742375 [0,2,0,0,0,0|2,0,0]=4 5004 B14R1.18 Cc1cccc([C@H](N)C(C)CC)c1O Amb24565925 [0,2,0,0,0,0|2,0,0]=4 5005 B14R1.18 Cc1cccc([C@H](O)[C@@H](N)CC)c1C Amb25233255 [0,2,0,0,0,0|2,0,0]=4 5006 B14R1.18 Cc1cccc([C@H](O)[C@@H](N)CC)c1Cl Amb24653885 [0,2,0,0,0,0|2,0,0]=4 5007 B14R1.18 Cc1cccc([C@H](O)[C@@H](N)CC)c1F Amb24542767 [0,2,0,0,0,0|2,0,0]=4 5008 B14R1.18 Cc1cccc([C@H](O)[C@H](N)CC)c1C Amb25322559 [0,2,0,0,0,0|2,0,0]=4 5009 B14R1.18 Cc1cccc([C@H](O)[C@H](N)CC)c1Cl Amb24627313 [0,2,0,0,0,0|2,0,0]=4 5010 B14R1.36 N#CCC(C(c1cccc(c1)Br)O)C Amb17354629 [0,2,0,0,0,0|1,0,1]=4 5011 B14R1.36 N#CCC(C(c1cccc(c1)C)O)C Amb17336108 [0,2,0,0,0,0|1,0,1]=4 5012 B14R1.36 N#CCC(C(c1cccc(c1)Cl)O)C Amb17339412 [0,2,0,0,0,0|1,0,1]=4 5013 B14R1.36 N#CCC(C(c1cccc(c1)O)O)C Amb17336304 [0,2,0,0,0,0|1,0,1]=4 5014 B14R1.79 CNC(C)C(=O)c1cc(ccc1)OC Amb18565248 [0,2,0,0,0,0|0,0,2]=4 5015 B14R1.89 Cc1cc(ccc1)[C@@H](O)[C@@H](CC)C#N Amb25129751 [0,2,0,0,0,0|1,0,1]=4 5016 B14R1.89 Cc1cc(ccc1)[C@H](O)[C@@H](CC)C#N Amb25846206 [0,2,0,0,0,0|1,0,1]=4 5017 B14R1.150 CC(=O)C(Cl)C(O)c1cccc(F)c1 Amb25112169 [0,2,0,0,0,0|2,0,0]=4 5018 B14R1.150 CC(=O)[C@@H](Cl)[C@@H](O)c1cccc(F)c1 Amb25798340 [0,2,0,0,0,0|2,0,0]=4 5019 B14R1.150 CC(C(O)c1cc(F)ccc1)[N+]([O-])=O Amb24521719 [0,2,0,0,0,0|1,0,1]=4 5020 B14R1.150 CC(C)C(C)C(N)c1cccc(Br)c1 Amb24740087 [0,2,0,0,0,0|2,0,0]=4 5021 B14R1.150 CC(C)C(C)C(N)c1cccc(Cl)c1 Amb24629087 [0,2,0,0,0,0|2,0,0]=4 5022 B14R1.150 CC(C)C(C)C(N)c1cccc(F)c1 Amb25167319 [0,2,0,0,0,0|2,0,0]=4 5023 B14R1.150 CC(C)C(C)C(O)c1cccc(Cl)c1 Amb25855880 [0,2,0,0,0,0|1,0,0]=3 5024 B14R1.150 CC(C)C(N)C(O)c1cc(Br)ccc1 Amb18586799 [0,2,0,0,0,0|2,0,0]=4 5025 B14R1.150 CC(C)C(N)C(O)c1cc(Cl)ccc1 Amb18569651 [0,2,0,0,0,0|2,0,0]=4 5026 B14R1.150 CC(C)C(N)C(O)c1cc(F)ccc1 Amb18565956 [0,2,0,0,0,0|2,0,0]=4 5027 B14R1.150 CC(C)[C@@H](N)[C@@H](O)c1cc(Br)ccc1 Amb24595940 [0,2,0,0,0,0|2,0,0]=4 5028 B14R1.150 CC(C)[C@@H](N)[C@H](O)c1cc(F)ccc1 Amb25200061 [0,2,0,0,0,0|2,0,0]=4 5029 B14R1.150 CC(C)[C@H](N)[C@@H](O)c1cc(F)ccc1 Amb24652774 [0,2,0,0,0,0|2,0,0]=4 5030 B14R1.150 CC(C)[C@H](N)[C@@H](O)c1cc(O)ccc1 Amb24558371 [0,2,0,0,0,0|2,0,0]=4 5031 B14R1.150 CC(C)[C@H](N)[C@H](O)c1cc(Br)ccc1 Amb25287505 [0,2,0,0,0,0|2,0,0]=4 5032 B14R1.150 CC(C)[C@H](N)[C@H](O)c1cc(Cl)ccc1 Amb24558809 [0,2,0,0,0,0|2,0,0]=4 5033 B14R1.150 CN(C)C(=N)C(O)c1cc(O)ccc1 Amb25142721 [0,2,0,0,0,0|1,0,1]=4 5034 B14R1.150 CN(C)C(=O)C(O)c1cccc(Br)c1 Amb25029176 [0,2,0,0,0,0|1,0,1]=4 5035 B14R1.150 CN(C)C(=O)C(O)c1cccc(F)c1 Amb25320310 [0,2,0,0,0,0|1,0,1]=4 5036 B14R1.150 Cc1cc(cc[n]1)C(O)C(C)C(C)C Amb24398158 [0,2,0,0,0,0|2,0,0]=4 5037 B14R1.150 Cc1cc(ccc1)C(O)C(N)C(C)C Amb18565327 [0,2,0,0,0,0|2,0,0]=4 5038 B14R1.150 Cc1cc(ccc1)[C@@H](O)[C@@H](N)C(C)C Amb24587461 [0,2,0,0,0,0|2,0,0]=4 5039 B14R1.150 Cc1cc(ccc1)[C@H](O)[C@@H](N)C(C)C Amb24618298 [0,2,0,0,0,0|2,0,0]=4 5040 B14R1.150 Cc1cc[n]c(c1)C(O)C(C)C(C)C Amb24501601 [0,2,0,0,0,0|2,0,0]=4 5041 B14R1.150 Cc1cccc([n]1)C(O)C(C)C(C)C Amb25322334 [0,2,0,0,0,0|2,0,0]=4 5042 B14R1.150 Cc1cccc(c1)C(N)C(C)C(C)C Amb18817935 [0,2,0,0,0,0|2,0,0]=4 5043 B14R1.306 CC(C)(C#N)C(O)c1cccc(F)c1 Amb25127436 [0,2,0,0,0,0|2,0,0]=4 5044 B14R1.306 CC(C)(CC)C(N)c1cccc(Cl)c1 Amb25340051 [0,2,0,0,0,0|2,0,0]=4 5045 B14R1.306 CC(C)(CC)C(N)c1cccc(F)c1 Amb25691813 [0,2,0,0,0,0|2,0,0]=4 5046 B14R1.306 CC(C)(CC)C(O)c1cccc(Cl)c1 Amb24588493 [0,2,0,0,0,0|1,0,0]=3 5047 B14R1.306 CC(C)(CC)C(O)c1cccc(F)c1 Amb24731577 [0,2,0,0,0,0|1,0,0]=3 5048 B14R1.306 CC(C)(CN)C(O)c1cccc(Cl)c1 Amb18914855 [0,2,0,0,0,0|2,0,0]=4 5049 B14R1.306 CC(C)(CN)C(O)c1cccc(F)c1 Amb18911118 [0,2,0,0,0,0|2,0,0]=4 5050 B14R1.306 CC(C)(CO)C(O)c1cccc(F)c1 Amb25750545 [0,2,0,0,0,0|2,0,0]=4 5051 B14R1.306 CC(C)(CO)[C@@H](O)c1cc(O)ccc1 Amb25705129 [0,2,0,0,0,0|2,0,0]=4 5052 B14R1.306 CC(C)(CO)[C@H](O)c1cc(O)ccc1 Amb25198772 [0,2,0,0,0,0|2,0,0]=4 5053 B14R1.306 CC(C)(NC)C(=O)c1cccc(Cl)c1 Amb24401211 [0,2,0,0,0,0|0,0,2]=4 5054 B14R1.306 CC(C)(NC)C(=O)c1cccc(F)c1 Amb25265202 [0,2,0,0,0,0|0,0,2]=4 5055 B14R1.306 CC(C)(NC)C(O)c1cccc(Cl)c1 Amb24458155 [0,2,0,0,0,0|0,0,0]=2 5056 B14R1.306 CC(C)(OC)C(N)c1cccc(F)c1 Amb25229901 [0,2,0,0,0,0|2,0,0]=4 5057 B14R1.306 CC(C)(OC)C(O)c1cccc(F)c1 Amb25677011 [0,2,0,0,0,0|1,0,0]=3 5058 B14R1.306 CC(C)(SC)C(N)c1cccc(Cl)c1 Amb24444138 [0,2,0,0,0,0|2,0,0]=4 5059 B14R1.306 CNC(C)(C)C(O)c1c[n]cc(F)c1 Amb25688191 [0,2,0,0,0,0|1,0,0]=3 5060 B14R1.306 COC(C)(C)C(O)c1c[n]cc(F)c1 Amb24469177 [0,2,0,0,0,0|2,0,0]=4 5061 B14R1.306 Cc1c[n]cc(c1)C(F)C(C)(C)NC Amb25306963 [0,2,0,0,0,0|2,0,0]=4 5062 B14R1.306 Cc1c[n]cc(c1)C(O)C(C)(C)CC Amb24747482 [0,2,0,0,0,0|2,0,0]=4 5063 B14R1.306 Cc1c[n]cc(c1)C(O)C(C)(C)NC Amb25107853 [0,2,0,0,0,0|1,0,0]=3 5064 B14R1.306 Cc1cc(ccc1)C(=O)C(C)(C)NC Amb25291771 [0,2,0,0,0,0|0,0,2]=4 5065 B14R1.306 Cc1cccc(c1)C(N)C(C)(C)CC Amb25828729 [0,2,0,0,0,0|2,0,0]=4 5066 B14R1.306 Cc1cccc(c1)C(N)C(C)(C)SC Amb25854648 [0,2,0,0,0,0|2,0,0]=4 5067 B14R1.306 Cc1cccc(c1)C(O)C(C)(C)CN Amb18910514 [0,2,0,0,0,0|2,0,0]=4 5068 B14R1.306 Cc1cccc(c1)C(O)C(C)(C)NC Amb25107854 [0,2,0,0,0,0|0,0,0]=2 5069 B14R1.306 Cc1cccc(c1)C(O)C(C)(C)OC Amb24648586 [0,2,0,0,0,0|1,0,0]=3 5070 B14R1.306 Cc1cccc(c1)C(O)C(C)(C)SC Amb24694861 [0,2,0,0,0,0|1,0,0]=3 5071 B14R1.306 Cc1cccc(c1)C(O)C(C)(O)CC Amb25775720 [0,2,0,0,0,0|1,0,0]=3 5072 B14R1.711 CC(CC)C(C#N)c1cccc(Cl)c1 Amb25764317 [0,2,0,0,0,0|2,0,0]=4 5073 B14R1.711 CC(CC)C(C#N)c1cccc(F)c1 Amb25732215 [0,2,0,0,0,0|2,0,0]=4 5074 B14R1.988 CC(C#N)C(O)c1cc(Br)ccc1Cl Amb24534881 [0,2,0,0,0,0|2,0,0]=4 5075 B14R1.988 CC(C#N)C(O)c1cc(Br)ccc1F Amb25305026 [0,2,0,0,0,0|2,0,0]=4 5076 B14R1.988 CC(C#N)C(O)c1cc(Cl)ccc1Br Amb24535286 [0,2,0,0,0,0|2,0,0]=4 5077 B14R1.988 CC(C#N)C(O)c1cc(F)ccc1F Amb25739201 [0,2,0,0,0,0|2,0,0]=4 5078 B14R1.988 CC(CC)C(Br)c1cc(Br)ccc1Br Amb25181036 [0,2,0,0,0,0|2,0,0]=4 5079 B14R1.988 CC(CC)C(Br)c1cc(C)ccc1C Amb24675724 [0,2,0,0,0,0|2,0,0]=4 5080 B14R1.988 CC(CC)C(Cl)c1cc(Br)ccc1Br Amb24431383 [0,2,0,0,0,0|2,0,0]=4 5081 B14R1.988 CC(CC)C(Cl)c1cc(Br)ccc1F Amb24507618 [0,2,0,0,0,0|2,0,0]=4 5082 B14R1.988 CC(CC)C(Cl)c1cc(Cl)ccc1Cl Amb25164315 [0,2,0,0,0,0|2,0,0]=4 5083 B14R1.988 CC(CC)C(Cl)c1cc(F)ccc1Cl Amb24413102 [0,2,0,0,0,0|2,0,0]=4 5084 B14R1.988 CC(CC)C(N)c1cc(Br)ccc1Cl Amb25068268 [0,2,0,0,0,0|2,0,0]=4 5085 B14R1.988 CC(CC)C(N)c1cc(Br)ccc1I Amb25849832 [0,2,0,0,0,0|2,0,0]=4 5086 B14R1.988 CC(CC)C(N)c1cc(Br)ccc1O Amb24558728 [0,2,0,0,0,0|2,0,0]=4 5087 B14R1.988 CC(CC)C(N)c1cc(Cl)ccc1O Amb24655126 [0,2,0,0,0,0|2,0,0]=4 5088 B14R1.988 CC(CC)C(N)c1cc(F)ccc1Br Amb25842822 [0,2,0,0,0,0|2,0,0]=4 5089 B14R1.988 CC(CC)C(N)c1cc(F)ccc1Cl Amb24379383 [0,2,0,0,0,0|2,0,0]=4 5090 B14R1.988 CC(CC)C(N)c1cc(O)ccc1Br Amb24634743 [0,2,0,0,0,0|2,0,0]=4 5091 B14R1.988 CC(CC)C(N)c1cc(O)ccc1O Amb25200334 [0,2,0,0,0,0|2,0,0]=4 5092 B14R1.988 CC(CC)C(O)c1cc(Br)ccc1Br Amb25041213 [0,2,0,0,0,0|1,0,0]=3 5093 B14R1.988 CC(CC)C(O)c1cc(C)ccc1C Amb19050767 [0,2,0,0,0,0|1,0,0]=3 5094 B14R1.988 CC(CC)C(O)c1cc(Cl)c[n]c1N Amb24335914 [0,2,0,0,0,0|2,0,0]=4 5095 B14R1.988 CC(CC)C(O)c1cc(Cl)ccc1Br Amb24498643 [0,2,0,0,0,0|1,0,0]=3 5096 B14R1.988 CC(CC)C(O)c1cc(Cl)ccc1Cl Amb25164675 [0,2,0,0,0,0|1,0,0]=3 5097 B14R1.988 CC(CC)C(O)c1cc(Cl)ccc1I Amb25707071 [0,2,0,0,0,0|1,0,0]=3 5098 B14R1.988 CC(CC)C(O)c1cc(F)ccc1Br Amb25356503 [0,2,0,0,0,0|1,0,0]=3 5099 B14R1.988 CC(CC)C(O)c1cc(F)ccc1F Amb19047921 [0,2,0,0,0,0|1,0,0]=3 5100 B14R1.988 CC(CC)C(O)c1cc(F)ccc1N Amb25195818 [0,2,0,0,0,0|1,0,0]=3 5101 B14R1.988 CC(CC)C(O)c1cc(I)ccc1Br Amb24433213 [0,2,0,0,0,0|1,0,0]=3 5102 B14R1.988 CC(CC)[C@@H](N)c1cc(Cl)ccc1Br Amb25200116 [0,2,0,0,0,0|2,0,0]=4 5103 B14R1.988 CC(CC)[C@@H](N)c1cc(Cl)ccc1Cl Amb25200113 [0,2,0,0,0,0|2,0,0]=4 5104 B14R1.988 CC(CC)[C@@H](N)c1cc(Cl)ccc1F Amb25339750 [0,2,0,0,0,0|2,0,0]=4 5105 B14R1.988 CC(CC)[C@@H](N)c1cc(Cl)ccc1N Amb25258963 [0,2,0,0,0,0|2,0,0]=4 5106 B14R1.988 CC(CC)[C@@H](N)c1cc(Cl)ccc1O Amb24710752 [0,2,0,0,0,0|2,0,0]=4 5107 B14R1.988 CC(CC)[C@@H](N)c1cc(F)ccc1F Amb24542939 [0,2,0,0,0,0|2,0,0]=4 5108 B14R1.988 CC(CC)[C@@H](N)c1cc(I)ccc1F Amb24710753 [0,2,0,0,0,0|2,0,0]=4 5109 B14R1.988 CC(CC)[C@H](N)c1cc(Br)ccc1Br Amb24694449 [0,2,0,0,0,0|2,0,0]=4 5110 B14R1.988 CC(CC)[C@H](N)c1cc(Br)ccc1Cl Amb25300564 [0,2,0,0,0,0|2,0,0]=4 5111 B14R1.988 CC(CC)[C@H](N)c1cc(Br)ccc1F Amb25377918 [0,2,0,0,0,0|2,0,0]=4 5112 B14R1.988 CC(CC)[C@H](N)c1cc(Cl)ccc1F Amb25200199 [0,2,0,0,0,0|2,0,0]=4 5113 B14R1.988 CC(CC)[C@H](N)c1cc(Cl)ccc1O Amb24566486 [0,2,0,0,0,0|2,0,0]=4 5114 B14R1.988 CC(CC)[C@H](N)c1cc(F)ccc1Br Amb24550260 [0,2,0,0,0,0|2,0,0]=4 5115 B14R1.988 CC(CC)[C@H](N)c1cc(F)ccc1O Amb25245411 [0,2,0,0,0,0|2,0,0]=4 5116 B14R1.988 CC(CN)C(O)c1cc(Br)ccc1Cl Amb24397376 [0,2,0,0,0,0|2,0,0]=4 5117 B14R1.988 CC(CN)C(O)c1cc(C)ccc1C Amb25814994 [0,2,0,0,0,0|2,0,0]=4 5118 B14R1.988 CC(CN)C(O)c1cc(Cl)ccc1F Amb25814993 [0,2,0,0,0,0|2,0,0]=4 5119 B14R1.988 CC(CN)C(O)c1cc(F)ccc1Cl Amb25094656 [0,2,0,0,0,0|2,0,0]=4 5120 B14R1.988 CC(CN)C(O)c1cc(F)ccc1F Amb25071899 [0,2,0,0,0,0|2,0,0]=4 5121 B14R1.988 CC(OC)C(N)c1cc(Br)ccc1F Amb25302539 [0,2,0,0,0,0|2,0,0]=4 5122 B14R1.988 CC(OC)C(O)c1cc(Cl)ccc1Cl Amb25679322 [0,2,0,0,0,0|1,0,0]=3 5123 B14R1.988 CC(OC)C(O)c1cc(F)ccc1Cl Amb25715175 [0,2,0,0,0,0|1,0,0]=3 5124 B14R1.988 CCC(C(c1cc(C)ccc1C)O)N Amb17139402 [0,2,0,0,0,0|2,0,0]=4 5125 B14R1.988 CCC(N)C(O)c1cc(Cl)ccc1N Amb25227947 [0,2,0,0,0,0|2,0,0]=4 5126 B14R1.988 CCC(N)C(O)c1cc(Cl)ccc1O Amb25275605 [0,2,0,0,0,0|2,0,0]=4 5127 B14R1.988 CCC(N)C(O)c1cc(F)ccc1Cl Amb18170096 [0,2,0,0,0,0|2,0,0]=4 5128 B14R1.988 CCC(N)C(O)c1cc(N)ccc1Cl Amb25291102 [0,2,0,0,0,0|2,0,0]=4 5129 B14R1.988 CCC(O)C(O)c1cc(Cl)ccc1Cl Amb25278694 [0,2,0,0,0,0|2,0,0]=4 5130 B14R1.988 CCC(O)C(O)c1cc(F)ccc1Cl Amb24667987 [0,2,0,0,0,0|2,0,0]=4 5131 B14R1.988 CCC(O)C(O)c1cc(F)ccc1F Amb25671883 [0,2,0,0,0,0|2,0,0]=4 5132 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(Cl)ccc1F Amb25222672 [0,2,0,0,0,0|2,0,0]=4 5133 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(Cl)ccc1O Amb24587462 [0,2,0,0,0,0|2,0,0]=4 5134 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(F)ccc1Cl Amb24694523 [0,2,0,0,0,0|2,0,0]=4 5135 B14R1.988 CC[C@@H](N)[C@@H](O)c1cc(F)ccc1F Amb24627300 [0,2,0,0,0,0|2,0,0]=4 5136 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(Cl)ccc1N Amb25377924 [0,2,0,0,0,0|2,0,0]=4 5137 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(F)ccc1F Amb25222737 [0,2,0,0,0,0|2,0,0]=4 5138 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(F)ccc1O Amb24656168 [0,2,0,0,0,0|2,0,0]=4 5139 B14R1.988 CC[C@@H](N)[C@H](O)c1cc(N)ccc1F Amb25300635 [0,2,0,0,0,0|2,0,0]=4 5140 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(Cl)ccc1O Amb24542665 [0,2,0,0,0,0|2,0,0]=4 5141 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(F)ccc1O Amb25350599 [0,2,0,0,0,0|2,0,0]=4 5142 B14R1.988 CC[C@H](N)[C@@H](O)c1cc(N)ccc1Cl Amb25241648 [0,2,0,0,0,0|2,0,0]=4 5143 B14R1.988 CC[C@H](N)[C@H](O)c1cc(F)ccc1N Amb24715982 [0,2,0,0,0,0|2,0,0]=4 5144 B14R1.988 CC[C@H](N)[C@H](O)c1cc(N)ccc1F Amb25339756 [0,2,0,0,0,0|2,0,0]=4 5145 B14R1.988 CNC(=O)C(O)c1cc(Br)ccc1F Amb24672527 [0,2,0,0,0,0|1,0,1]=4 5146 B14R1.988 CNC(=O)C(O)c1cc(Cl)ccc1F Amb25198587 [0,2,0,0,0,0|1,0,1]=4 5147 B14R1.988 CNC(C)C(=O)c1cc(Br)ccc1F Amb25672741 [0,2,0,0,0,0|0,0,2]=4 5148 B14R1.988 CNC(C)C(=O)c1cc(Cl)ccc1F Amb18244258 [0,2,0,0,0,0|0,0,2]=4 5149 B14R1.988 CNC(C)C(=O)c1cc(F)ccc1Cl Amb25133418 [0,2,0,0,0,0|0,0,2]=4 5150 B14R1.988 CNC(C)C(=O)c1cc(F)ccc1F Amb18566081 [0,2,0,0,0,0|0,0,2]=4 5151 B14R1.988 Cc1cc(C(=O)C(C)NC)c(C)cc1 Amb18564935 [0,2,0,0,0,0|0,0,2]=4 5152 B14R1.988 Cc1cc(C(C)C(C)NC)c(C)cc1 Amb24476061 [0,2,0,0,0,0|1,0,0]=3 5153 B14R1.988 Cc1cc(C(O)C(=O)NC)c(C)cc1 Amb25856390 [0,2,0,0,0,0|1,0,1]=4 5154 B14R1.988 Cc1cc([C@@H](O)[C@H](N)CC)c(C)cc1 Amb25238427 [0,2,0,0,0,0|2,0,0]=4 5155 B14R1.988 Cc1ccc(Br)c(c1)C(N)C(C)CC Amb25843040 [0,2,0,0,0,0|2,0,0]=4 5156 B14R1.988 Cc1ccc(Br)c(c1)C(O)C(C)CC Amb24371516 [0,2,0,0,0,0|1,0,0]=3 5157 B14R1.988 Cc1ccc(Br)cc1C(N)C(C)CC Amb25033563 [0,2,0,0,0,0|2,0,0]=4 5158 B14R1.988 Cc1ccc(Br)cc1C(O)C(C)CN Amb24639899 [0,2,0,0,0,0|2,0,0]=4 5159 B14R1.988 Cc1ccc(Cl)c(c1)C(=O)C(C)NC Amb25361404 [0,2,0,0,0,0|0,0,2]=4 5160 B14R1.988 Cc1ccc(Cl)c(c1)C(N)C(C)OC Amb25375006 [0,2,0,0,0,0|2,0,0]=4 5161 B14R1.988 Cc1ccc(Cl)c(c1)C(O)C(C)CN Amb24339234 [0,2,0,0,0,0|2,0,0]=4 5162 B14R1.988 Cc1ccc(Cl)c(c1)C(O)C(C)OC Amb24339209 [0,2,0,0,0,0|1,0,0]=3 5163 B14R1.988 Cc1ccc(Cl)c(c1)C(O)C(N)CC Amb24629257 [0,2,0,0,0,0|2,0,0]=4 5164 B14R1.988 Cc1ccc(Cl)c(c1)C(O)C(O)CC Amb24355472 [0,2,0,0,0,0|2,0,0]=4 5165 B14R1.988 Cc1ccc(Cl)c(c1)[C@@H](O)[C@H](N)CC Amb24617339 [0,2,0,0,0,0|2,0,0]=4 5166 B14R1.988 Cc1ccc(Cl)c(c1)[C@H](O)[C@@H](N)CC Amb25230675 [0,2,0,0,0,0|2,0,0]=4 5167 B14R1.988 Cc1ccc(Cl)cc1[C@@H](O)[C@H](N)CC Amb24580473 [0,2,0,0,0,0|2,0,0]=4 5168 B14R1.988 Cc1ccc(F)c(c1)C(=O)C(C)NC Amb24400875 [0,2,0,0,0,0|0,0,2]=4 5169 B14R1.988 Cc1ccc(F)c(c1)C(O)C(C)C#N Amb24758552 [0,2,0,0,0,0|2,0,0]=4 5170 B14R1.988 Cc1ccc(F)c(c1)C(O)C(O)CC Amb25835875 [0,2,0,0,0,0|2,0,0]=4 5171 B14R1.988 Cc1ccc(F)c(c1)[C@@H](N)C(C)CC Amb25200336 [0,2,0,0,0,0|2,0,0]=4 5172 B14R1.988 Cc1ccc(F)c(c1)[C@@H](O)[C@@H](N)CC Amb25200195 [0,2,0,0,0,0|2,0,0]=4 5173 B14R1.988 Cc1ccc(F)cc1C(=O)C(C)NC Amb24366843 [0,2,0,0,0,0|0,0,2]=4 5174 B14R1.988 Cc1ccc(F)cc1C(N)C(C)CC Amb24718757 [0,2,0,0,0,0|2,0,0]=4 5175 B14R1.988 Cc1ccc(F)cc1C(N)C(C)OC Amb25779143 [0,2,0,0,0,0|2,0,0]=4 5176 B14R1.988 Cc1ccc(F)cc1C(O)C(C)C#N Amb25094055 [0,2,0,0,0,0|2,0,0]=4 5177 B14R1.988 Cc1ccc(F)cc1C(O)C(C)CC Amb25787531 [0,2,0,0,0,0|1,0,0]=3 5178 B14R1.988 Cc1ccc(F)cc1C(O)C(N)CC Amb24758831 [0,2,0,0,0,0|2,0,0]=4 5179 B14R1.988 Cc1ccc(F)cc1[C@@H](N)C(C)CC Amb25242645 [0,2,0,0,0,0|2,0,0]=4 5180 B14R1.988 Cc1ccc(F)cc1[C@H](O)[C@H](N)CC Amb24550712 [0,2,0,0,0,0|2,0,0]=4 5181 B14R1.988 Cc1ccc(N)c(c1)C(O)C(N)CC Amb25302400 [0,2,0,0,0,0|2,0,0]=4 5182 B14R1.988 Cc1ccc(N)c(c1)[C@H](O)[C@H](N)CC Amb25207839 [0,2,0,0,0,0|2,0,0]=4 5183 B14R1.988 Cc1ccc(N)cc1[C@@H](O)[C@@H](N)CC Amb25207843 [0,2,0,0,0,0|2,0,0]=4 5184 B14R1.988 Cc1ccc(N)cc1[C@@H](O)[C@H](N)CC Amb25245386 [0,2,0,0,0,0|2,0,0]=4 5185 B14R1.988 Cc1ccc(O)c(c1)C(O)C(C)NC Amb25207754 [0,2,0,0,0,0|0,0,0]=2 5186 B14R1.988 Cc1ccc(O)c(c1)[C@@H](N)C(C)CC Amb25231061 [0,2,0,0,0,0|2,0,0]=4 5187 B14R1.988 Cc1ccc(O)c(c1)[C@H](N)C(C)CC Amb24627268 [0,2,0,0,0,0|2,0,0]=4 5188 B14R1.993 CC(C#N)C(O)c1cc(Br)cc(Br)c1 Amb24565527 [0,2,0,0,0,0|2,0,0]=4 5189 B14R1.993 CC(C#N)C(O)c1cc(Br)cc(F)c1 Amb25061495 [0,2,0,0,0,0|2,0,0]=4 5190 B14R1.993 CC(C#N)C(O)c1cc(Cl)cc(Cl)c1 Amb24463513 [0,2,0,0,0,0|2,0,0]=4 5191 B14R1.993 CC(CC)C(Cl)c1cc(C)cc(C)c1 Amb25092303 [0,2,0,0,0,0|2,0,0]=4 5192 B14R1.993 CC(CC)C(N)c1cc(Br)cc(Br)c1 Amb24706146 [0,2,0,0,0,0|2,0,0]=4 5193 B14R1.993 CC(CC)C(N)c1cc(Cl)cc(Br)c1 Amb25136579 [0,2,0,0,0,0|2,0,0]=4 5194 B14R1.993 CC(CC)C(O)c1cc(C)cc(C)[n]1 Amb24576060 [0,2,0,0,0,0|2,0,0]=4 5195 B14R1.993 CC(CC)C(O)c1cc(Cl)cc(Br)c1 Amb25673103 [0,2,0,0,0,0|1,0,0]=3 5196 B14R1.993 CC(CC)C(O)c1cc(Cl)cc(Cl)c1 Amb25205980 [0,2,0,0,0,0|1,0,0]=3 5197 B14R1.993 CC(CC)C(O)c1cc(F)cc(Cl)c1 Amb25247075 [0,2,0,0,0,0|1,0,0]=3 5198 B14R1.993 CC(CC)C(O)c1cc(F)cc(F)c1 Amb25040379 [0,2,0,0,0,0|1,0,0]=3 5199 B14R1.993 CC(CC)[C@@H](N)c1cc(C)cc(C)c1 Amb25349570 [0,2,0,0,0,0|2,0,0]=4 5200 B14R1.993 CC(CC)[C@@H](N)c1cc(Cl)cc(Cl)c1 Amb24558389 [0,2,0,0,0,0|2,0,0]=4 5201 B14R1.993 CC(CC)[C@@H](N)c1cc(F)cc(Br)c1 Amb24595617 [0,2,0,0,0,0|2,0,0]=4 5202 B14R1.993 CC(CC)[C@@H](N)c1cc(F)cc(F)c1 Amb24586080 [0,2,0,0,0,0|2,0,0]=4 5203 B14R1.993 CC(CN)C(O)c1cc(Br)cc(Br)c1 Amb25251678 [0,2,0,0,0,0|2,0,0]=4 5204 B14R1.993 CC(CN)C(O)c1cc(Br)cc(F)c1 Amb25081358 [0,2,0,0,0,0|2,0,0]=4 5205 B14R1.993 CC(CN)C(O)c1cc(Cl)cc(Cl)c1 Amb25069337 [0,2,0,0,0,0|2,0,0]=4 5206 B14R1.993 CC(NC)C(O)c1cc(O)cc(O)c1 Amb24399942 [0,2,0,0,0,0|0,0,0]=2 5207 B14R1.993 CCC(C)C(C)c1cc(O)cc(O)c1 Amb25706946 [0,2,0,0,0,0|2,0,0]=4 5208 B14R1.993 CCC(N)C(O)c1cc(Br)cc(Br)c1 Amb25211497 [0,2,0,0,0,0|2,0,0]=4 5209 B14R1.993 CCC(N)C(O)c1cc(C)cc(C)c1 Amb18980663 [0,2,0,0,0,0|2,0,0]=4 5210 B14R1.993 CCC(N)C(O)c1cc(Cl)cc(Cl)c1 Amb18968091 [0,2,0,0,0,0|2,0,0]=4 5211 B14R1.993 CCC(N)C(O)c1cc(Cl)cc(O)c1 Amb25199982 [0,2,0,0,0,0|2,0,0]=4 5212 B14R1.993 CCC(N)C(O)c1cc(F)cc(F)c1 Amb24472855 [0,2,0,0,0,0|2,0,0]=4 5213 B14R1.993 CCC(N)C(O)c1cc(F)cc(O)c1 Amb25794566 [0,2,0,0,0,0|2,0,0]=4 5214 B14R1.993 CCC(O)C(O)c1cc(F)cc(F)c1 Amb25112379 [0,2,0,0,0,0|2,0,0]=4 5215 B14R1.993 CC[C@@H](N)[C@@H](O)c1cc(C)cc(C)c1 Amb24678349 [0,2,0,0,0,0|2,0,0]=4 5216 B14R1.993 CC[C@@H](N)[C@@H](O)c1cc(Cl)cc(F)c1 Amb25200187 [0,2,0,0,0,0|2,0,0]=4 5217 B14R1.993 CC[C@@H](N)[C@@H](O)c1cc(Cl)cc(O)c1 Amb25349637 [0,2,0,0,0,0|2,0,0]=4 5218 B14R1.993 CC[C@@H](N)[C@@H](O)c1cc(F)cc(F)c1 Amb24564554 [0,2,0,0,0,0|2,0,0]=4 5219 B14R1.993 CC[C@@H](N)[C@H](O)c1cc(C)cc(C)c1 Amb25241703 [0,2,0,0,0,0|2,0,0]=4 5220 B14R1.993 CC[C@@H](N)[C@H](O)c1cc(Cl)cc(O)c1 Amb24568038 [0,2,0,0,0,0|2,0,0]=4 5221 B14R1.993 CC[C@@H](N)[C@H](O)c1cc(F)cc(F)c1 Amb25259285 [0,2,0,0,0,0|2,0,0]=4 5222 B14R1.993 CC[C@@H](N)[C@H](O)c1cc(F)cc(O)c1 Amb25245388 [0,2,0,0,0,0|2,0,0]=4 5223 B14R1.993 CC[C@H](N)[C@@H](O)c1cc(F)cc(F)c1 Amb25242709 [0,2,0,0,0,0|2,0,0]=4 5224 B14R1.993 CC[C@H](N)[C@H](O)c1cc(C)cc(C)c1 Amb25202176 [0,2,0,0,0,0|2,0,0]=4 5225 B14R1.993 CC[C@H](N)[C@H](O)c1cc(F)cc(F)c1 Amb24565980 [0,2,0,0,0,0|2,0,0]=4 5226 B14R1.993 CC[C@H](N)[C@H](O)c1cc(F)cc(O)c1 Amb25322482 [0,2,0,0,0,0|2,0,0]=4 5227 B14R1.993 CNC(C)C(=O)c1cc(C)cc(C)c1 Amb25327269 [0,2,0,0,0,0|0,0,2]=4 5228 B14R1.993 CNC(C)C(=O)c1cc(F)cc(F)c1 Amb24699987 [0,2,0,0,0,0|0,0,2]=4 5229 B14R1.993 CNC(C)C(C)c1cc(F)cc(F)c1 Amb25140948 [0,2,0,0,0,0|1,0,0]=3 5230 B14R1.993 C[C@H](CO)[C@@H](O)c1cc(C)cc(C)c1 Amb25846207 [0,2,0,0,0,0|2,0,0]=4 5231 B14R1.993 Cc1cc(Br)cc(c1)C(N)C(C)CC Amb25033365 [0,2,0,0,0,0|2,0,0]=4 5232 B14R1.993 Cc1cc(Cl)cc(c1)C(N)C(C)CC Amb24669991 [0,2,0,0,0,0|2,0,0]=4 5233 B14R1.993 Cc1cc(Cl)cc(c1)C(O)C(C)C#N Amb24693126 [0,2,0,0,0,0|2,0,0]=4 5234 B14R1.993 Cc1cc(F)cc(c1)C(=O)C(C)NC Amb24377299 [0,2,0,0,0,0|0,0,2]=4 5235 B14R1.993 Cc1cc(F)cc(c1)C(N)C(C)CC Amb25664442 [0,2,0,0,0,0|2,0,0]=4 5236 B14R1.993 Cc1cc(F)cc(c1)C(O)C(C)CC Amb24463292 [0,2,0,0,0,0|1,0,0]=3 5237 B14R1.993 Cc1cc(O)cc(c1)C(=O)C(C)NC Amb25780009 [0,2,0,0,0,0|0,0,2]=4 5238 B14R1.993 Cc1cc(O)cc(c1)C(O)C(C)NC Amb25804679 [0,2,0,0,0,0|0,0,0]=2 5239 B14R1.993 Cc1cc(cc(Cl)c1)C(O)C(N)CC Amb25232773 [0,2,0,0,0,0|2,0,0]=4 5240 B14R1.993 Cc1cc(cc(F)c1)C(O)C(C)OC Amb25223021 [0,2,0,0,0,0|1,0,0]=3 5241 B14R1.993 Cc1cc(cc(F)c1)[C@@H](O)[C@@H](N)CC Amb24542765 [0,2,0,0,0,0|2,0,0]=4 5242 B14R1.993 Cc1cc(cc(F)c1)[C@H](O)[C@@H](N)CC Amb25238501 [0,2,0,0,0,0|2,0,0]=4 5243 B14R1.1014 CC(CC)C(C)(O)c1c[n]cc(F)c1 Amb19054313 [0,2,0,0,0,0|2,0,0]=4 5244 B14R1.1014 CC(N)(C(C)CC)c1cccc(Br)c1 Amb24498644 [0,2,0,0,0,0|2,0,0]=4 5245 B14R1.1014 CC(N)(C(C)CC)c1cccc(F)c1 Amb19052657 [0,2,0,0,0,0|2,0,0]=4 5246 B14R1.1014 CC(O)(C(C)C#N)c1cccc(Br)c1 Amb24563767 [0,2,0,0,0,0|2,0,0]=4 5247 B14R1.1014 CC(O)(C(C)C#N)c1cccc(F)c1 Amb24449877 [0,2,0,0,0,0|2,0,0]=4 5248 B14R1.1014 CC(O)(C(C)CC)c1cccc(F)c1 Amb19053401 [0,2,0,0,0,0|1,0,0]=3 5249 B14R1.1014 CC(O)(C(C)CN)c1cccc(Cl)c1 Amb24369426 [0,2,0,0,0,0|2,0,0]=4 5250 B14R1.1014 CC(O)(C(C)CN)c1cccc(F)c1 Amb25771391 [0,2,0,0,0,0|2,0,0]=4 5251 B14R1.1014 CC(O)(C(C)OC)c1cccc(Cl)c1 Amb25272031 [0,2,0,0,0,0|1,0,0]=3 5252 B14R1.1014 CC(O)(C(C)OC)c1cccc(F)c1 Amb24366361 [0,2,0,0,0,0|1,0,0]=3 5253 B14R1.1014 COC(C)C(C)(O)c1c[n]cc(F)c1 Amb25258261 [0,2,0,0,0,0|2,0,0]=4 5254 B14R1.1014 Cc1c[n]cc(c1)C(C)(O)C(C)CC Amb25363593 [0,2,0,0,0,0|2,0,0]=4 5255 B14R1.1014 Cc1c[n]cc(c1)C(C)(O)C(C)OC Amb24499567 [0,2,0,0,0,0|2,0,0]=4 5256 B14R1.1014 Cc1cccc(c1)C(C)(N)C(C)CC Amb19050351 [0,2,0,0,0,0|2,0,0]=4 5257 B14R1.1014 Cc1cccc(c1)C(C)(O)C(C)CC Amb19050749 [0,2,0,0,0,0|1,0,0]=3 5258 B14R1.1014 Cc1cccc(c1)C(C)(O)C(C)CN Amb25117547 [0,2,0,0,0,0|2,0,0]=4 5259 B14R1.166 C#CCNC(=O)C(O)c1ccccc1 Amb25166183 [0,2,0,0,0,0|1,0,1]=4 5260 B14R1.166 C#CCNC(C(c1ccccc1)O)C Amb1078314 [0,2,0,0,0,0|0,0,0]=2 5261 B14R1.166 C=CCNC(=O)C(c1ccccc1)O Amb17401510 [0,2,0,0,0,0|1,0,1]=4 5262 B14R1.166 CC(C#CCO)C(O)c1ccccc1 Amb24371223 [0,2,0,0,0,0|1,0,0]=3 5263 B14R1.166 CC(CC#CC)C(O)c1ccccc1 Amb25272424 [0,2,0,0,0,0|1,0,0]=3 5264 B14R1.166 CC(NCC#C)C(O)c1ccccc1 Amb22283761 [0,2,0,0,0,0|0,0,0]=2 5265 B14R1.166 CC(NCC=C)C(O)c1ccccc1 Amb18092962 [0,2,0,0,0,0|0,0,0]=2 5266 B14R1.166 CC(NCCC)C(O)c1ccccc1 Amb18604509 [0,2,0,0,0,0|0,0,0]=2 5267 B14R1.166 CC(\C=C\C#N)C(O)c1ccccc1 Amb24675508 [0,2,0,0,0,0|1,0,1]=4 5268 B14R1.166 CCCNC(=O)C(c1ccccc1)O Amb17401749 [0,2,0,0,0,0|1,0,1]=4 5269 B14R1.166 CCCNC(C(=O)c1ccccc1)C Amb17619593 [0,2,0,0,0,0|0,0,2]=4 5270 B14R1.166 C[C@@H](C#CCO)[C@@H](O)c1ccccc1 Amb25222283 [0,2,0,0,0,0|1,0,0]=3 5271 B14R1.166 C[C@H](C#CCO)[C@@H](O)c1ccccc1 Amb25831897 [0,2,0,0,0,0|1,0,0]=3 5272 B14R1.166 C[C@H](\C=C\C#N)[C@@H](O)c1ccccc1 Amb24448032 [0,2,0,0,0,0|1,0,1]=4 5273 B14R1.166 N#CCNC(=O)C(O)c1ccccc1 Amb24462473 [0,2,0,0,0,0|1,0,1]=4 5274 B14R1.417 CC(=O)NC(C)C(C)c1ccccc1 Amb25086516 [0,2,0,0,0,0|1,0,0]=3 5275 B14R1.417 CC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 Amb25725960 [0,2,0,0,0,0|1,0,0]=3 5276 B14R1.417 CC(=O)N[C@@H](C)[C@@H](O)c1ccccc1 Amb24418068 [0,2,0,0,0,0|0,0,0]=2 5277 B14R1.417 CC(=O)N[C@@H](C)[C@H](S)c1ccccc1 Amb25165741 [0,2,0,0,0,0|0,1,0]=3 5278 B14R1.417 CC(=O)N[C@H](C)C(=O)c1ccccc1 Amb25695468 [0,2,0,0,0,0|0,0,2]=4 5279 B14R1.417 CC(C(=O)c1ccccc1)CN(C)C Amb2228745 [0,2,0,0,0,0|0,0,2]=4 5280 B14R1.417 CC(C)=NC(C)C(O)c1ccccc1 Amb24648156 [0,2,0,0,0,0|0,0,1]=3 5281 B14R1.417 CC(C)=N[C@@H](C)[C@H](O)c1ccccc1 Amb24718349 [0,2,0,0,0,0|0,0,1]=3 5282 B14R1.417 CC(C)=N[C@H](C)[C@@H](O)c1ccccc1 Amb25057756 [0,2,0,0,0,0|0,0,1]=3 5283 B14R1.417 CC(C)NC(=N)C(O)c1ccccc1 Amb24678903 [0,2,0,0,0,0|1,0,1]=4 5284 B14R1.417 CC(C)NC(=O)[C@H](O)c1ccccc1 Amb24356731 [0,2,0,0,0,0|1,0,1]=4 5285 B14R1.417 CC(C)NC(C)C(O)c1ccccc1 Amb18565350 [0,2,0,0,0,0|0,0,0]=2 5286 B14R1.417 CC(NC(N)=O)C(Cl)c1ccccc1 Amb24668959 [0,2,0,0,0,0|1,0,1]=4 5287 B14R1.417 CC(NC(N)=O)C(O)c1ccccc1 Amb25772992 [0,2,0,0,0,0|0,0,1]=3 5288 B14R1.417 C[C@@H](NC(N)=O)[C@@H](O)c1ccccc1 Amb24433430 [0,2,0,0,0,0|0,0,1]=3 5289 B14R1.417 C[C@@H](NC(N)=O)[C@H](Cl)c1ccccc1 Amb25785564 [0,2,0,0,0,0|1,0,1]=4 5290 B14R1.417 C[C@@H](NC(N)=O)[C@H](O)c1ccccc1 Amb25055138 [0,2,0,0,0,0|0,0,1]=3 5291 B14R1.417 OC(c1ccccc1)C(=O)NC(C)C Amb17401750 [0,2,0,0,0,0|1,0,1]=4 5292 B14R1.417 OC(c1ccccc1)C(NC(=O)C)C Amb17595062 [0,2,0,0,0,0|0,0,0]=2 5293 B14R1.478 CCCC(NC)C(=O)c1ccccc1 Amb22055744 [0,2,0,0,0,0|0,0,2]=4 5294 B14R1.478 CCNC(CC)C(O)c1ccccc1 Amb18093006 [0,2,0,0,0,0|0,0,0]=2 5295 B14R1.478 C\C=C\C(C#C)C(O)c1ccccc1 Amb25234698 [0,2,0,0,0,0|1,0,1]=4 5296 B14R1.478 C\C=C\C(C#N)C(O)c1ccccc1 Amb25730972 [0,2,0,0,0,0|1,0,1]=4 5297 B14R1.510 C\C=C\C(O)C(C)(O)c1ccccc1 Amb25681400 [0,2,0,0,0,0|2,0,0]=4 5298 B14R1.510 C\C=C\[C@@H](O)[C@@](C)(O)c1ccccc1 Amb24448066 [0,2,0,0,0,0|2,0,0]=4 5299 B14R1.3348 N#CCC(C(c1ccccc1C)O)C Amb17336106 [0,2,0,0,0,0|1,0,1]=4 5300 B14R1.3348 N#CCC(C(c1ccccc1Cl)O)C Amb17339410 [0,2,0,0,0,0|1,0,1]=4 5301 B14R1.3348 N#CCC(C(c1ccccc1F)O)C Amb17336576 [0,2,0,0,0,0|1,0,1]=4 5302 B14R1.6708 CC(C)(N=[N+]=[N-])C(O)c1ccccc1 Amb25125259 [0,2,0,0,0,0|1,0,1]=4 5303 B14R1.6708 CC(Cl)(NCC)C(=O)c1ccccc1 Amb24104241 [0,2,0,0,0,0|0,0,2]=4 5304 B14R1.6708 CC(c1ccccc1)C(C)(C)NC=O Amb24469227 [0,2,0,0,0,0|1,0,1]=4 5305 B14R1.6708 C\C=C\C(C)(O)C(Cl)c1ccccc1 Amb25216153 [0,2,0,0,0,0|2,0,0]=4 5306 B14R1.391 CNC(=NN)C(OC)c1ccccc1 Amb19079445 [0,2,0,0,0,0|1,0,1]=4 5307 B14R1.391 CSC(SC)C(=NO)c1ccccc1 Amb22460634 [0,2,0,0,0,0|1,0,1]=4 5308 B14R1.1017 CC(C(N(C)C)C#N)c1ccccc1 Amb17234592 [0,2,0,0,0,0|1,0,1]=4 5309 B14R1.1017 CC(C)C(C#N)C(O)c1ccccc1 Amb25763948 [0,2,0,0,0,0|1,0,1]=4 5310 B14R1.1017 CC(C)C(NC)C(=O)c1ccccc1 Amb18564926 [0,2,0,0,0,0|0,0,2]=4 5311 B14R1.1017 CC(C)[C@@H](C#C)[C@@H](O)c1ccccc1 Amb25220646 [0,2,0,0,0,0|1,0,1]=4 5312 B14R1.1017 CC(C)[C@H](C#C)[C@@H](O)c1ccccc1 Amb25813914 [0,2,0,0,0,0|1,0,1]=4 5313 B14R1.1017 CCC(C(O)c1ccccc1)C(O)=O Amb19022377 [0,2,0,0,0,0|1,0,1]=4 5314 B14R1.1017 CN(C)C(C#N)C(O)c1ccccc1 Amb24688261 [0,2,0,0,0,0|0,0,1]=3 5315 B14R1.1022 CNC(C#C)C(C)(C)c1ccccc1 Amb25772021 [0,2,0,0,0,0|1,0,1]=4 5316 B14R1.1022 CN[C@H](C#N)C(C)(C)c1ccccc1 Amb25806172 [0,2,0,0,0,0|1,0,1]=4 5317 B14R1.2883 CCC(C)(C#N)C(O)c1c[n]ccc1 Amb25693934 [0,2,0,0,0,0|2,0,0]=4 5318 B14R1.2883 COP(=O)(OC)C(O)c1ccccc1 Amb22461397 [0,2,0,0,0,0|2,0,0]=4 5319 B14R1.2883 CO[C@@](C)(C#C)[C@@H](O)c1ccccc1 Amb24748477 [0,2,0,0,0,0|1,0,0]=3 5320 B14R1.3624 CCC(C#N)C(O)c1ccccc1Cl Amb25255152 [0,2,0,0,0,0|1,0,1]=4 5321 B14R1.243 CC(C(O)c1ccccc1C)C(C)=O Amb25750420 [0,2,0,0,0,0|1,0,0]=3 5322 B14R1.243 CC(C)C(C)C(N)c1ccccc1Br Amb24391135 [0,2,0,0,0,0|2,0,0]=4 5323 B14R1.243 CC(C)C(C)C(N)c1ccccc1Cl Amb25105328 [0,2,0,0,0,0|2,0,0]=4 5324 B14R1.243 CC(C)C(C)C(N)c1ccccc1I Amb24504510 [0,2,0,0,0,0|2,0,0]=4 5325 B14R1.243 CC(C)C(C)C(O)c1[n]cccc1Cl Amb25287287 [0,2,0,0,0,0|2,0,0]=4 5326 B14R1.243 CC(C)C(C)C(O)c1ccccc1Br Amb24501552 [0,2,0,0,0,0|1,0,0]=3 5327 B14R1.243 CC(C)C(C)C(O)c1ccccc1F Amb25728655 [0,2,0,0,0,0|1,0,0]=3 5328 B14R1.243 CC(C)C(C)C(O)c1ccccc1I Amb25109488 [0,2,0,0,0,0|1,0,0]=3 5329 B14R1.243 CC(C)C(C)C(O)c1ccccc1N Amb25054136 [0,2,0,0,0,0|1,0,0]=3 5330 B14R1.243 CC(C)C(N)C(O)c1ccccc1Br Amb18586770 [0,2,0,0,0,0|2,0,0]=4 5331 B14R1.243 CC(C)C(N)C(O)c1ccccc1Cl Amb18569649 [0,2,0,0,0,0|2,0,0]=4 5332 B14R1.243 CC(C)C(N)C(O)c1ccccc1F Amb18565953 [0,2,0,0,0,0|2,0,0]=4 5333 B14R1.243 CC(C)C(O)C(O)c1ccccc1F Amb24701911 [0,2,0,0,0,0|2,0,0]=4 5334 B14R1.243 CC(C)[C@@H](N)[C@@H](O)c1ccccc1Br Amb24711955 [0,2,0,0,0,0|2,0,0]=4 5335 B14R1.243 CC(C)[C@@H](N)[C@@H](O)c1ccccc1O Amb24598971 [0,2,0,0,0,0|2,0,0]=4 5336 B14R1.243 CC(C)[C@@H](N)[C@H](O)c1ccccc1Cl Amb25327917 [0,2,0,0,0,0|2,0,0]=4 5337 B14R1.243 CC(C)[C@@H](N)[C@H](O)c1ccccc1O Amb25245413 [0,2,0,0,0,0|2,0,0]=4 5338 B14R1.243 CC(C)[C@H](N)[C@@H](O)c1ccccc1N Amb24542658 [0,2,0,0,0,0|2,0,0]=4 5339 B14R1.243 CC(C)[C@H](N)[C@@H](O)c1ccccc1O Amb25238498 [0,2,0,0,0,0|2,0,0]=4 5340 B14R1.243 CC(C)[C@H](N)[C@H](O)c1ccccc1Br Amb25242707 [0,2,0,0,0,0|2,0,0]=4 5341 B14R1.243 CC(C)[C@H](N)[C@H](O)c1ccccc1O Amb25322593 [0,2,0,0,0,0|2,0,0]=4 5342 B14R1.243 CN(C)C(=O)C(O)c1ccccc1Br Amb25754296 [0,2,0,0,0,0|1,0,1]=4 5343 B14R1.243 CN(C)C(=O)C(O)c1ccccc1F Amb25220155 [0,2,0,0,0,0|1,0,1]=4 5344 B14R1.243 Cc1[n]cccc1C(O)C(C)C(C)C Amb24501630 [0,2,0,0,0,0|2,0,0]=4 5345 B14R1.243 Cc1ccc[n]c1C(O)C(C)C(C)C Amb24501603 [0,2,0,0,0,0|2,0,0]=4 5346 B14R1.243 Cc1ccccc1C(=O)C(C)N(C)C Amb22831910 [0,2,0,0,0,0|0,0,2]=4 5347 B14R1.243 Cc1ccccc1C(O)C(=O)N(C)C Amb24359091 [0,2,0,0,0,0|1,0,1]=4 5348 B14R1.243 Cc1ccccc1C(O)C(C)C(C)C Amb25342982 [0,2,0,0,0,0|1,0,0]=3 5349 B14R1.243 Cc1ccccc1C(O)C(N)C(C)C Amb18565325 [0,2,0,0,0,0|2,0,0]=4 5350 B14R1.1027 CC(C)C(C)C(C#N)c1ccccc1 Amb25287304 [0,2,0,0,0,0|2,0,0]=4 5351 B14R1.1027 CN(C)N(C)C(CN)c1ccccc1 Amb18065028 [0,2,0,0,0,0|2,0,0]=4 5352 B14R1.1027 COC(C(=O)N(C)C)c1ccccc1 Amb15751548 [0,2,0,0,0,0|1,0,1]=4 5353 B14R1.1027 [C-]#[N+]C(C(C)C(C)O)c1ccccc1 Amb24474138 [0,2,0,0,0,0|2,0,0]=4 5354 B14R1.6306 CC(C(O)=O)C(C)(O)c1ccccc1 Amb18990602 [0,2,0,0,0,0|2,0,0]=4 5355 B14R1.6306 CC(C)C(C)C(C)(N)c1ccccc1 Amb25101866 [0,2,0,0,0,0|2,0,0]=4 5356 B14R1.6306 CC(C)C(C)C(C)(O)c1cccc[n]1 Amb24501569 [0,2,0,0,0,0|2,0,0]=4 5357 B14R1.6306 CC(O)(C(C)C(N)=O)c1ccccc1 Amb25114161 [0,2,0,0,0,0|2,0,0]=4 5358 B14R1.6306 C[C@@H](C(O)=O)[C@](C)(O)c1ccccc1 Amb25164442 [0,2,0,0,0,0|2,0,0]=4 5359 B14R1.6306 C[C@@H]([C@@H](C)O)C(C)(C)c1ccccc1 Amb25796370 [0,2,0,0,0,0|2,0,0]=4 5360 B14R1.6391 CC(=C)C(C)(O)C(O)c1ccccc1 Amb24430960 [0,2,0,0,0,0|1,0,0]=3 5361 B14R1.6391 CC(=C)C(F)(F)C(O)c1ccccc1 Amb24534909 [0,2,0,0,0,0|2,0,0]=4 5362 B14R1.6391 CC(=O)C(C)(N)C(O)c1ccccc1 Amb25339242 [0,2,0,0,0,0|1,0,0]=3 5363 B14R1.6391 CC(=O)C(C)(O)C(O)c1ccccc1 Amb24474267 [0,2,0,0,0,0|1,0,0]=3 5364 B14R1.6391 CC(C)(C(O)c1ccccc1)[N+]([O-])=O Amb24192781 [0,2,0,0,0,0|1,0,1]=4 5365 B14R1.6391 CC(C)[C@@](C)(O)[C@@H](O)c1ccccc1 Amb25357633 [0,2,0,0,0,0|1,0,0]=3 5366 B14R1.6391 CC(Cl)(C(O)c1ccccc1)C(O)=O Amb24574677 [0,2,0,0,0,0|2,0,0]=4 5367 B14R1.6391 CC(N)(C(O)c1ccccc1)C(N)=O Amb25069472 [0,2,0,0,0,0|2,0,0]=4 5368 B14R1.6391 CC(O)(C(O)c1ccccc1)C(N)=O Amb25067866 [0,2,0,0,0,0|2,0,0]=4 5369 B14R1.6391 CC(O)C(C)(C)C(O)c1ccccc1 Amb25065471 [0,2,0,0,0,0|1,0,0]=3 5370 B14R1.6391 CC(c1ccccc1)C(C)(C)C(C)O Amb25192739 [0,2,0,0,0,0|2,0,0]=4 5371 B14R1.6391 CN(C)C(C)(C)C(O)c1c[n]c[n]c1 Amb24409301 [0,2,0,0,0,0|2,0,0]=4 5372 B14R1.6391 CN(C)C(C)(C)C(O)c1c[n]cc[n]1 Amb24698573 [0,2,0,0,0,0|2,0,0]=4 5373 B14R1.6391 CN(C)C(C)(C)C(O)c1c[n]ccc1 Amb24427043 [0,2,0,0,0,0|1,0,0]=3 5374 B14R1.6391 C[C@@](O)([C@@H](O)c1ccccc1)C(N)=O Amb25766627 [0,2,0,0,0,0|2,0,0]=4 5375 B14R1.6391 C[C@](N)([C@@H](O)c1ccccc1)C(N)=O Amb25764494 [0,2,0,0,0,0|2,0,0]=4 5376 B14R1.6391 C[C@](N)([C@H](O)c1ccccc1)C(O)=O Amb25279530 [0,2,0,0,0,0|2,0,0]=4 5377 B14R1.10526 CC(C(Br)c1ccccc1)C(C)(F)F Amb25728592 [0,2,0,0,0,0|2,0,0]=4 5378 B14R1.10526 CC(C(Br)c1ccccc1)S(C)(=O)=O Amb24681913 [0,2,0,0,0,0|2,0,0]=4 5379 B14R1.10526 CC(C(Cl)c1ccccc1)S(C)(=O)=O Amb25789096 [0,2,0,0,0,0|2,0,0]=4 5380 B14R1.10526 CC(C(N)c1ccccc1)C(C)(C)C Amb24560695 [0,2,0,0,0,0|2,0,0]=4 5381 B14R1.10526 CC(C(N)c1ccccc1)C(C)(F)F Amb25342644 [0,2,0,0,0,0|2,0,0]=4 5382 B14R1.10526 CC(C(N)c1ccccc1)S(C)(=O)=O Amb18997173 [0,2,0,0,0,0|2,0,0]=4 5383 B14R1.10526 CC(C(O)c1c[n]ccc1)C(C)(C)C Amb25841951 [0,2,0,0,0,0|2,0,0]=4 5384 B14R1.10526 CC(C(O)c1c[n]ccc1)S(C)(=O)=O Amb25133444 [0,2,0,0,0,0|2,0,0]=4 5385 B14R1.10526 CC(C(O)c1ccccc1)C(C)(C)O Amb25051463 [0,2,0,0,0,0|1,0,0]=3 5386 B14R1.10526 CC(C(O)c1ccccc1)S(C)(=O)=O Amb23510650 [0,2,0,0,0,0|1,0,0]=3 5387 B14R1.10526 CC(C(O)c1ccccc1)[N+](C)(C)C Amb22455077 [0,2,0,0,0,0|0,0,1]=3 5388 B14R1.10526 CC(C)(C)C(N)C(O)c1ccccc1 Amb25856900 [0,2,0,0,0,0|2,0,0]=4 5389 B14R1.10526 CC(C)(C)[C@H](O)[C@@H](O)c1ccccc1 Amb24457843 [0,2,0,0,0,0|2,0,0]=4 5390 B14R1.10526 CC(C)(C)[C@H](O)[C@H](O)c1ccccc1 Amb25750565 [0,2,0,0,0,0|2,0,0]=4 5391 B14R1.10526 CS(=O)(=O)C(Br)C(O)c1ccccc1 Amb23510560 [0,2,0,0,0,0|2,0,0]=4 5392 B14R1.10526 CS(=O)(=O)C(Cl)C(O)c1ccccc1 Amb23510517 [0,2,0,0,0,0|2,0,0]=4 5393 B14R1.10526 CS(=O)(=O)C(I)C(O)c1ccccc1 Amb23510604 [0,2,0,0,0,0|2,0,0]=4 5394 B14R1.10526 C[C@@H]([C@@H](O)c1ccccc1)C(C)(C)C Amb25296355 [0,2,0,0,0,0|1,0,0]=3 5395 B14R1.10526 C[C@@H]([C@H](O)c1ccccc1)[N+](C)(C)C Amb22366802 [0,2,0,0,0,0|0,0,1]=3 5396 B14R1.10526 C[C@H]([C@@H](O)c1ccccc1)C(C)(C)C Amb25345140 [0,2,0,0,0,0|1,0,0]=3 5397 B14R1.10526 C[C@H]([C@H](O)c1ccccc1)C(C)(C)C Amb25332331 [0,2,0,0,0,0|1,0,0]=3 5398 B14R1.10526 C[C@H]([C@H](O)c1ccccc1)C(C)(C)O Amb25687891 [0,2,0,0,0,0|1,0,0]=3 5399 B14R1.91 CC(C)(OC)C(C)(O)c1c[n]ccc1 Amb24711059 [0,2,0,0,0,0|2,0,0]=4 5400 B14R1.91 CCC(C)(N)P(O)(=O)c1ccccc1 Amb25785612 [0,2,0,0,0,0|2,0,0]=4 5401 B14R1.91 CNC(C)(C)C(C)(C)c1ccccc1 Amb25701754 [0,2,0,0,0,0|1,0,0]=3 5402 B14R1.91 C[C@@](O)(c1ccccc1)[C@](C)(O)CN Amb25742496 [0,2,0,0,0,0|2,0,0]=4 5403 B14R1.91 N#CC(C(c1ccccc1)(O)C)(C)C Amb1812249 [0,2,0,0,0,0|2,0,0]=4 5404 B14R1.2903 CC(C)(NO)\C(=N\O)\c1ccccc1 Amb22282262 [0,2,0,0,0,0|1,0,1]=4 5405 B14R1.2903 ONC(\C(=N\O)\c1ccccc1)(C)C Amb1004702 [0,2,0,0,0,0|1,0,1]=4 5406 B14R1.2903 ONC(\C(=[NH+]/O)\c1ccccc1)(C)C Amb2226897 [0,2,0,0,0,0|1,0,1]=4 5407 B14R1.5665 CC(C)(C#N)C(O)c1ccccc1F Amb25331720 [0,2,0,0,0,0|2,0,0]=4 5408 B14R1.5665 CC(C)(C=C)C(O)c1ccccc1O Amb25272960 [0,2,0,0,0,0|1,0,1]=4 5409 B14R1.5665 CC(C)(CC)C(O)c1ccccc1Cl Amb25167169 [0,2,0,0,0,0|1,0,0]=3 5410 B14R1.5665 CC(C)(CN)C(O)c1ccccc1Cl Amb18914856 [0,2,0,0,0,0|2,0,0]=4 5411 B14R1.5665 CC(C)(CN)C(O)c1ccccc1F Amb18911120 [0,2,0,0,0,0|2,0,0]=4 5412 B14R1.5665 CC(C)(CN)C(O)c1ccccc1O Amb24556401 [0,2,0,0,0,0|2,0,0]=4 5413 B14R1.5665 CC(C)(CO)C(O)c1ccccc1Br Amb25705021 [0,2,0,0,0,0|2,0,0]=4 5414 B14R1.5665 CC(C)(CO)[C@@H](O)c1ccccc1Br Amb25329817 [0,2,0,0,0,0|2,0,0]=4 5415 B14R1.5665 CC(C)(CO)[C@@H](O)c1ccccc1Cl Amb24046276 [0,2,0,0,0,0|2,0,0]=4 5416 B14R1.5665 CC(C)(NC)C(F)c1ccc[n]c1N Amb24407784 [0,2,0,0,0,0|2,0,0]=4 5417 B14R1.5665 CC(C)(NC)C(F)c1ccccc1Cl Amb25065693 [0,2,0,0,0,0|1,0,0]=3 5418 B14R1.5665 CC(C)(NC)C(O)c1cc[n]cc1F Amb25819552 [0,2,0,0,0,0|1,0,0]=3 5419 B14R1.5665 CC(C)(NC)C(O)c1ccc[n]c1N Amb25821482 [0,2,0,0,0,0|1,0,0]=3 5420 B14R1.5665 CC(C)(NC)C(O)c1ccccc1F Amb24581910 [0,2,0,0,0,0|0,0,0]=2 5421 B14R1.5665 CC(C)(OC)C(N)c1ccccc1F Amb25696236 [0,2,0,0,0,0|2,0,0]=4 5422 B14R1.5665 CC(C)(OC)C(O)c1ccccc1Cl Amb24455093 [0,2,0,0,0,0|1,0,0]=3 5423 B14R1.5665 CC(C)(SC)C(N)c1ccccc1Cl Amb25172389 [0,2,0,0,0,0|2,0,0]=4 5424 B14R1.5665 CC(C)(SC)C(O)c1c[n]ccc1N Amb25132606 [0,2,0,0,0,0|2,0,0]=4 5425 B14R1.5665 CC(C)(SC)C(O)c1cc[n]cc1F Amb25265947 [0,2,0,0,0,0|2,0,0]=4 5426 B14R1.5665 CC(C)(SC)C(O)c1ccccc1Cl Amb25125780 [0,2,0,0,0,0|1,0,0]=3 5427 B14R1.5665 CC(O)(CC)C(O)c1cc[n]cc1F Amb24556921 [0,2,0,0,0,0|2,0,0]=4 5428 B14R1.5665 CC(O)(CC)C(O)c1ccc[n]c1N Amb24402131 [0,2,0,0,0,0|2,0,0]=4 5429 B14R1.5665 CC(O)(CC)C(O)c1ccccc1Cl Amb25353476 [0,2,0,0,0,0|1,0,0]=3 5430 B14R1.5665 CNC(C)(C)C(F)c1cc[n]cc1F Amb25115307 [0,2,0,0,0,0|2,0,0]=4 5431 B14R1.5665 Cc1cc[n]cc1C(F)C(C)(C)NC Amb25788484 [0,2,0,0,0,0|2,0,0]=4 5432 B14R1.5665 Cc1cc[n]cc1C(O)C(C)(C)CC Amb25342959 [0,2,0,0,0,0|2,0,0]=4 5433 B14R1.5665 Cc1ccccc1C(N)C(C)(C)CC Amb24444047 [0,2,0,0,0,0|2,0,0]=4 5434 B14R1.5665 Cc1ccccc1C(N)C(C)(C)OC Amb25078113 [0,2,0,0,0,0|2,0,0]=4 5435 B14R1.5665 Cc1ccccc1C(N)C(C)(C)SC Amb25344090 [0,2,0,0,0,0|2,0,0]=4 5436 B14R1.5665 Cc1ccccc1C(O)C(C)(C)C#N Amb24535285 [0,2,0,0,0,0|2,0,0]=4 5437 B14R1.5665 Cc1ccccc1C(O)C(C)(C)CN Amb18910515 [0,2,0,0,0,0|2,0,0]=4 5438 B14R1.5665 Cc1ccccc1C(O)C(C)(C)NC Amb25832936 [0,2,0,0,0,0|0,0,0]=2 5439 B14R1.5665 Cc1ccccc1C(O)C(C)(O)CC Amb25692025 [0,2,0,0,0,0|1,0,0]=3 5440 B14R1.2982 CCC(O)(C(=O)NC)c1ccccc1 Amb24741758 [0,2,0,0,0,0|1,0,1]=4 5441 B14R1.2982 CCC(O)(C(C)C#N)c1ccccc1 Amb25771388 [0,2,0,0,0,0|2,0,0]=4 5442 B14R1.2982 COC(C(c1ccccc1)(C#N)C)C Amb17594920 [0,2,0,0,0,0|2,0,0]=4 5443 B14R1.2984 CCC(C)C(C(O)=O)c1ccccc1 Amb17943573 [0,2,0,0,0,0|1,0,0]=3 5444 B14R1.2984 CN(CC)C(C(O)=O)c1ccccc1 Amb19373061 [0,2,0,0,0,0|2,0,0]=4 5445 B14R1.2984 CNC(=S)C(C(O)=O)c1ccccc1 Amb24375767 [0,2,0,0,0,0|1,0,1]=4 5446 B14R1.7706 CC(CC)C(C#N)c1ccccc1Br Amb25772028 [0,2,0,0,0,0|2,0,0]=4 5447 B14R1.7706 CC(CC)C(C#N)c1ccccc1F Amb25376595 [0,2,0,0,0,0|2,0,0]=4 5448 B14R1.7706 Cc1ccccc1C(C#N)C(C)CC Amb24382217 [0,2,0,0,0,0|2,0,0]=4 5449 B14R1.95 CC(C#N)C(O)c1ccccc1OC Amb25726636 [0,2,0,0,0,0|2,0,0]=4 5450 B14R1.95 CC(CC)[C@@H](N)c1ccccc1C#N Amb24550269 [0,2,0,0,0,0|2,0,0]=4 5451 B14R1.95 CC(CC)[C@H](N)c1ccccc1C#N Amb25249292 [0,2,0,0,0,0|2,0,0]=4 5452 B14R1.95 CNC(C(=O)c1ccccc1OC)C Amb17313591 [0,2,0,0,0,0|0,0,2]=4 5453 B14R1.95 CNc1ccccc1C(C)C(C)OC Amb25726952 [0,2,0,0,0,0|2,0,0]=4 5454 B14R1.95 CNc1ccccc1[C@H](C)[C@@H](C)OC Amb25804181 [0,2,0,0,0,0|2,0,0]=4 5455 B14R1.2908 CC(N)(C(C)CC)c1ccccc1F Amb19081013 [0,2,0,0,0,0|2,0,0]=4 5456 B14R1.2908 CC(O)(C(C)CC)c1ccccc1Br Amb24380452 [0,2,0,0,0,0|1,0,0]=3 5457 B14R1.2908 CC(O)(C(C)CC)c1ccccc1F Amb19081843 [0,2,0,0,0,0|1,0,0]=3 5458 B14R1.2908 CC(O)(C(C)CN)c1ccccc1Cl Amb25776745 [0,2,0,0,0,0|2,0,0]=4 5459 B14R1.2908 CC(O)(C(C)CN)c1ccccc1F Amb25082290 [0,2,0,0,0,0|2,0,0]=4 5460 B14R1.2908 CC(O)(C(C)OC)c1ccc[n]c1N Amb24665452 [0,2,0,0,0,0|2,0,0]=4 5461 B14R1.2908 CC(O)(C(C)OC)c1ccccc1Cl Amb25291384 [0,2,0,0,0,0|1,0,0]=3 5462 B14R1.2908 Cc1cc[n]cc1C(C)(O)C(C)OC Amb24365715 [0,2,0,0,0,0|2,0,0]=4 5463 B14R1.2908 Cc1ccccc1C(C)(N)C(C)CC Amb19050352 [0,2,0,0,0,0|2,0,0]=4 5464 B14R1.2908 Cc1ccccc1C(C)(O)C(C)CC Amb19050750 [0,2,0,0,0,0|1,0,0]=3 5465 B14R1.8657 CC(C#N)C(O)c1c(F)cccc1Br Amb24726761 [0,2,0,0,0,0|2,0,0]=4 5466 B14R1.8657 CC(C#N)C(O)c1c(F)cccc1F Amb25085878 [0,2,0,0,0,0|2,0,0]=4 5467 B14R1.8657 CC(CC)C(Cl)c1c(Br)cccc1Cl Amb25844808 [0,2,0,0,0,0|2,0,0]=4 5468 B14R1.8657 CC(CC)C(Cl)c1c(F)cccc1F Amb24363844 [0,2,0,0,0,0|2,0,0]=4 5469 B14R1.8657 CC(CC)C(N)c1c(C)cccc1C Amb25813162 [0,2,0,0,0,0|2,0,0]=4 5470 B14R1.8657 CC(CC)C(N)c1c(Cl)cccc1Cl Amb25842022 [0,2,0,0,0,0|2,0,0]=4 5471 B14R1.8657 CC(CC)C(N)c1c(F)cccc1Br Amb25856635 [0,2,0,0,0,0|2,0,0]=4 5472 B14R1.8657 CC(CC)C(N)c1c(F)cccc1F Amb25263688 [0,2,0,0,0,0|2,0,0]=4 5473 B14R1.8657 CC(CC)C(O)c1c(Cl)cccc1Br Amb24654239 [0,2,0,0,0,0|1,0,0]=3 5474 B14R1.8657 CC(CC)C(O)c1c(Cl)cccc1Cl Amb25312739 [0,2,0,0,0,0|1,0,0]=3 5475 B14R1.8657 CC(CC)[C@@H](N)c1c(C)cccc1C Amb24697941 [0,2,0,0,0,0|2,0,0]=4 5476 B14R1.8657 CC(CC)[C@@H](N)c1c(Cl)cccc1Cl Amb25249239 [0,2,0,0,0,0|2,0,0]=4 5477 B14R1.8657 CC(CC)[C@@H](N)c1c(F)cccc1Br Amb24612059 [0,2,0,0,0,0|2,0,0]=4 5478 B14R1.8657 CC(CC)[C@@H](N)c1c(F)cccc1Cl Amb24694451 [0,2,0,0,0,0|2,0,0]=4 5479 B14R1.8657 CC(CN)C(O)c1c(C)cccc1C Amb24361529 [0,2,0,0,0,0|2,0,0]=4 5480 B14R1.8657 CC(CN)C(O)c1c(Cl)cccc1Br Amb25666627 [0,2,0,0,0,0|2,0,0]=4 5481 B14R1.8657 CC(CN)C(O)c1c(F)cccc1Br Amb24745096 [0,2,0,0,0,0|2,0,0]=4 5482 B14R1.8657 CC(CN)C(O)c1c(F)cccc1Cl Amb25756371 [0,2,0,0,0,0|2,0,0]=4 5483 B14R1.8657 CC(OC)C(O)c1c(F)cccc1F Amb24437171 [0,2,0,0,0,0|1,0,0]=3 5484 B14R1.8657 CCC(N)C(O)c1c(C)cccc1C Amb24554675 [0,2,0,0,0,0|2,0,0]=4 5485 B14R1.8657 CCC(N)C(O)c1c(F)cccc1Cl Amb19149265 [0,2,0,0,0,0|2,0,0]=4 5486 B14R1.8657 CCC(N)C(O)c1c(F)cccc1F Amb19149128 [0,2,0,0,0,0|2,0,0]=4 5487 B14R1.8657 CCC(O)C(O)c1c(F)cccc1Cl Amb25078491 [0,2,0,0,0,0|2,0,0]=4 5488 B14R1.8657 CC[C@@H](N)[C@@H](O)c1c(F)cccc1F Amb24542620 [0,2,0,0,0,0|2,0,0]=4 5489 B14R1.8657 CC[C@H](N)[C@H](O)c1c(Cl)cccc1Cl Amb25200332 [0,2,0,0,0,0|2,0,0]=4 5490 B14R1.8657 CC[C@H](N)[C@H](O)c1c(F)cccc1F Amb24612218 [0,2,0,0,0,0|2,0,0]=4 5491 B14R1.8657 CC[C@H](N)[C@H](O)c1c(O)cccc1O Amb24542655 [0,2,0,0,0,0|2,0,0]=4 5492 B14R1.8657 CNC(C)C(C)c1c(Cl)cccc1Cl Amb24539082 [0,2,0,0,0,0|1,0,0]=3 5493 B14R1.8657 Cc1cccc(Br)c1C(O)C(C)CC Amb24500934 [0,2,0,0,0,0|1,0,0]=3 5494 B14R1.8657 Cc1cccc(Cl)c1[C@@H](N)C(C)CC Amb25222689 [0,2,0,0,0,0|2,0,0]=4 5495 B14R1.8657 Cc1cccc(Cl)c1[C@H](O)[C@H](N)CC Amb25339718 [0,2,0,0,0,0|2,0,0]=4 5496 B14R1.8657 Cc1cccc(F)c1C(O)C(N)CC Amb24563542 [0,2,0,0,0,0|2,0,0]=4 5497 B14R1.8657 Cc1cccc(F)c1[C@@H](O)[C@H](N)CC Amb25280832 [0,2,0,0,0,0|2,0,0]=4 5498 B14R1.8657 Cc1cccc(F)c1[C@H](O)[C@@H](N)CC Amb25288566 [0,2,0,0,0,0|2,0,0]=4 5499 B14R1.8657 Cc1cccc(F)c1[C@H](O)[C@H](N)CC Amb24558804 [0,2,0,0,0,0|2,0,0]=4 5500 B12R1.77 CNC(C)c1ccccc1C=C Amb24694177 [0,0,1,1,0,0|1,0,1]=4 5501 B12R1.77 CN[C@@H](C)c1[n]cccc1C=C Amb24378219 [0,0,1,1,0,0|1,0,1]=4 5502 B12R1.77 CN[C@@H](C)c1ccccc1C=C Amb25132659 [0,0,1,1,0,0|1,0,1]=4 5503 B12R1.435 CNC(C)c1cccc(C=C)[n]1 Amb24730587 [0,0,1,1,0,0|1,0,1]=4 5504 B12R1.435 CNC(C)c1cccc(C=C)c1 Amb24729645 [0,0,1,1,0,0|1,0,1]=4 5505 B12R1.435 CN[C@@H](C)c1cccc(C=C)[n]1 Amb24683767 [0,0,1,1,0,0|1,0,1]=4 5506 B12R1.435 CN[C@@H](C)c1cccc(C=C)c1 Amb25189383 [0,0,1,1,0,0|1,0,1]=4 5507 B12R1.435 CN[C@H](C)c1cccc(C=C)c1 Amb25751436 [0,0,1,1,0,0|1,0,1]=4 5508 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [1,0,0,1,0,0|1,0,1]=4 5509 B12R2.2 C1CCC(O1)c2cccc[n]2 Amb24729132 [1,0,0,1,0,0|2,0,0]=4 5510 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [1,0,0,1,0,0|1,1,0]=4 5511 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [1,0,0,1,0,0|2,0,0]=4 5512 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [1,0,0,1,0,0|2,0,0]=4 5513 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [1,0,0,1,0,0|2,0,0]=4 5514 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [1,0,0,1,0,0|2,0,0]=4 5515 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [1,0,0,1,0,0|1,0,0]=3 5516 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [1,0,0,1,0,0|2,0,0]=4 5517 B12R2.2 C1NC(CO1)c2ccccc2 Amb25258799 [1,0,0,1,0,0|2,0,0]=4 5518 B12R2.2 C1NC(CS1)c2ccccc2 Amb24460745 [1,0,0,1,0,0|2,0,0]=4 5519 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [1,0,0,1,0,0|1,0,0]=3 5520 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [1,0,0,1,0,0|1,0,0]=3 5521 B12R2.2 C1NCC(C1)c2ccccn2 Amb10808435 [1,0,0,1,0,0|2,0,0]=4 5522 B12R2.2 C1NCC(C1)c2ccncc2 Amb10576618 [1,0,0,1,0,0|2,0,0]=4 5523 B12R2.2 C1NCC(O1)c2c[n]ccc2 Amb18065317 [1,0,0,1,0,0|1,0,0]=3 5524 B12R2.2 C1NCC(O1)c2cc[n]cc2 Amb18065319 [1,0,0,1,0,0|1,0,0]=3 5525 B12R2.2 C1NCC(O1)c2cccc[n]2 Amb18065316 [1,0,0,1,0,0|1,0,0]=3 5526 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [1,0,0,1,0,0|0,0,0]=2 5527 B12R2.2 C1NCC=C1c2ccccc2 Amb22059494 [1,0,0,1,0,0|1,0,1]=4 5528 B12R2.2 C1NCCC1c2c[n]ccc2 Amb19958035 [1,0,0,1,0,0|2,0,0]=4 5529 B12R2.2 C1NCCC1c2c[n]ccc2 Amb22490712 [1,0,0,1,0,0|2,0,0]=4 5530 B12R2.2 C1NCCC1c2cc[n]cc2 Amb22233781 [1,0,0,1,0,0|2,0,0]=4 5531 B12R2.2 C1NCC[C@@H]1c2c[n]ccc2 Amb24673743 [1,0,0,1,0,0|2,0,0]=4 5532 B12R2.2 C1NCC[C@@H]1c2cc[n]cc2 Amb24487080 [1,0,0,1,0,0|2,0,0]=4 5533 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [1,0,0,1,0,0|1,0,0]=3 5534 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [1,0,0,1,0,0|1,0,0]=3 5535 B12R2.2 C1NCC[C@H]1c2c[n]ccc2 Amb24085651 [1,0,0,1,0,0|2,0,0]=4 5536 B12R2.2 C1NCC[C@H]1c2cc[n]cc2 Amb25716776 [1,0,0,1,0,0|2,0,0]=4 5537 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [1,0,0,1,0,0|1,0,0]=3 5538 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [1,0,0,1,0,0|2,0,0]=4 5539 B12R2.2 C1OCOC1c2cc[n]cc2 Amb24102637 [1,0,0,1,0,0|2,0,0]=4 5540 B12R2.2 C1OCOC1c2cccc[n]2 Amb24069912 [1,0,0,1,0,0|2,0,0]=4 5541 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [1,0,0,1,0,0|1,0,0]=3 5542 B12R2.27 BrCC1OC1c2ccccc2 Amb25695964 [1,0,0,1,0,0|2,0,0]=4 5543 B12R2.27 BrC[C@@H]1O[C@@H]1c2ccccc2 Amb24540282 [1,0,0,1,0,0|2,0,0]=4 5544 B12R2.27 BrC[C@H]1O[C@@H]1c2ccccc2 Amb25287176 [1,0,0,1,0,0|2,0,0]=4 5545 B12R2.27 C=CC1OC1c2ccccc2 Amb24624086 [1,0,0,1,0,0|1,0,1]=4 5546 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [1,0,0,1,0,0|1,0,0]=3 5547 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [1,0,0,1,0,0|1,0,0]=3 5548 B12R2.27 COC1OC1c2ccccc2 Amb24613179 [1,0,0,1,0,0|1,0,0]=3 5549 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [1,0,0,1,0,0|2,0,0]=4 5550 B12R2.27 ClCC1OC1c2ccccc2 Amb25169273 [1,0,0,1,0,0|2,0,0]=4 5551 B12R2.27 ClC[C@H]1O[C@@H]1c2ccccc2 Amb24568308 [1,0,0,1,0,0|2,0,0]=4 5552 B12R2.27 ClC[C@H]1O[C@H]1c2ccccc2 Amb24562256 [1,0,0,1,0,0|2,0,0]=4 5553 B12R2.27 N#CC1OC1c2ccccc2 Amb17593640 [1,0,0,1,0,0|2,0,0]=4 5554 B12R2.27 NCC1OC1c2ccccc2 Amb25836323 [1,0,0,1,0,0|2,0,0]=4 5555 B12R2.27 NNC1CC1c2ccccc2 Amb25244653 [1,0,0,1,0,0|2,0,0]=4 5556 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [1,0,0,1,0,0|2,0,0]=4 5557 B12R2.27 OCC1OC1c2ccccc2 Amb24063567 [1,0,0,1,0,0|2,0,0]=4 5558 B12R2.27 OC[C@H]1O[C@@H]1c2ccccc2 Amb20242388 [1,0,0,1,0,0|2,0,0]=4 5559 B12R2.116 CC1(CNC1)c2ccccc2 Amb18065223 [1,0,0,1,0,0|1,0,0]=3 5560 B12R2.116 CC1(CNC1)c2ccccc2 Amb22549211 [1,0,0,1,0,0|1,0,0]=3 5561 B12R2.116 CC1(COC1)c2ccccc2 Amb22497353 [1,0,0,1,0,0|2,0,0]=4 5562 B12R2.116 FC1(CNC1)c2c[n]ccc2 Amb25151802 [1,0,0,1,0,0|2,0,0]=4 5563 B12R2.116 FC1(COC1)c2ccccc2 Amb22738854 [1,0,0,1,0,0|2,0,0]=4 5564 B12R2.116 NC1(CCC1)c2ccccc2 Amb2371533 [1,0,0,1,0,0|2,0,0]=4 5565 B12R2.116 NC1(CNC1)c2ccccc2 Amb24120649 [1,0,0,1,0,0|1,0,0]=3 5566 B12R2.116 NC1(COC1)c2ccccc2 Amb19892665 [1,0,0,1,0,0|2,0,0]=4 5567 B12R2.116 NC1(COC1)c2ccccc2 Amb22386882 [1,0,0,1,0,0|2,0,0]=4 5568 B12R2.116 OC1(CCC1)c2c[n]ccc2 Amb25123095 [1,0,0,1,0,0|2,0,0]=4 5569 B12R2.116 OC1(CCC1)c2ccccc2 Amb20668463 [1,0,0,1,0,0|1,0,0]=3 5570 B12R2.116 OC1(CNC1)c2c[n]c[n]c2 Amb25756768 [1,0,0,1,0,0|2,0,0]=4 5571 B12R2.116 OC1(CNC1)c2c[n]cc[n]2 Amb25791772 [1,0,0,1,0,0|2,0,0]=4 5572 B12R2.116 OC1(CNC1)c2cccc[n]2 Amb24486814 [1,0,0,1,0,0|1,0,0]=3 5573 B12R2.116 OC1(CNC1)c2ccccc2 Amb22406135 [1,0,0,1,0,0|0,0,0]=2 5574 B12R2.116 OC1(CNC1)c2ccccc2 Amb22496452 [1,0,0,1,0,0|0,0,0]=2 5575 B12R2.116 OC1(COC1)c2c[n]ccc2 Amb22737297 [1,0,0,1,0,0|2,0,0]=4 5576 B12R2.116 OC1(COC1)c2cc[n]cc2 Amb22897030 [1,0,0,1,0,0|2,0,0]=4 5577 B12R2.116 OC1(COC1)c2cccc[n]2 Amb22897031 [1,0,0,1,0,0|2,0,0]=4 5578 B12R2.116 OC1(COC1)c2ccccc2 Amb21960821 [1,0,0,1,0,0|1,0,0]=3 5579 B12R2.116 OC1(CSC1)c2ccccc2 Amb22386890 [1,0,0,1,0,0|1,0,0]=3 5580 B12R2.235 CC1CC1(O)c2c[n]ccc2 Amb24653327 [1,0,0,1,0,0|2,0,0]=4 5581 B12R2.235 CC1CC1(O)c2cccc[n]2 Amb25149270 [1,0,0,1,0,0|2,0,0]=4 5582 B12R2.235 C[C@@H]1C[C@@]1(O)c2cccc[n]2 Amb25163570 [1,0,0,1,0,0|2,0,0]=4 5583 B12R2.235 C[C@@H]1C[C@]1(O)c2cccc[n]2 Amb25044984 [1,0,0,1,0,0|2,0,0]=4 5584 B12R2.235 C[C@H]1C[C@]1(O)c2cccc[n]2 Amb24515105 [1,0,0,1,0,0|2,0,0]=4 5585 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [1,0,0,1,0,0|1,0,0]=3 5586 B12R2.931 NNCC1Cc2ccccc21 Amb25149107 [1,0,0,1,0,0|2,0,0]=4 5587 B12R2.1081 BrC1COCc2ccccc21 Amb25095651 [1,0,0,1,0,0|2,0,0]=4 5588 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [1,0,0,1,0,0|2,0,0]=4 5589 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [1,0,0,1,0,0|1,0,0]=3 5590 B12R2.1081 CC1CNCc2ccc[n]c21 Amb18124939 [1,0,0,1,0,0|2,0,0]=4 5591 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [1,0,0,1,0,0|1,0,0]=3 5592 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [1,0,0,1,0,0|2,0,0]=4 5593 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [1,0,0,1,0,0|1,0,0]=3 5594 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [1,0,0,1,0,0|1,0,0]=3 5595 B12R2.1081 ClC1COCc2ccccc21 Amb22490656 [1,0,0,1,0,0|2,0,0]=4 5596 B12R2.1081 FC1CNCc2c1cccc2 Amb10841578 [1,0,0,1,0,0|1,0,0]=3 5597 B12R2.1081 FC1COCc2ccccc21 Amb25768367 [1,0,0,1,0,0|2,0,0]=4 5598 B12R2.1081 NC1CCCc2c1cccc2 Amb1154594 [1,0,0,1,0,0|2,0,0]=4 5599 B12R2.1081 NC1CCCc2ccccc21 Amb24273096 [1,0,0,1,0,0|2,0,0]=4 5600 B12R2.1081 NC1CNCc2ccccc21 Amb19929632 [1,0,0,1,0,0|1,0,0]=3 5601 B12R2.1081 NC1CNCc2ccccc21 Amb22494720 [1,0,0,1,0,0|1,0,0]=3 5602 B12R2.1081 NC1CNCc2ccccc21 Amb22494721 [1,0,0,1,0,0|1,0,0]=3 5603 B12R2.1081 NC1COCc2c1cccc2 Amb10067658 [1,0,0,1,0,0|2,0,0]=4 5604 B12R2.1081 NC1COCc2ccccc21 Amb18202067 [1,0,0,1,0,0|2,0,0]=4 5605 B12R2.1081 NC1CSCc2c1cccc2 Amb10067686 [1,0,0,1,0,0|2,0,0]=4 5606 B12R2.1081 N[C@@H]1CCCc2c1cccc2 Amb10844952 [1,0,0,1,0,0|2,0,0]=4 5607 B12R2.1081 N[C@@H]1CCCc2ccccc21 Amb22167169 [1,0,0,1,0,0|2,0,0]=4 5608 B12R2.1081 N[C@H]1CCCc2ccccc21 Amb19929634 [1,0,0,1,0,0|2,0,0]=4 5609 B12R2.1081 O=C1CNCc2ccccc21 Amb22494722 [1,0,0,1,0,0|0,0,2]=4 5610 B12R2.1081 OC1CC=Cc2ccccc21 Amb25122696 [1,0,0,1,0,0|1,0,1]=4 5611 B12R2.1081 OC1CCCc2c1cccc2 Amb1151324 [1,0,0,1,0,0|1,0,0]=3 5612 B12R2.1081 OC1CCCc2c[n]ccc21 Amb23399822 [1,0,0,1,0,0|2,0,0]=4 5613 B12R2.1081 OC1CCCc2cc[n]cc21 Amb24070835 [1,0,0,1,0,0|2,0,0]=4 5614 B12R2.1081 OC1CCCc2cccnc12 Amb17935812 [1,0,0,1,0,0|2,0,0]=4 5615 B12R2.1081 OC1CCNc2c1cccc2 Amb10553386 [1,0,0,1,0,0|2,0,0]=4 5616 B12R2.1081 OC1CCNc2ccccc21 Amb22276045 [1,0,0,1,0,0|2,0,0]=4 5617 B12R2.1081 OC1CCNc2ccccc21 Amb22497677 [1,0,0,1,0,0|2,0,0]=4 5618 B12R2.1081 OC1CNCc2[n]c[n]cc21 Amb18201680 [1,0,0,1,0,0|2,0,0]=4 5619 B12R2.1081 OC1CNCc2[n]cccc21 Amb18201914 [1,0,0,1,0,0|1,0,0]=3 5620 B12R2.1081 OC1CNCc2c1cccc2 Amb16233378 [1,0,0,1,0,0|0,0,0]=2 5621 B12R2.1081 OC1CNCc2ccccc21 Amb22587041 [1,0,0,1,0,0|0,0,0]=2 5622 B12R2.1081 OC1COCc2ccccc21 Amb20171360 [1,0,0,1,0,0|1,0,0]=3 5623 B12R2.1081 ON1CCCc2ccccc12 Amb24085481 [1,0,0,1,0,0|2,0,0]=4 5624 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [1,0,0,1,0,0|1,0,1]=4 5625 B12R2.1081 O[C@@H]1CCCc2cc[n]cc21 Amb25357624 [1,0,0,1,0,0|2,0,0]=4 5626 B12R2.1081 O[C@@H]1CCCc2ccc[n]c21 Amb24062853 [1,0,0,1,0,0|2,0,0]=4 5627 B12R2.1081 O[C@@H]1CCCc2ccccc21 Amb22337827 [1,0,0,1,0,0|1,0,0]=3 5628 B12R2.1081 O[C@@H]1CCSc2c1cccc2 Amb13952924 [1,0,0,1,0,0|2,0,0]=4 5629 B12R2.1081 O[C@@H]1CNCc2ccccc21 Amb24746212 [1,0,0,1,0,0|0,0,0]=2 5630 B12R2.1081 O[C@@H]1COCc2ccccc21 Amb22748516 [1,0,0,1,0,0|1,0,0]=3 5631 B12R2.1081 O[C@H]1CCCc2[n]cccc21 Amb24386952 [1,0,0,1,0,0|2,0,0]=4 5632 B12R2.1081 O[C@H]1CCCc2cc[n]cc21 Amb24340473 [1,0,0,1,0,0|2,0,0]=4 5633 B12R2.1081 O[C@H]1CCCc2ccc[n]c21 Amb24083650 [1,0,0,1,0,0|2,0,0]=4 5634 B12R2.1081 O[C@H]1CCCc2ccccc21 Amb22336192 [1,0,0,1,0,0|1,0,0]=3 5635 B12R2.1081 O[C@H]1CCSc2c1cccc2 Amb13952926 [1,0,0,1,0,0|2,0,0]=4 5636 B12R2.1081 O[C@H]1CNCc2ccccc21 Amb24533225 [1,0,0,1,0,0|0,0,0]=2 5637 B12R2.1081 O[C@H]1COCc2ccccc21 Amb25748982 [1,0,0,1,0,0|1,0,0]=3 5638 B12R2.1081 [NH3+]C1CCCc2ccccc21 Amb24113843 [1,0,0,1,0,0|2,0,0]=4 5639 B12R2.2028 C=C1C[C@@H](O)c2ccccc21 Amb25149657 [1,0,0,1,0,0|1,0,1]=4 5640 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [1,0,0,1,0,0|1,0,1]=4 5641 B12R2.2028 CC1CC(Br)c2ccccc21 Amb25131825 [1,0,0,1,0,0|2,0,0]=4 5642 B12R2.2028 CC1CC(N)c2ccccc21 Amb19373084 [1,0,0,1,0,0|2,0,0]=4 5643 B12R2.2028 CC1CC(O)c2cc[n]cc21 Amb25129412 [1,0,0,1,0,0|2,0,0]=4 5644 B12R2.2028 CC1CC(O)c2ccccc21 Amb25709313 [1,0,0,1,0,0|1,0,0]=3 5645 B12R2.2028 CC1CC(S)c2ccccc21 Amb24465175 [1,0,0,1,0,0|1,1,0]=4 5646 B12R2.2028 CC1CN(N)c2ccccc21 Amb24519067 [1,0,0,1,0,0|2,0,0]=4 5647 B12R2.2028 CN1CC(O)c2ccccc12 Amb24632103 [1,0,0,1,0,0|0,0,0]=2 5648 B12R2.2028 CN1CN(C)c2ccccc12 Amb24092822 [1,0,0,1,0,0|2,0,0]=4 5649 B12R2.2028 C[C@@H]1CC(O)c2ccccc21 Amb25188702 [1,0,0,1,0,0|1,0,0]=3 5650 B12R2.2028 C[C@@H]1C[C@@H](O)c2cc[n]cc21 Amb25102087 [1,0,0,1,0,0|2,0,0]=4 5651 B12R2.2028 C[C@@H]1C[C@H](Br)c2ccccc21 Amb24741831 [1,0,0,1,0,0|2,0,0]=4 5652 B12R2.2028 C[C@@H]1C[C@H](O)c2cc[n]cc21 Amb24694361 [1,0,0,1,0,0|2,0,0]=4 5653 B12R2.2028 C[C@H]1CC(O)c2ccccc21 Amb24533800 [1,0,0,1,0,0|1,0,0]=3 5654 B12R2.2028 C[C@H]1C[C@@H](O)c2cc[n]cc21 Amb24601331 [1,0,0,1,0,0|2,0,0]=4 5655 B12R2.2028 C[C@H]1C[C@@H](O)c2ccccc21 Amb24740911 [1,0,0,1,0,0|1,0,0]=3 5656 B12R2.2028 C[n]1cc(O)c2ccccc12 Amb24069283 [1,0,0,1,0,0|0,0,2]=4 5657 B12R2.2028 N[C@@H]1CC(O)c2ccccc21 Amb25317541 [1,0,0,1,0,0|2,0,0]=4 5658 B12R2.2028 N[C@@H]1C[C@@H](O)c2ccccc21 Amb25213011 [1,0,0,1,0,0|2,0,0]=4 5659 B12R2.2028 N[C@@H]1C[C@H](O)c2ccccc21 Amb24657326 [1,0,0,1,0,0|2,0,0]=4 5660 B12R2.2028 N[C@H]1CC(O)c2ccccc21 Amb25716664 [1,0,0,1,0,0|2,0,0]=4 5661 B12R2.2028 OC1CC(c2c1cccc2)N Amb17470387 [1,0,0,1,0,0|2,0,0]=4 5662 B12R2.2028 OC1CC(c2c1cccc2)O Amb1110942 [1,0,0,1,0,0|2,0,0]=4 5663 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [1,0,0,1,0,0|2,0,0]=4 5664 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [1,0,0,1,0,0|2,0,0]=4 5665 B12R2.2028 O[C@H]1C[C@@H](O)c2ccccc12 Amb17938072 [1,0,0,1,0,0|2,0,0]=4 5666 B12R2.2028 O[C@H]1C[C@@H](c2c1cccc2)O Amb10068281 [1,0,0,1,0,0|2,0,0]=4 5667 B12R2.2075 BrC(C1CC1)c2ccccc2 Amb25205179 [1,0,0,1,0,0|2,0,0]=4 5668 B12R2.2075 ClC(C1CC1)c2ccccc2 Amb18792883 [1,0,0,1,0,0|2,0,0]=4 5669 B12R2.2075 FC(C1CO1)c2ccccc2 Amb24611783 [1,0,0,1,0,0|2,0,0]=4 5670 B12R2.2075 NC(c1ccccc1)C2CC2 Amb2371625 [1,0,0,1,0,0|2,0,0]=4 5671 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22406367 [1,0,0,1,0,0|2,0,0]=4 5672 B12R2.2075 N[C@@H](C1CC1)c2ccccc2 Amb22744981 [1,0,0,1,0,0|2,0,0]=4 5673 B12R2.2075 N[C@H](C1CC1)c2ccccc2 Amb22406366 [1,0,0,1,0,0|2,0,0]=4 5674 B12R2.2075 OC(C1CC1)c2cc[n]cc2 Amb24486009 [1,0,0,1,0,0|2,0,0]=4 5675 B12R2.2075 OC(C1CC1)c2ccc[n]c2 Amb22497231 [1,0,0,1,0,0|2,0,0]=4 5676 B12R2.2075 O[C@@H](C1CC1)c2cc[n]cc2 Amb25149640 [1,0,0,1,0,0|2,0,0]=4 5677 B12R2.2075 O[C@@H](C1CC1)c2cccc[n]2 Amb25296893 [1,0,0,1,0,0|2,0,0]=4 5678 B12R2.2075 O[C@@H]([C@H]1CO1)c2ccccc2 Amb24700386 [1,0,0,1,0,0|1,0,0]=3 5679 B12R2.2075 O[C@H](C1CC1)c2cc[n]cc2 Amb24705928 [1,0,0,1,0,0|2,0,0]=4 5680 B12R2.2075 O[C@H](C1CC1)c2cccc[n]2 Amb25205476 [1,0,0,1,0,0|2,0,0]=4 5681 B12R2.2075 O[C@H](C1CC1)c2ccccc2 Amb25260486 [1,0,0,1,0,0|1,0,0]=3 5682 B12R2.2075 O[C@H]([C@@H]1CO1)c2ccccc2 Amb24718405 [1,0,0,1,0,0|1,0,0]=3 5683 B12R2.2075 SC(C1CC1)c2ccccc2 Amb18788326 [1,0,0,1,0,0|1,1,0]=4 5684 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [1,0,0,1,0,0|0,0,2]=4 5685 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [1,0,0,1,0,0|0,0,2]=4 5686 B12R2.18 CC1C(C)Nc2c1cccc2 Amb17593676 [1,0,0,1,0,0|1,0,0]=3 5687 B12R2.18 CC1C(N)Cc2ccccc21 Amb18124847 [1,0,0,1,0,0|1,0,0]=3 5688 B12R2.18 CC1C(O)Cc2ccccc21 Amb20622729 [1,0,0,1,0,0|2,0,0]=4 5689 B12R2.18 CC1Cc2ccccc2C1Br Amb25106421 [1,0,0,1,0,0|1,0,0]=3 5690 B12R2.18 CC1Cc2ccccc2C1Cl Amb18183547 [1,0,0,1,0,0|1,0,0]=3 5691 B12R2.18 CC1Cc2ccccc2C1N Amb19373701 [1,0,0,1,0,0|1,0,0]=3 5692 B12R2.18 CC1Cc2ccccc2N1N Amb24065299 [1,0,0,1,0,0|2,0,0]=4 5693 B12R2.18 CC1Nc2ccccc2N1Cl Amb25095932 [1,0,0,1,0,0|2,0,0]=4 5694 B12R2.18 CC1Oc2[n]cccc2C1O Amb22372218 [1,0,0,1,0,0|2,0,0]=4 5695 B12R2.18 CC1Oc2ccccc2C1N Amb18943788 [1,0,0,1,0,0|2,0,0]=4 5696 B12R2.18 CC1Oc2ccccc2C1O Amb24572207 [1,0,0,1,0,0|1,0,0]=3 5697 B12R2.18 CC1Sc2ccccc2C1N Amb18278067 [1,0,0,1,0,0|2,0,0]=4 5698 B12R2.18 CC1c2ccccc2CN1N Amb25255493 [1,0,0,1,0,0|2,0,0]=4 5699 B12R2.18 CN1[C@H](C)Cc2ccccc12 Amb24068204 [1,0,0,1,0,0|2,0,0]=4 5700 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [1,0,0,1,0,0|0,0,2]=4 5701 B12R2.18 C[C@@H]1Cc2ccccc2[C@@H]1N Amb24578752 [1,0,0,1,0,0|1,0,0]=3 5702 B12R2.18 C[C@@H]1Oc2ccccc2[C@@H]1O Amb25344981 [1,0,0,1,0,0|1,0,0]=3 5703 B12R2.18 C[C@@H]1[C@@H](O)Cc2ccccc21 Amb25176418 [1,0,0,1,0,0|2,0,0]=4 5704 B12R2.18 C[C@@H]1[C@H](O)Cc2ccccc21 Amb24546023 [1,0,0,1,0,0|2,0,0]=4 5705 B12R2.18 C[C@H]1Nc2ccccc2[C@@H]1O Amb24629727 [1,0,0,1,0,0|0,0,0]=2 5706 B12R2.18 C[C@H]1[C@@H](N)Cc2ccccc21 Amb24562844 [1,0,0,1,0,0|1,0,0]=3 5707 B12R2.18 ClC1Cc2ccccc2C1Cl Amb25770688 [1,0,0,1,0,0|2,0,0]=4 5708 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@@H]1Cl Amb25366590 [1,0,0,1,0,0|2,0,0]=4 5709 B12R2.18 Cl[C@@H]1Cc2ccccc2[C@H]1Cl Amb25242520 [1,0,0,1,0,0|2,0,0]=4 5710 B12R2.18 FC1C(Br)Cc2ccccc21 Amb25857057 [1,0,0,1,0,0|2,0,0]=4 5711 B12R2.18 NC1C(C)Cc2c1cccc2 Amb17232033 [1,0,0,1,0,0|1,0,0]=3 5712 B12R2.18 NC1C(F)Cc2ccccc21 Amb24459876 [1,0,0,1,0,0|2,0,0]=4 5713 B12R2.18 NC1C(N)Cc2c1cccc2 Amb13953204 [1,0,0,1,0,0|1,0,0]=3 5714 B12R2.18 NC1C(O)Nc2ccccc21 Amb25722216 [1,0,0,1,0,0|2,0,0]=4 5715 B12R2.18 NC1Cc2[n]cccc2C1O Amb25364253 [1,0,0,1,0,0|1,0,0]=3 5716 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [1,0,0,1,0,0|0,0,2]=4 5717 B12R2.18 NC1Cc2ccccc2C1F Amb24655749 [1,0,0,1,0,0|1,0,0]=3 5718 B12R2.18 NC1Cc2ccccc2C1O Amb20623676 [1,0,0,1,0,0|0,0,0]=2 5719 B12R2.18 NC1[C@H](O)Cc2ccccc21 Amb24401902 [1,0,0,1,0,0|2,0,0]=4 5720 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [1,0,0,1,0,0|0,0,2]=4 5721 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [1,0,0,1,0,0|0,0,2]=4 5722 B12R2.18 N[C@@H]1Cc2ccccc2C1O Amb25209005 [1,0,0,1,0,0|0,0,0]=2 5723 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1N Amb22745804 [1,0,0,1,0,0|1,0,0]=3 5724 B12R2.18 N[C@@H]1Cc2ccccc2[C@@H]1O Amb24501357 [1,0,0,1,0,0|0,0,0]=2 5725 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1N Amb22748292 [1,0,0,1,0,0|1,0,0]=3 5726 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb22388538 [1,0,0,1,0,0|0,0,0]=2 5727 B12R2.18 N[C@@H]1Cc2ccccc2[C@H]1O Amb25379044 [1,0,0,1,0,0|0,0,0]=2 5728 B12R2.18 N[C@@H]1[C@@H](Cl)Cc2ccccc21 Amb24519208 [1,0,0,1,0,0|2,0,0]=4 5729 B12R2.18 N[C@@H]1[C@@H](F)Cc2ccccc21 Amb25252184 [1,0,0,1,0,0|2,0,0]=4 5730 B12R2.18 N[C@@H]1[C@@H](O)Cc2c1cccc2 Amb10842191 [1,0,0,1,0,0|2,0,0]=4 5731 B12R2.18 N[C@@H]1[C@H](Cl)Cc2ccccc21 Amb24641556 [1,0,0,1,0,0|2,0,0]=4 5732 B12R2.18 N[C@@H]1[C@H](O)Cc2ccccc12 Amb17779311 [1,0,0,1,0,0|2,0,0]=4 5733 B12R2.18 N[C@H]1C(O)Cc2ccccc21 Amb24427360 [1,0,0,1,0,0|2,0,0]=4 5734 B12R2.18 N[C@H]1Cc2ccccc2[C@@H]1N Amb24624674 [1,0,0,1,0,0|1,0,0]=3 5735 B12R2.18 N[C@H]1Cc2ccccc2[C@H]1O Amb24540566 [1,0,0,1,0,0|0,0,0]=2 5736 B12R2.18 N[C@H]1[C@H](O)Cc2c1cccc2 Amb10842210 [1,0,0,1,0,0|2,0,0]=4 5737 B12R2.18 O=C1C(C)Nc2c1cccc2 Amb17593674 [1,0,0,1,0,0|0,0,2]=4 5738 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [1,0,0,1,0,0|0,0,2]=4 5739 B12R2.18 OC1C(Br)Cc2c1cccc2 Amb1159074 [1,0,0,1,0,0|1,0,0]=3 5740 B12R2.18 OC1C(F)Cc2ccccc21 Amb24423988 [1,0,0,1,0,0|1,0,0]=3 5741 B12R2.18 OC1C(N)Cc2c1cccc2 Amb2383051 [1,0,0,1,0,0|0,0,0]=2 5742 B12R2.18 OC1C(O)C[n+]2ccccc21 Amb25739707 [1,0,0,1,0,0|2,0,0]=4 5743 B12R2.18 OC1Cc2ccccc2C1Br Amb25785578 [1,0,0,1,0,0|2,0,0]=4 5744 B12R2.18 OC1Cc2ccccc2C1F Amb24672733 [1,0,0,1,0,0|2,0,0]=4 5745 B12R2.18 OC1Cc2ccccc2C1O Amb24323306 [1,0,0,1,0,0|1,0,0]=3 5746 B12R2.18 OC1Cc2ccccc2C1S Amb24430077 [1,0,0,1,0,0|1,1,0]=4 5747 B12R2.18 OC1Nc2ccccc2C1O Amb24090494 [1,0,0,1,0,0|1,0,0]=3 5748 B12R2.18 O[C@@H]1C(Br)Cc2ccccc21 Amb25061997 [1,0,0,1,0,0|1,0,0]=3 5749 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1Cl Amb24650956 [1,0,0,1,0,0|2,0,0]=4 5750 B12R2.18 O[C@@H]1Cc2ccccc2[C@@H]1O Amb22800784 [1,0,0,1,0,0|1,0,0]=3 5751 B12R2.18 O[C@@H]1Oc2ccccc2[C@H]1O Amb25284399 [1,0,0,1,0,0|2,0,0]=4 5752 B12R2.18 O[C@@H]1Sc2ccccc2[C@@H]1O Amb25215688 [1,0,0,1,0,0|2,0,0]=4 5753 B12R2.18 O[C@@H]1[C@@H](F)Cc2ccccc21 Amb25200299 [1,0,0,1,0,0|1,0,0]=3 5754 B12R2.18 O[C@@H]1[C@H](F)Cc2ccccc21 Amb25176954 [1,0,0,1,0,0|1,0,0]=3 5755 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [1,0,0,1,0,0|1,0,1]=4 5756 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1Br Amb24682797 [1,0,0,1,0,0|2,0,0]=4 5757 B12R2.18 O[C@H]1Cc2ccccc2[C@@H]1F Amb25240021 [1,0,0,1,0,0|2,0,0]=4 5758 B12R2.18 O[C@H]1Cc2ccccc2[C@H]1O Amb22230411 [1,0,0,1,0,0|1,0,0]=3 5759 B12R2.18 O[C@H]1Sc2ccccc2[C@H]1O Amb25256602 [1,0,0,1,0,0|2,0,0]=4 5760 B12R2.18 O[C@H]1[C@H](Cl)Cc2ccccc21 Amb24519428 [1,0,0,1,0,0|1,0,0]=3 5761 B12R2.18 O[C@H]1[C@H](O)Cc2c1cccc2 Amb10982589 [1,0,0,1,0,0|1,0,0]=3 5762 B12R2.18 [NH3+][C@@H]1Cc2ccccc2[C@H]1O Amb22224837 [1,0,0,1,0,0|0,0,1]=3 5763 B12R2.23 BrC1COC1c2ccccc2 Amb24484887 [1,0,0,1,0,0|1,0,0]=3 5764 B12R2.23 Br[C@@H]1CO[C@H]1c2ccccc2 Amb25198843 [1,0,0,1,0,0|1,0,0]=3 5765 B12R2.23 CC1CNC1c2ccccc2 Amb19338009 [1,0,0,1,0,0|1,0,0]=3 5766 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [1,0,0,1,0,0|1,0,0]=3 5767 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [1,0,0,1,0,0|1,0,0]=3 5768 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [1,0,0,1,0,0|1,0,0]=3 5769 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [1,0,0,1,0,0|1,0,0]=3 5770 B12R2.23 NC1CSC1c2ccccc2 Amb25076286 [1,0,0,1,0,0|0,1,0]=3 5771 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [1,0,0,1,0,0|1,0,0]=3 5772 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [1,0,0,1,0,0|1,0,1]=4 5773 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [1,0,0,1,0,0|2,0,0]=4 5774 B12R2.23 OC1CNC1c2ccccc2 Amb25680030 [1,0,0,1,0,0|2,0,0]=4 5775 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [1,0,0,1,0,0|2,0,0]=4 5776 B12R2.23 O[C@@H]1CS[C@H]1c2ccccc2 Amb25334761 [1,0,0,1,0,0|1,1,0]=4 5777 B12R2.23 O[C@H]1CS[C@H]1c2ccccc2 Amb25176781 [1,0,0,1,0,0|1,1,0]=4 5778 B12R2.92 CC1(C)CC1c2ccccc2 Amb22052702 [1,0,0,1,0,0|1,0,0]=3 5779 B12R2.92 CC1(C)N=C1c2ccccc2 Amb16226276 [1,0,0,1,0,0|1,0,1]=4 5780 B12R2.92 CC1(C)NC1c2ccccc2 Amb24056776 [1,0,0,1,0,0|1,0,0]=3 5781 B12R2.92 CC1(C)OC1c2cccc[n]2 Amb24070213 [1,0,0,1,0,0|1,0,0]=3 5782 B12R2.92 CC1(C)OC1c2ccccc2 Amb21964286 [1,0,0,1,0,0|0,0,0]=2 5783 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [1,0,0,1,0,0|1,0,0]=3 5784 B12R2.92 C[C@@]1(N)C[C@H]1c2ccccc2 Amb25378765 [1,0,0,1,0,0|1,0,0]=3 5785 B12R2.92 C[C@]1(N)C[C@@H]1c2ccccc2 Amb24613115 [1,0,0,1,0,0|1,0,0]=3 5786 B12R2.3190 CC(O)C1Cc2ccccc21 Amb24538275 [1,0,0,1,0,0|2,0,0]=4 5787 B12R2.3190 C[C@@H](N)C1Cc2ccccc21 Amb25047176 [1,0,0,1,0,0|1,0,0]=3 5788 B12R2.3190 C[C@@H](O)C1Cc2ccccc21 Amb25151401 [1,0,0,1,0,0|2,0,0]=4 5789 B12R2.3190 C[C@H](O)C1Cc2ccccc21 Amb25172779 [1,0,0,1,0,0|2,0,0]=4 5790 B12R2.11 Br[C@@H]1C[C@@H]1Cc2ccccc2 Amb25280103 [1,0,0,1,0,0|2,0,0]=4 5791 B12R2.11 CC1CC1Nc2ccccc2 Amb24743217 [1,0,0,1,0,0|2,0,0]=4 5792 B12R2.11 C[C@H]1C[C@@H]1Nc2ccccc2 Amb24581235 [1,0,0,1,0,0|2,0,0]=4 5793 B12R2.11 NC1CC1Cc2ccccc2 Amb18960797 [1,0,0,1,0,0|2,0,0]=4 5794 B12R2.11 NC1CC1Cc2ccccc2 Amb19375025 [1,0,0,1,0,0|2,0,0]=4 5795 B12R2.11 OC1CC1Cc2ccccc2 Amb25145316 [1,0,0,1,0,0|2,0,0]=4 5796 B12R2.11 O[C@H]1C[C@@H]1Cc2ccccc2 Amb25326057 [1,0,0,1,0,0|2,0,0]=4 5797 B12R2.24 BrC1CCc2c(C1)cccc2 Amb13952699 [1,0,0,1,0,0|2,0,0]=4 5798 B12R2.24 CC1CCc2c(N1)cccc2 Amb2525824 [1,0,0,1,0,0|2,0,0]=4 5799 B12R2.24 CC1CCc2ccccc2N1 Amb22499773 [1,0,0,1,0,0|2,0,0]=4 5800 B12R2.24 CC1CCc2ccccc2O1 Amb19515436 [1,0,0,1,0,0|2,0,0]=4 5801 B12R2.24 CC1CCc2ccccc2S1 Amb25706129 [1,0,0,1,0,0|2,0,0]=4 5802 B12R2.24 CC1Cc2[n]c[n]cc2CN1 Amb18202057 [1,0,0,1,0,0|2,0,0]=4 5803 B12R2.24 CC1Cc2[n]cccc2CC1 Amb25187438 [1,0,0,1,0,0|2,0,0]=4 5804 B12R2.24 CC1Cc2[n]cccc2CN1 Amb18124940 [1,0,0,1,0,0|1,0,0]=3 5805 B12R2.24 CC1Cc2cc[n]cc2CN1 Amb24685008 [1,0,0,1,0,0|1,0,0]=3 5806 B12R2.24 CC1Cc2ccccc2CN1 Amb22755434 [1,0,0,1,0,0|0,0,0]=2 5807 B12R2.24 CC1Cc2ccccc2N=C1 Amb24682970 [1,0,0,1,0,0|2,0,0]=4 5808 B12R2.24 CC1Cc2ccccc2NC1 Amb22501042 [1,0,0,1,0,0|2,0,0]=4 5809 B12R2.24 CC1Cc2ccccc2OC1 Amb25189640 [1,0,0,1,0,0|2,0,0]=4 5810 B12R2.24 CC1Nc2ccccc2CS1 Amb24373918 [1,0,0,1,0,0|2,0,0]=4 5811 B12R2.24 CN1CCc2c(C1)cccc2 Amb2581727 [1,0,0,1,0,0|2,0,0]=4 5812 B12R2.24 CN1Cc2ccccc2CC1 Amb22001820 [1,0,0,1,0,0|2,0,0]=4 5813 B12R2.24 C[C@@H]1CCc2ccccc2N1 Amb22751676 [1,0,0,1,0,0|2,0,0]=4 5814 B12R2.24 C[C@@H]1Cc2ccccc2C=N1 Amb22747779 [1,0,0,1,0,0|0,0,2]=4 5815 B12R2.24 C[C@@H]1Cc2ccccc2CN1 Amb22751934 [1,0,0,1,0,0|0,0,0]=2 5816 B12R2.24 C[C@H]1CCc2ccccc2N1 Amb25138125 [1,0,0,1,0,0|2,0,0]=4 5817 B12R2.24 C[C@H]1Cc2[n]cccc2CC1 Amb24068759 [1,0,0,1,0,0|2,0,0]=4 5818 B12R2.24 C[C@H]1Cc2ccccc2C=N1 Amb25056784 [1,0,0,1,0,0|0,0,2]=4 5819 B12R2.24 C[C@H]1Cc2ccccc2CN1 Amb24087372 [1,0,0,1,0,0|0,0,0]=2 5820 B12R2.24 ClC1CCc2ccccc2C1 Amb17672772 [1,0,0,1,0,0|2,0,0]=4 5821 B12R2.24 ClC1Cc2c[n]ccc2CN1 Amb24486562 [1,0,0,1,0,0|2,0,0]=4 5822 B12R2.24 ClC1Cc2ccccc2CO1 Amb25152704 [1,0,0,1,0,0|2,0,0]=4 5823 B12R2.24 IC1Cc2ccccc2CO1 Amb25811321 [1,0,0,1,0,0|2,0,0]=4 5824 B12R2.24 NC1CCc2c(C1)cccc2 Amb13952050 [1,0,0,1,0,0|2,0,0]=4 5825 B12R2.24 NC1CCc2c(C1)cccc2 Amb2383251 [1,0,0,1,0,0|2,0,0]=4 5826 B12R2.24 NC1Cc2ccccc2CO1 Amb24365192 [1,0,0,1,0,0|2,0,0]=4 5827 B12R2.24 N[C@H]1Cc2ccccc2CC1 Amb25113422 [1,0,0,1,0,0|2,0,0]=4 5828 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [1,0,0,1,0,0|2,0,0]=4 5829 B12R2.24 O[C@@H]1Cc2ccccc2CC1 Amb25149682 [1,0,0,1,0,0|2,0,0]=4 5830 B12R2.24 O[C@H]1Cc2ccccc2CC1 Amb25043599 [1,0,0,1,0,0|2,0,0]=4 5831 B12R2.24 S=C1Cc2ccccc2CN1 Amb24538124 [1,0,0,1,0,0|1,0,1]=4 5832 B12R2.24 SC1CCc2ccccc2C1 Amb17672773 [1,0,0,1,0,0|2,0,0]=4 5833 B12R2.32 BrCC1Cc2ccccc2C1 Amb22235471 [1,0,0,1,0,0|2,0,0]=4 5834 B12R2.32 C#CC1Cc2ccccc2C1 Amb24074759 [1,0,0,1,0,0|1,0,1]=4 5835 B12R2.32 CCN1Cc2ccccc2C1 Amb21870754 [1,0,0,1,0,0|2,0,0]=4 5836 B12R2.32 CNC1Cc2ccccc2C1 Amb21955693 [1,0,0,1,0,0|0,0,0]=2 5837 B12R2.32 COC1Cc2ccccc2O1 Amb24084536 [1,0,0,1,0,0|2,0,0]=4 5838 B12R2.32 CSC1Cc2ccccc2C1 Amb25712718 [1,0,0,1,0,0|1,0,0]=3 5839 B12R2.32 NCC1Cc2ccccc2C1 Amb19287049 [1,0,0,1,0,0|2,0,0]=4 5840 B12R2.32 NNC1Cc2c(C1)cccc2 Amb10071076 [1,0,0,1,0,0|1,0,0]=3 5841 B12R2.32 NNC1Cc2ccccc2C1 Amb19890159 [1,0,0,1,0,0|1,0,0]=3 5842 B12R2.32 NNC1Cc2ccccc2C1 Amb21954062 [1,0,0,1,0,0|1,0,0]=3 5843 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [1,0,0,1,0,0|2,0,0]=4 5844 B12R2.32 OCC1Cc2ccccc2C1 Amb19516120 [1,0,0,1,0,0|2,0,0]=4 5845 B12R2.37 CC1C(O)C1c2ccccc2 Amb24457875 [1,0,0,1,0,0|2,0,0]=4 5846 B12R2.37 C[C@@H]1C(c2ccccc2)[N@@]1C Amb23513697 [1,0,0,1,0,0|0,0,0]=2 5847 B12R2.37 C[C@@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25321015 [1,0,0,1,0,0|2,0,0]=4 5848 B12R2.37 C[C@@H]1[C@H](Cl)[C@H]1c2ccccc2 Amb24511894 [1,0,0,1,0,0|2,0,0]=4 5849 B12R2.37 C[C@H]1C(Cl)[C@@H]1c2ccccc2 Amb25173083 [1,0,0,1,0,0|2,0,0]=4 5850 B12R2.37 C[C@H]1[C@H](Cl)[C@@H]1c2ccccc2 Amb25320879 [1,0,0,1,0,0|2,0,0]=4 5851 B12R2.94 CC1(Cc2ccccc2)NN1 Amb24672487 [1,0,0,1,0,0|1,0,0]=3 5852 B12R2.94 NC1(Cc2ccccc2)CC1 Amb22587208 [1,0,0,1,0,0|2,0,0]=4 5853 B12R2.94 OC1(Cc2ccccc2)CC1 Amb19374431 [1,0,0,1,0,0|2,0,0]=4 5854 B12R2.2051 CC1(Cc2ccccc12)C=C Amb17778871 [1,0,0,1,0,0|1,0,1]=4 5855 B12R2.2058 B1CC(C1)Cc2ccccc2 Amb25243383 [1,0,0,1,0,0|2,0,0]=4 5856 B12R2.2058 C(C1CCN1)c2ccccc2 Amb20623701 [1,0,0,1,0,0|0,0,0]=2 5857 B12R2.2058 C1CC(C1)C[n+]2ccccc2 Amb10554487 [1,0,0,1,0,0|2,0,0]=4 5858 B12R2.2058 C1CC(C1)Sc2ccccc2 Amb10976023 [1,0,0,1,0,0|2,0,0]=4 5859 B12R2.2058 C1CCC1Nc2ccccc2 Amb18283820 [1,0,0,1,0,0|2,0,0]=4 5860 B12R2.2058 C1NCC1Cc2ccccc2 Amb19373673 [1,0,0,1,0,0|2,0,0]=4 5861 B12R2.2058 N1CC(C1)Cc2ccccc2 Amb1123190 [1,0,0,1,0,0|2,0,0]=4 5862 B12R2.10 CC1NCCC1c2ccco2 Amb18947165 [0,0,0,1,1,0|2,0,0]=4 5863 B12R2.10 CC1NCCC1c2cocc2 Amb25856069 [0,0,0,1,1,0|2,0,0]=4 5864 B12R2.102 CC1CC1C(O)c2ccc[s]2 Amb18180165 [0,0,0,1,1,0|2,0,0]=4 5865 B12R2.243 CC1CCC1(O)c2ccc[s]2 Amb24382905 [0,0,0,1,1,0|2,0,0]=4 5866 B12R2.302 CCC1CC1(O)c2ccc[s]2 Amb24357029 [0,0,0,1,1,0|2,0,0]=4 5867 B12R2.302 CCC1CC1(O)c2cocc2 Amb24559113 [0,0,0,1,1,0|2,0,0]=4 5868 B12R2.3797 OC(C1CCC1)c2c[s]cc2 Amb25709014 [0,0,0,1,1,0|2,0,0]=4 5869 B12R2.3797 OC(C1CCC1)c2ccco2 Amb23443586 [0,0,0,1,1,0|2,0,0]=4 5870 B12R2.3797 OC(c1cccs1)C2CCC2 Amb17194475 [0,0,0,1,1,0|2,0,0]=4 5871 B12R2.4379 CC1(CC1)C(O)c2c[nH]cc2 Amb25848444 [0,0,0,1,1,0|2,0,0]=4 5872 B12R2.4379 CC1(CC1)C(O)c2c[s]cc2 Amb24573554 [0,0,0,1,1,0|2,0,0]=4 5873 B12R2.4379 CC1(CC1)C(O)c2ccc[s]2 Amb24611713 [0,0,0,1,1,0|2,0,0]=4 5874 B14R2.8 CCC1COC(N1)c2cccc[n]2 Amb24365377 [0,0,0,1,0,1|2,0,0]=4 5875 B14R2.8 CC[C@@H]1COC(N1)c2ccccc2 Amb25702532 [0,0,0,1,0,1|1,0,0]=3 5876 B14R2.8 CC[C@@H]1CO[C@H](N1)c2ccccc2 Amb24559902 [0,0,0,1,0,1|1,0,0]=3 5877 B14R2.8 CC[C@H]1CO[C@H](N1)c2ccccc2 Amb24594932 [0,0,0,1,0,1|1,0,0]=3 5878 B14R2.8 CNC1CC(CC1)c2c[n]ccc2 Amb18065639 [0,0,0,1,0,1|2,0,0]=4 5879 B14R2.8 CNC1CC(CC1)c2ccccc2 Amb18065568 [0,0,0,1,0,1|1,0,0]=3 5880 B14R2.8 CNC1COC(=N1)c2ccccc2 Amb25210524 [0,0,0,1,0,1|0,0,1]=3 5881 B14R2.8 CN[C@@H]1C[C@@H](CN1)c2ccccc2 Amb24515116 [0,0,0,1,0,1|2,0,0]=4 5882 B14R2.8 COC1CCC(O1)c2ccccc2 Amb24572881 [0,0,0,1,0,1|2,0,0]=4 5883 B14R2.8 ClC[C@@H]1CO[C@H](O1)c2ccccc2 Amb24753016 [0,0,0,1,0,1|2,0,0]=4 5884 B14R2.8 ClC[C@H]1CO[C@@H](O1)c2ccccc2 Amb24651092 [0,0,0,1,0,1|2,0,0]=4 5885 B14R2.8 ClC[C@H]1CO[C@H](O1)c2ccccc2 Amb24753017 [0,0,0,1,0,1|2,0,0]=4 5886 B14R2.8 NCC1CC(OC1)c2ccccc2 Amb24652934 [0,0,0,1,0,1|2,0,0]=4 5887 B14R2.8 NCC1COC(O1)c2ccccc2 Amb17335291 [0,0,0,1,0,1|2,0,0]=4 5888 B14R2.8 O=C[C@@H]1COC(O1)c2ccccc2 Amb24416692 [0,0,0,1,0,1|2,0,0]=4 5889 B14R2.8 O=C[C@H]1COC(O1)c2ccccc2 Amb25857402 [0,0,0,1,0,1|2,0,0]=4 5890 B14R2.8 OCC1COC(O1)c2ccccc2 Amb17335395 [0,0,0,1,0,1|2,0,0]=4 5891 B14R2.8 OC[C@@H]1COC(O1)c2ccccc2 Amb25675575 [0,0,0,1,0,1|2,0,0]=4 5892 B14R2.8 OC[C@@H]1CO[C@H](O1)c2ccccc2 Amb25174836 [0,0,0,1,0,1|2,0,0]=4 5893 B14R2.8 OC[C@H]1CO[C@H](O1)c2ccccc2 Amb25176407 [0,0,0,1,0,1|2,0,0]=4 5894 B14R2.21 Br[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22898808 [0,0,0,1,0,1|2,0,0]=4 5895 B14R2.21 CC1CC(CCN1)c2ccccc2 Amb25765759 [0,0,0,1,0,1|1,0,0]=3 5896 B14R2.21 CC1CC(NCC1)c2ccccc2 Amb24066154 [0,0,0,1,0,1|2,0,0]=4 5897 B14R2.21 CC1CN(CCN1)c2ccccc2 Amb21954180 [0,0,0,1,0,1|2,0,0]=4 5898 B14R2.21 CC1NC(CCS1)c2ccccc2 Amb25766531 [0,0,0,1,0,1|2,0,0]=4 5899 B14R2.21 CC1NCCN(C1)c2ccccc2 Amb10603700 [0,0,0,1,0,1|2,0,0]=4 5900 B14R2.21 CC1NCCN(C1)c2ccccc2 Amb13948949 [0,0,0,1,0,1|2,0,0]=4 5901 B14R2.21 CC=1CC(OCC1)c2ccccc2 Amb24066155 [0,0,0,1,0,1|1,0,1]=4 5902 B14R2.21 C[C@@H]1CCC[C@@H](N1)c2ccccc2 Amb24710306 [0,0,0,1,0,1|2,0,0]=4 5903 B14R2.21 C[C@@H]1N[C@@H](CCS1)c2ccccc2 Amb24602392 [0,0,0,1,0,1|2,0,0]=4 5904 B14R2.21 C[C@H]1CCC[C@@H](N1)c2ccccc2 Amb25224330 [0,0,0,1,0,1|2,0,0]=4 5905 B14R2.21 C[C@H]1C[C@H](NCC1)c2ccccc2 Amb24436064 [0,0,0,1,0,1|2,0,0]=4 5906 B14R2.21 ClC1CC(OCC1)c2ccccc2 Amb25310870 [0,0,0,1,0,1|2,0,0]=4 5907 B14R2.21 N[C@@H]1C[C@@H](OCC1)c2ccccc2 Amb22747497 [0,0,0,1,0,1|2,0,0]=4 5908 B14R2.21 N[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22746393 [0,0,0,1,0,1|2,0,0]=4 5909 B14R2.21 N[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22747492 [0,0,0,1,0,1|2,0,0]=4 5910 B14R2.21 OC1CC(OCC1)c2ccccc2 Amb21962863 [0,0,0,1,0,1|2,0,0]=4 5911 B14R2.21 O[C@@H]1C[C@@H](OCC1)c2ccccc2 Amb22746392 [0,0,0,1,0,1|2,0,0]=4 5912 B14R2.21 O[C@@H]1C[C@H](OCC1)c2ccccc2 Amb22746390 [0,0,0,1,0,1|2,0,0]=4 5913 B14R2.21 O[C@H]1C[C@@H](OCC1)c2ccccc2 Amb24722718 [0,0,0,1,0,1|2,0,0]=4 5914 B14R2.21 O[C@H]1C[C@H](OCC1)c2ccccc2 Amb25685558 [0,0,0,1,0,1|2,0,0]=4 5915 B14R2.52 CC1CC(Br)c2ccccc2CC1 Amb25060376 [0,0,0,1,0,1|2,0,0]=4 5916 B14R2.52 CC1CC(Cl)c2ccccc2CC1 Amb18317919 [0,0,0,1,0,1|2,0,0]=4 5917 B14R2.52 CC1CC(N)c2ccccc2CC1 Amb18944007 [0,0,0,1,0,1|2,0,0]=4 5918 B14R2.52 CC1CC(O)c2ccccc2C=C1 Amb25065535 [0,0,0,1,0,1|1,0,1]=4 5919 B14R2.52 CC1CC(O)c2ccccc2CC1 Amb18178310 [0,0,0,1,0,1|1,0,0]=3 5920 B14R2.52 CC1CC(O)c2ccccc2CS1 Amb24352362 [0,0,0,1,0,1|1,0,0]=3 5921 B14R2.52 CC1C[C@@H](N)c2ccccc2CS1 Amb25858362 [0,0,0,1,0,1|2,0,0]=4 5922 B14R2.52 CC1C[C@H](O)c2ccccc2CS1 Amb25044152 [0,0,0,1,0,1|1,0,0]=3 5923 B14R2.52 CC1NCc2c(N(C1)C)cccc2 Amb17578284 [0,0,0,1,0,1|2,0,0]=4 5924 B14R2.52 CN1CC(O)c2ccccc2CC1 Amb25142465 [0,0,0,1,0,1|2,0,0]=4 5925 B14R2.260 CC1CC(OC1O)c2ccccc2 Amb25381394 [0,0,0,1,0,1|2,0,0]=4 5926 B14R2.260 C[C@@H]1NC(OC1=O)c2ccccc2 Amb25238712 [0,0,0,1,0,1|2,0,0]=4 5927 B14R2.260 C[C@@H]1O[C@@H](C[C@H]1O)c2ccccc2 Amb24564416 [0,0,0,1,0,1|2,0,0]=4 5928 B14R2.335 O[C@H]([C@H]1CNC1=O)c2ccccc2 Amb25302360 [0,0,0,1,0,1|1,0,1]=4 5929 B14R2.352 CC(NC1CC1C)c2ccccc2 Amb18183998 [0,0,0,1,0,1|2,0,0]=4 5930 B14R2.352 CC1OC1CC(O)c2ccccc2 Amb24448107 [0,0,0,1,0,1|2,0,0]=4 5931 B14R2.352 OC(CC1CC1O)c2ccccc2 Amb25051424 [0,0,0,1,0,1|2,0,0]=4 5932 B14R2.794 BrC(CC1CCC1)c2ccccc2 Amb25157292 [0,0,0,1,0,1|2,0,0]=4 5933 B14R2.794 CC(CC1CCN1)c2ccccc2 Amb25356580 [0,0,0,1,0,1|1,0,0]=3 5934 B14R2.794 CC(NC1CCC1)c2ccccc2 Amb18296782 [0,0,0,1,0,1|2,0,0]=4 5935 B14R2.794 CN(CC1CCN1)c2ccccc2 Amb24546480 [0,0,0,1,0,1|2,0,0]=4 5936 B14R2.794 O=C(CC1CCN1)c2ccccc2 Amb25212663 [0,0,0,1,0,1|0,0,2]=4 5937 B14R2.794 OC(CC1CCC1)c2c[n]ccc2 Amb25132625 [0,0,0,1,0,1|2,0,0]=4 5938 B14R2.794 OC(CC1CCC1)c2cccc[n]2 Amb25303693 [0,0,0,1,0,1|2,0,0]=4 5939 B14R2.794 OC(CC1CCC1)c2ccccc2 Amb25841391 [0,0,0,1,0,1|1,0,0]=3 5940 B14R2.794 OC(CC1CCN1)c2ccccc2 Amb24596087 [0,0,0,1,0,1|0,0,0]=2 5941 B14R2.794 O[C@@H](CN1CCC1)c2ccccc2 Amb25694951 [0,0,0,1,0,1|2,0,0]=4 5942 B14R2.958 CC(NC)C1CC1c2ccccc2 Amb25841242 [0,0,0,1,0,1|1,0,0]=3 5943 B14R2.958 CC(NC)[C@@H]1C[C@H]1c2ccccc2 Amb25371287 [0,0,0,1,0,1|1,0,0]=3 5944 B14R2.958 CCC(O)C1OC1c2ccccc2 Amb24495611 [0,0,0,1,0,1|2,0,0]=4 5945 B14R2.958 CC[C@@H](O)[C@H]1O[C@@H]1c2ccccc2 Amb24618736 [0,0,0,1,0,1|2,0,0]=4 5946 B14R2.958 CC[C@@H](O)[C@H]1O[C@H]1c2ccccc2 Amb24564407 [0,0,0,1,0,1|2,0,0]=4 5947 B14R2.958 CC[C@H](O)[C@@H]1O[C@@H]1c2ccccc2 Amb25349381 [0,0,0,1,0,1|2,0,0]=4 5948 B14R2.958 CC[C@H](O)[C@H]1O[C@H]1c2ccccc2 Amb25234680 [0,0,0,1,0,1|2,0,0]=4 5949 B14R2.958 CNC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25317578 [0,0,0,1,0,1|1,0,1]=4 5950 B14R2.1019 CCC1CC(Br)c2ccccc2C1 Amb25695686 [0,0,0,1,0,1|2,0,0]=4 5951 B14R2.1019 CCC1CC(Cl)c2ccccc2C1 Amb25351168 [0,0,0,1,0,1|2,0,0]=4 5952 B14R2.1019 CCC1CC(N)c2ccccc2C1 Amb25685827 [0,0,0,1,0,1|2,0,0]=4 5953 B14R2.1019 CCC1CC(O)c2ccccc2C1 Amb24743037 [0,0,0,1,0,1|1,0,0]=3 5954 B14R2.1019 CCC1CC(O)c2ccccc2N1 Amb25348395 [0,0,0,1,0,1|2,0,0]=4 5955 B14R2.1019 CCC1CC(O)c2ccccc2O1 Amb24745110 [0,0,0,1,0,1|2,0,0]=4 5956 B14R2.1019 CCC1C[C@@H](O)c2ccccc2O1 Amb25117712 [0,0,0,1,0,1|2,0,0]=4 5957 B14R2.1019 CCC1C[C@H](O)c2ccccc2O1 Amb25137713 [0,0,0,1,0,1|2,0,0]=4 5958 B14R2.1019 CCC1Cc2ccccc2C(O)O1 Amb24404772 [0,0,0,1,0,1|1,0,0]=3 5959 B14R2.1019 CC[C@@H]1C[C@H](O)c2ccccc2O1 Amb24725587 [0,0,0,1,0,1|2,0,0]=4 5960 B14R2.1019 CC[C@H]1C[C@@H](O)c2ccccc2O1 Amb24632593 [0,0,0,1,0,1|2,0,0]=4 5961 B14R2.1019 CNC1Cc2ccccc2N(C)C1 Amb24427608 [0,0,0,1,0,1|2,0,0]=4 5962 B14R2.1019 NCC1CC(O)c2c(C1)cccc2 Amb17470570 [0,0,0,1,0,1|2,0,0]=4 5963 B14R2.1019 OCC1CC(O)c2c(C1)cccc2 Amb17470583 [0,0,0,1,0,1|2,0,0]=4 5964 B14R2.1019 O[C@@H]1C[C@@H](Cc2ccccc21)CO Amb24519917 [0,0,0,1,0,1|2,0,0]=4 5965 B14R2.1161 C=CC1CC1C(O)c2ccccc2 Amb17934191 [0,0,0,1,0,1|1,0,1]=4 5966 B14R2.1161 C=C[C@H]1C[C@H]1[C@H](O)c2ccccc2 Amb25177098 [0,0,0,1,0,1|1,0,1]=4 5967 B14R2.1161 OC(C1CC1CO)c2ccccc2 Amb25069636 [0,0,0,1,0,1|2,0,0]=4 5968 B14R2.1161 OC([C@@H]1C[C@H]1CO)c2ccccc2 Amb24719653 [0,0,0,1,0,1|2,0,0]=4 5969 B14R2.2950 CC1CC(C)(CO1)c2ccccc2 Amb25324271 [0,0,0,1,0,1|2,0,0]=4 5970 B14R2.2950 CC1CC(N)(CC1)c2ccccc2 Amb25336116 [0,0,0,1,0,1|2,0,0]=4 5971 B14R2.2950 CC1CC(O)(CC1)c2c[n]ccc2 Amb24493793 [0,0,0,1,0,1|2,0,0]=4 5972 B14R2.2950 CC1CC(O)(CN1)c2ccccc2 Amb24441692 [0,0,0,1,0,1|0,0,0]=2 5973 B14R2.2950 CC1CC(O)(CS1)c2c[n]ccc2 Amb24434055 [0,0,0,1,0,1|2,0,0]=4 5974 B14R2.2950 CC1CC(O)(CS1)c2ccccc2 Amb24544473 [0,0,0,1,0,1|1,0,0]=3 5975 B14R2.2950 CN1CC(O)(CC1)c2ccccc2 Amb18790846 [0,0,0,1,0,1|2,0,0]=4 5976 B14R2.2950 C[C@@H]1CC(C)(CN1)c2ccccc2 Amb25774369 [0,0,0,1,0,1|1,0,0]=3 5977 B14R2.2950 C[C@H]1C[C@@](C)(CN1)c2ccccc2 Amb25223734 [0,0,0,1,0,1|1,0,0]=3 5978 B14R2.2950 NC1CC(O)(CC1)c2ccccc2 Amb22749709 [0,0,0,1,0,1|2,0,0]=4 5979 B14R2.2986 COC1CC(O)(C1)c2c[n]ccc2 Amb24495437 [0,0,0,1,0,1|2,0,0]=4 5980 B14R2.7724 CC1CC(=O)c2ccccc2N1C Amb25768566 [0,0,0,1,0,1|0,0,2]=4 5981 B14R2.7724 CC1CC(O)c2ccccc2C1O Amb24405902 [0,0,0,1,0,1|2,0,0]=4 5982 B14R2.9595 CC1(CC(Cl)c2ccccc2)CC1 Amb24658718 [0,0,0,1,0,1|2,0,0]=4 5983 B14R2.9595 CC1(CC(O)c2c[n]ccc2)CC1 Amb25229774 [0,0,0,1,0,1|2,0,0]=4 5984 B14R2.9595 CC1(CC(O)c2ccccc2)CC1 Amb24622914 [0,0,0,1,0,1|1,0,0]=3 5985 B14R2.9595 NC1(CC(O)c2ccccc2)CC1 Amb18195918 [0,0,0,1,0,1|2,0,0]=4 5986 B14R2.9595 OC(CC1(O)CC1)c2ccccc2 Amb24386892 [0,0,0,1,0,1|2,0,0]=4 5987 B14R2.17370 CC1(CC(O)c2ccccc12)C=C Amb24555553 [0,0,0,1,0,1|1,0,1]=4 5988 B14R2.17370 C[C@]1(C[C@H](O)c2ccccc12)C=C Amb24515233 [0,0,0,1,0,1|1,0,1]=4 5989 B14R2.35816 CC(CC1Cc2ccccc21)NN Amb25842091 [0,0,0,1,0,1|2,0,0]=4 5990 B14R2.30 CC/1NCC\C1=C/c2ccccc2 Amb18127119 [0,0,0,1,0,1|1,0,1]=4 5991 B14R2.30 CC/1NCC\C1=C\c2ccccc2 Amb25268253 [0,0,0,1,0,1|1,0,1]=4 5992 B14R2.30 CC1NCCC1Cc2ccccc2 Amb18960801 [0,0,0,1,0,1|1,0,0]=3 5993 B14R2.30 CC1SCCC1Nc2ccccc2 Amb25158675 [0,0,0,1,0,1|2,0,0]=4 5994 B14R2.30 C[C@@H]1CCN[C@H]1Cc2ccccc2 Amb18197090 [0,0,0,1,0,1|2,0,0]=4 5995 B14R2.30 C[C@H]/1NCC\C1=C/c2ccccc2 Amb24637949 [0,0,0,1,0,1|1,0,1]=4 5996 B14R2.30 ClC1CCOC1Sc2ccccc2 Amb24676898 [0,0,0,1,0,1|2,0,0]=4 5997 B14R2.30 Cl[C@@H]1CCO[C@@H]1Sc2ccccc2 Amb25176393 [0,0,0,1,0,1|2,0,0]=4 5998 B14R2.30 Cl[C@@H]1CCO[C@H]1Sc2ccccc2 Amb25176394 [0,0,0,1,0,1|2,0,0]=4 5999 B14R2.30 Cl[C@H]1CCO[C@@H]1Sc2ccccc2 Amb25240081 [0,0,0,1,0,1|2,0,0]=4 6000 B14R2.78 CCC1CCC1Nc2ccccc2 Amb25686792 [0,0,0,1,0,1|2,0,0]=4 6001 B14R2.78 CNC1CCN1Cc2ccccc2 Amb24743315 [0,0,0,1,0,1|2,0,0]=4 6002 B14R2.78 CN[C@H]1CCN1Cc2ccccc2 Amb24496673 [0,0,0,1,0,1|2,0,0]=4 6003 B14R2.343 CC1CC1C(Cl)Cc2ccccc2 Amb18317922 [0,0,0,1,0,1|2,0,0]=4 6004 B14R2.343 CC1CC1C(N)Cc2ccccc2 Amb18795738 [0,0,0,1,0,1|2,0,0]=4 6005 B14R2.343 CC1CC1C(O)Cc2cc[n]cc2 Amb25785410 [0,0,0,1,0,1|2,0,0]=4 6006 B14R2.343 CC1CC1C(O)Cc2ccccc2 Amb18178311 [0,0,0,1,0,1|1,0,0]=3 6007 B14R2.727 CC1CCC1(O)Cc2cc[n]cc2 Amb24379258 [0,0,0,1,0,1|2,0,0]=4 6008 B14R2.727 CC1CCC1(O)Cc2ccccc2 Amb24551125 [0,0,0,1,0,1|1,0,0]=3 6009 B14R2.741 CC1NCc2ccccc2CC1=O Amb25223185 [0,0,0,1,0,1|0,0,2]=4 6010 B14R2.741 C[C@H]1NCc2ccccc2NC1=O Amb25279479 [0,0,0,1,0,1|0,0,2]=4 6011 B14R2.741 OC1Cc2ccccc2CCC1O Amb25788060 [0,0,0,1,0,1|2,0,0]=4 6012 B14R2.972 CC(CC)C1Cc2ccccc2N1 Amb24461961 [0,0,0,1,0,1|2,0,0]=4 6013 B14R2.972 CC(NC)C1Cc2ccccc2O1 Amb20668421 [0,0,0,1,0,1|0,0,0]=2 6014 B14R2.972 CC(NC)C1Cc2ccccc2O1 Amb22157233 [0,0,0,1,0,1|0,0,0]=2 6015 B14R2.972 CC(NC)C1Cc2ccccc2S1 Amb24735456 [0,0,0,1,0,1|0,1,0]=3 6016 B14R2.972 CC(NN)C1Cc2ccccc2C1 Amb25707741 [0,0,0,1,0,1|2,0,0]=4 6017 B14R2.972 CC(NO)c1[n]c2ccccc2o1 Amb25376358 [0,0,0,1,0,1|1,0,1]=4 6018 B14R2.972 CCC(c1nc2c(o1)cccc2)C Amb17570155 [0,0,0,1,0,1|1,0,1]=4 6019 B14R2.972 CC[C@@H](O)C1Cc2ccccc2O1 Amb24731708 [0,0,0,1,0,1|2,0,0]=4 6020 B14R2.972 CC[C@H](O)C1Cc2ccccc2O1 Amb24715065 [0,0,0,1,0,1|2,0,0]=4 6021 B14R2.972 CNC(=N)C1Cc2ccccc2O1 Amb25709283 [0,0,0,1,0,1|1,0,1]=4 6022 B14R2.972 CNC(C)c1[nH]c2ccccc2[n]1 Amb18288262 [0,0,0,1,0,1|1,0,1]=4 6023 B14R2.972 CNC(C)c1[n]c2[n]cccc2o1 Amb24429595 [0,0,0,1,0,1|1,0,1]=4 6024 B14R2.972 CNC(C)c1[n]c2ccccc2o1 Amb18286629 [0,0,0,1,0,1|0,0,1]=3 6025 B14R2.972 CNC(C)c1cc2ccccc2[s]1 Amb19648795 [0,0,0,1,0,1|0,1,1]=4 6026 B14R2.972 CNC(c1nc2c(s1)cccc2)C Amb2371159 [0,0,0,1,0,1|0,1,1]=4 6027 B14R2.972 CN[C@@H](C)c1[nH]c2ccccc2[n]1 Amb25700863 [0,0,0,1,0,1|1,0,1]=4 6028 B14R2.972 CN[C@@H](C)c1cc2ccccc2[nH]1 Amb24351578 [0,0,0,1,0,1|1,0,1]=4 6029 B14R2.972 CN[C@@H](C)c1cc2ccccc2[s]1 Amb25345291 [0,0,0,1,0,1|0,1,1]=4 6030 B14R2.972 CN[C@H](C)c1[nH]c2ccccc2[n]1 Amb25805678 [0,0,0,1,0,1|1,0,1]=4 6031 B14R2.972 CN[C@H](C)c1cc2ccccc2[s]1 Amb25255135 [0,0,0,1,0,1|0,1,1]=4 6032 B14R2.1039 CCC1CC1(O)Cc2cc[n]cc2 Amb25362782 [0,0,0,1,0,1|2,0,0]=4 6033 B14R2.1128 CC1Nc2ccccc2CC1OC Amb24468004 [0,0,0,1,0,1|2,0,0]=4 6034 B14R2.1128 CC1Oc2ccccc2OC1NC Amb25819930 [0,0,0,1,0,1|2,0,0]=4 6035 B14R2.1128 CNC1Cc2ccccc2CC1O Amb25211322 [0,0,0,1,0,1|0,0,0]=2 6036 B14R2.1128 CN[C@H]1Cc2ccccc2C[C@@H]1O Amb24664218 [0,0,0,1,0,1|0,0,0]=2 6037 B14R2.1128 COC1C=C2C=CC=CC2=CC1O Amb24593926 [0,0,0,1,0,1|1,0,1]=4 6038 B14R2.1128 CO[C@@H]1Cc2ccccc2C[C@H]1O Amb25271412 [0,0,0,1,0,1|1,0,0]=3 6039 B14R2.1128 N#CC1Cc2ccccc2CC1O Amb25802957 [0,0,0,1,0,1|2,0,0]=4 6040 B14R2.1128 N#C[C@H]1Cc2ccccc2C[C@@H]1O Amb24515204 [0,0,0,1,0,1|2,0,0]=4 6041 B14R2.1134 CC1C(CC1c2c[n]ccc2)NC Amb24714990 [0,0,0,1,0,1|2,0,0]=4 6042 B14R2.2956 CC1(C=O)OC1Cc2ccccc2 Amb25371918 [0,0,0,1,0,1|2,0,0]=4 6043 B14R2.2956 CC1(CO)OC1Cc2ccccc2 Amb25734381 [0,0,0,1,0,1|2,0,0]=4 6044 B14R2.2956 C[C@]1(CO)O[C@@H]1Cc2ccccc2 Amb24519588 [0,0,0,1,0,1|2,0,0]=4 6045 B14R2.4514 CC1CCC(C1O)c2ccccc2 Amb25051348 [0,0,0,1,0,1|1,0,0]=3 6046 B14R2.4514 CC1COC(C1O)c2ccccc2 Amb24495737 [0,0,0,1,0,1|2,0,0]=4 6047 B14R2.4514 CC1NCN(C1=O)c2ccccc2 Amb24607317 [0,0,0,1,0,1|0,0,2]=4 6048 B14R2.4514 CC1ON=C(C1O)c2ccccc2 Amb24412067 [0,0,0,1,0,1|2,0,0]=4 6049 B14R2.4514 C[C@H]1CC[C@H]([C@@H]1O)c2ccccc2 Amb25256763 [0,0,0,1,0,1|1,0,0]=3 6050 B14R2.4514 OC1C(CNC1=O)c2ccccc2 Amb24490122 [0,0,0,1,0,1|1,0,1]=4 6051 B14R2.4514 OC1CCN(C1O)c2ccccc2 Amb24533371 [0,0,0,1,0,1|2,0,0]=4 6052 B14R2.8188 CC1C(O)Oc2ccccc2C1O Amb25839571 [0,0,0,1,0,1|2,0,0]=4 6053 B14R2.8188 CN1C(=O)C(O)Cc2ccccc12 Amb25788945 [0,0,0,1,0,1|1,0,1]=4 6054 B14R2.9589 ClC(Cc1ccccc1)C2CCC2 Amb18317923 [0,0,0,1,0,1|2,0,0]=4 6055 B14R2.9589 NC(Cc1ccccc1)C2CCC2 Amb18971973 [0,0,0,1,0,1|2,0,0]=4 6056 B14R2.9589 O=C(Nc1ccccc1)C2CCN2 Amb25350502 [0,0,0,1,0,1|0,0,2]=4 6057 B14R2.9589 OC(Cc1ccc[n]c1)C2CCC2 Amb25373779 [0,0,0,1,0,1|2,0,0]=4 6058 B14R2.9589 OC(Cc1cccc[n]1)C2CCC2 Amb25761830 [0,0,0,1,0,1|2,0,0]=4 6059 B14R2.9589 OC(Cc1ccccc1)C2CCC2 Amb18178312 [0,0,0,1,0,1|1,0,0]=3 6060 B14R2.9589 OC(Cc1ccccc1)C2CNC2 Amb25752937 [0,0,0,1,0,1|2,0,0]=4 6061 B14R2.9592 CC1(CC1)C(Cl)Cc2ccccc2 Amb25225347 [0,0,0,1,0,1|2,0,0]=4 6062 B14R2.9592 CC1(CC1)C(N)Cc2ccccc2 Amb18825120 [0,0,0,1,0,1|2,0,0]=4 6063 B14R2.9592 CC1(CC1)C(O)Cc2c[n]ccc2 Amb25336103 [0,0,0,1,0,1|2,0,0]=4 6064 B14R2.17474 C[C@]1(OC)[C@H](O)Cc2ccccc12 Amb24582090 [0,0,0,1,0,1|1,0,0]=3 6065 B14R2.88 CCC1CC1(N)c2ccc(Br)cc2 Amb24418846 [0,1,0,1,0,0|2,0,0]=4 6066 B14R2.88 CCC1CC1(N)c2ccc(Cl)cc2 Amb24394737 [0,1,0,1,0,0|2,0,0]=4 6067 B14R2.88 CCC1CC1(N)c2ccc(F)cc2 Amb25690015 [0,1,0,1,0,0|2,0,0]=4 6068 B14R2.88 CCC1CC1(O)C2=CNC(=O)C=C2 Amb24715515 [0,1,0,1,0,0|2,0,0]=4 6069 B14R2.88 CCC1CC1(O)c2ccc(F)cc2 Amb25299093 [0,1,0,1,0,0|1,0,0]=3 6070 B14R2.88 Cc1ccc(c[n]1)C2(O)CC2CC Amb24726884 [0,1,0,1,0,0|2,0,0]=4 6071 B14R2.926 CC1CCCC1c2ccc(O)cc2 Amb24492681 [0,1,0,1,0,0|2,0,0]=4 6072 B14R2.926 CC1NCCC1c2ccc(Br)cc2 Amb18156968 [0,1,0,1,0,0|1,0,0]=3 6073 B14R2.926 CC1NCCC1c2ccc(Cl)cc2 Amb18280032 [0,1,0,1,0,0|1,0,0]=3 6074 B14R2.926 CC1NCCC1c2ccc(F)cc2 Amb18279916 [0,1,0,1,0,0|1,0,0]=3 6075 B14R2.926 CN1CCOC1c2ccc(cc2)Br Amb17349006 [0,1,0,1,0,0|2,0,0]=4 6076 B14R2.926 CN1CCOC1c2ccc(cc2)Cl Amb17337249 [0,1,0,1,0,0|2,0,0]=4 6077 B14R2.926 CN1CCOC1c2ccc(cc2)F Amb17335483 [0,1,0,1,0,0|2,0,0]=4 6078 B14R2.926 CN1CCOC1c2ccc(cc2)O Amb17335296 [0,1,0,1,0,0|2,0,0]=4 6079 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(Br)cc2 Amb18156752 [0,1,0,1,0,0|2,0,0]=4 6080 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(Cl)cc2 Amb18189119 [0,1,0,1,0,0|2,0,0]=4 6081 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(F)cc2 Amb18194450 [0,1,0,1,0,0|2,0,0]=4 6082 B14R2.926 C[C@@H]1CCN[C@H]1c2ccc(O)cc2 Amb18195881 [0,1,0,1,0,0|2,0,0]=4 6083 B14R2.926 C[C@H]1CCN[C@@H]1c2ccc(Cl)cc2 Amb24570411 [0,1,0,1,0,0|2,0,0]=4 6084 B14R2.926 Cc1ccc(cc1)C2CCNC2C Amb18947160 [0,1,0,1,0,0|1,0,0]=3 6085 B14R2.926 Cc1ccc(cc1)[C@@H]2NCC[C@H]2C Amb18197091 [0,1,0,1,0,0|2,0,0]=4 6086 B14R2.926 Cc1ccc(cc1)[C@@H]2OCC[C@H]2Cl Amb24634360 [0,1,0,1,0,0|2,0,0]=4 6087 B14R2.926 NC1CCOC1c2ccc(Cl)cc2 Amb24660263 [0,1,0,1,0,0|2,0,0]=4 6088 B14R2.926 NC1CCOC1c2ccc(F)cc2 Amb25102940 [0,1,0,1,0,0|2,0,0]=4 6089 B14R2.926 NC1CCOC1c2ccc(I)cc2 Amb24638734 [0,1,0,1,0,0|2,0,0]=4 6090 B14R2.928 CC1CC1C(Br)c2ccc(Br)cc2 Amb25856035 [0,1,0,1,0,0|2,0,0]=4 6091 B14R2.928 CC1CC1C(Br)c2ccc(Cl)cc2 Amb25688057 [0,1,0,1,0,0|2,0,0]=4 6092 B14R2.928 CC1CC1C(Cl)c2ccc(Br)cc2 Amb25234488 [0,1,0,1,0,0|2,0,0]=4 6093 B14R2.928 CC1CC1C(Cl)c2ccc(Cl)cc2 Amb25787448 [0,1,0,1,0,0|2,0,0]=4 6094 B14R2.928 CC1CC1C(Cl)c2ccc(F)cc2 Amb18322124 [0,1,0,1,0,0|2,0,0]=4 6095 B14R2.928 CC1CC1C(N)c2ccc(Cl)cc2 Amb19148804 [0,1,0,1,0,0|2,0,0]=4 6096 B14R2.928 CC1CC1C(O)c2ccc(Br)cc2 Amb24644614 [0,1,0,1,0,0|1,0,0]=3 6097 B14R2.928 CC1CC1C(O)c2ccc(Cl)cc2 Amb18321595 [0,1,0,1,0,0|1,0,0]=3 6098 B14R2.928 CC1CC1C(O)c2ccc(F)cc2 Amb18796244 [0,1,0,1,0,0|1,0,0]=3 6099 B14R2.928 Cc1ccc(c[n]1)C(O)C2CC2C Amb25790845 [0,1,0,1,0,0|2,0,0]=4 6100 B14R2.928 Cc1ccc(cc1)C(Cl)C2CC2C Amb18321299 [0,1,0,1,0,0|2,0,0]=4 6101 B14R2.928 Cc1ccc(cc1)C(O)C2CC2C Amb18180615 [0,1,0,1,0,0|1,0,0]=3 6102 B14R2.1095 CCC1Oc2cc(F)ccc2C1O Amb24534116 [0,1,0,1,0,0|2,0,0]=4 6103 B14R2.1095 Cc1ccc2C(O)C(CC)Oc2c1 Amb24451301 [0,1,0,1,0,0|2,0,0]=4 6104 B14R2.3373 C[C@]1(C=O)O[C@@H]1c2ccc(Cl)cc2 Amb25273020 [0,1,0,1,0,0|2,0,0]=4 6105 B14R2.8716 CN1C(=O)C(O)c2cc(F)ccc12 Amb24466186 [0,1,0,1,0,0|1,0,1]=4 6106 B14R2.8716 CN1C(C)C(C)c2cc(O)ccc12 Amb24364171 [0,1,0,1,0,0|1,0,0]=3 6107 B14R2.8716 Cc1ccc2C(C)C(C)C(O)c2c1 Amb25752244 [0,1,0,1,0,0|1,0,0]=3 6108 B14R2.8716 Cc1ccc2C(O)C(C)C(=O)c2c1 Amb24492685 [0,1,0,1,0,0|2,0,0]=4 6109 B14R2.10593 CC1CCC1(O)c2ccc(Cl)cc2 Amb24526811 [0,1,0,1,0,0|1,0,0]=3 6110 B14R2.10593 CC1CCC1(O)c2ccc(O)cc2 Amb24633376 [0,1,0,1,0,0|1,0,0]=3 6111 B14R2.10593 Cc1ccc(cc1)C2(N)CCC2C Amb24713108 [0,1,0,1,0,0|2,0,0]=4 6112 B14R2.10593 Cc1ccc(cc1)C2(O)CCC2C Amb25792730 [0,1,0,1,0,0|1,0,0]=3 6113 B14R2.10606 Brc1ccc(cc1)C(Br)C2CCC2 Amb24354672 [0,1,0,1,0,0|2,0,0]=4 6114 B14R2.10606 Cc1ccc([n]c1)C(O)C2CCC2 Amb24555279 [0,1,0,1,0,0|2,0,0]=4 6115 B14R2.10606 Cc1ccc(cc1)C(Br)C2CCC2 Amb23590195 [0,1,0,1,0,0|2,0,0]=4 6116 B14R2.10606 Cc1ccc(cc1)C(Cl)C2CCC2 Amb18321300 [0,1,0,1,0,0|2,0,0]=4 6117 B14R2.10606 Cc1ccc(cc1)[C@@H](N)C2CCC2 Amb25842458 [0,1,0,1,0,0|2,0,0]=4 6118 B14R2.10606 Fc1ccc(cc1)C(Cl)C2CCC2 Amb18322125 [0,1,0,1,0,0|2,0,0]=4 6119 B14R2.10606 NC(C1CCC1)c2ccc(S)cc2 Amb25710592 [0,1,0,1,0,0|2,0,0]=4 6120 B14R2.10606 NC(c1ccc(cc1)Br)C2CCC2 Amb10609590 [0,1,0,1,0,0|2,0,0]=4 6121 B14R2.10606 N[C@@H](C1CCC1)c2ccc(Br)cc2 Amb25329734 [0,1,0,1,0,0|2,0,0]=4 6122 B14R2.10606 N[C@@H](C1CCC1)c2ccc(I)cc2 Amb25244523 [0,1,0,1,0,0|2,0,0]=4 6123 B14R2.10606 N[C@@H](C1CCC1)c2ccc(O)cc2 Amb24494254 [0,1,0,1,0,0|2,0,0]=4 6124 B14R2.10606 N[C@H](C1CCC1)c2ccc(Cl)cc2 Amb24384998 [0,1,0,1,0,0|2,0,0]=4 6125 B14R2.10606 N[C@H](C1CCC1)c2ccc(F)cc2 Amb24490773 [0,1,0,1,0,0|2,0,0]=4 6126 B14R2.10606 N[C@H](C1CCC1)c2ccc(I)cc2 Amb25710502 [0,1,0,1,0,0|2,0,0]=4 6127 B14R2.10606 Nc1ccc(cc1)[C@H](N)C2CCC2 Amb25850113 [0,1,0,1,0,0|2,0,0]=4 6128 B14R2.10606 O=C(C1CCN1)c2ccc(F)cc2 Amb24400649 [0,1,0,1,0,0|0,0,2]=4 6129 B14R2.10606 OC(C1CCC1)c2ccc(Cl)c[n]2 Amb24635400 [0,1,0,1,0,0|2,0,0]=4 6130 B14R2.10606 OC(C1CCN1)c2ccc(F)cc2 Amb25217082 [0,1,0,1,0,0|0,0,0]=2 6131 B14R2.10606 OC(C1CNC1)c2ccc(Br)cc2 Amb24469562 [0,1,0,1,0,0|2,0,0]=4 6132 B14R2.10606 OC(C1CNC1)c2ccc(Cl)cc2 Amb25325819 [0,1,0,1,0,0|2,0,0]=4 6133 B14R2.10606 OC(C1CNC1)c2ccc(F)cc2 Amb24452023 [0,1,0,1,0,0|2,0,0]=4 6134 B14R2.10606 OC(C1CNC1)c2ccc(I)cc2 Amb25790285 [0,1,0,1,0,0|2,0,0]=4 6135 B14R2.10606 OC(c1ccc(cc1)Br)C2CCC2 Amb17196187 [0,1,0,1,0,0|1,0,0]=3 6136 B14R2.10606 OC(c1ccc(cc1)C)C2CCC2 Amb17194499 [0,1,0,1,0,0|1,0,0]=3 6137 B14R2.10606 OC(c1ccc(cc1)Cl)C2CCC2 Amb17194753 [0,1,0,1,0,0|1,0,0]=3 6138 B14R2.10606 OC(c1ccc(cc1)F)C2CCC2 Amb17194541 [0,1,0,1,0,0|1,0,0]=3 6139 B14R2.10606 O[C@@H](C1CCC1)c2ccc(F)cc2 Amb24686602 [0,1,0,1,0,0|1,0,0]=3 6140 B14R2.10606 O[C@H](C1CCC1)c2ccc(F)cc2 Amb24445458 [0,1,0,1,0,0|1,0,0]=3 6141 B14R2.10627 CC1(CC1)C(Br)c2ccc(Br)cc2 Amb25331460 [0,1,0,1,0,0|2,0,0]=4 6142 B14R2.10627 CC1(CC1)C(Br)c2ccc(Cl)cc2 Amb25153394 [0,1,0,1,0,0|2,0,0]=4 6143 B14R2.10627 CC1(CC1)C(Cl)c2ccc(Cl)cc2 Amb25786903 [0,1,0,1,0,0|2,0,0]=4 6144 B14R2.10627 CC1(CC1)C(Cl)c2ccc(F)cc2 Amb25153153 [0,1,0,1,0,0|2,0,0]=4 6145 B14R2.10627 CC1(CC1)C(N)c2ccc(Br)cc2 Amb18070379 [0,1,0,1,0,0|2,0,0]=4 6146 B14R2.10627 CC1(CC1)C(N)c2ccc(Cl)cc2 Amb18066383 [0,1,0,1,0,0|2,0,0]=4 6147 B14R2.10627 CC1(CC1)C(N)c2ccc(F)cc2 Amb18564098 [0,1,0,1,0,0|2,0,0]=4 6148 B14R2.10627 CC1(CO1)C(O)c2ccc(Cl)cc2 Amb24495569 [0,1,0,1,0,0|1,0,0]=3 6149 B14R2.10627 C[C@]1(CO1)[C@@H](O)c2ccc(Cl)cc2 Amb24515240 [0,1,0,1,0,0|1,0,0]=3 6150 B14R2.10627 Cc1ccc(c[n]1)C(O)C2(C)CC2 Amb24435793 [0,1,0,1,0,0|2,0,0]=4 6151 B14R2.10627 Cc1ccc(cc1)C(N)C2(C)CC2 Amb18065587 [0,1,0,1,0,0|2,0,0]=4 6152 B14R2.10627 OC1(CC1)C(O)c2ccc(Cl)cc2 Amb25036018 [0,1,0,1,0,0|2,0,0]=4 6153 B14R2.29369 NC1CCc2c(C1O)ccc(c2)Br Amb2383089 [0,1,0,1,0,0|2,0,0]=4 6154 B14R2.29369 NC1CCc2c(C1O)ccc(c2)Cl Amb2383087 [0,1,0,1,0,0|2,0,0]=4 6155 B14R2.29369 NC1CCc2c(C1O)ccc(c2)F Amb2383088 [0,1,0,1,0,0|2,0,0]=4 6156 B14R2.29369 NC1CCc2cc(Br)ccc2C1O Amb22585784 [0,1,0,1,0,0|2,0,0]=4 6157 B14R2.29369 NC1CCc2cc(Cl)ccc2C1O Amb22585786 [0,1,0,1,0,0|2,0,0]=4 6158 B14R2.29369 NC1CCc2cc(F)ccc2C1O Amb22585788 [0,1,0,1,0,0|2,0,0]=4 6159 B14R2.29369 NC1CCc2cc(O)ccc2C1O Amb18128411 [0,1,0,1,0,0|2,0,0]=4 6160 B14R2.269 CC1CCNC1c2cc(O)ccc2 Amb24637478 [0,1,0,1,0,0|2,0,0]=4 6161 B14R2.269 CC1NCCC1c2cc(Br)ccc2 Amb18156965 [0,1,0,1,0,0|1,0,0]=3 6162 B14R2.269 CC1NCCC1c2cc(Cl)ccc2 Amb18280037 [0,1,0,1,0,0|1,0,0]=3 6163 B14R2.269 CC1NCCC1c2cc(F)ccc2 Amb18279902 [0,1,0,1,0,0|1,0,0]=3 6164 B14R2.269 CN1CCOC1c2cccc(c2)Br Amb17349004 [0,1,0,1,0,0|2,0,0]=4 6165 B14R2.269 CN1CCOC1c2cccc(c2)C Amb17335177 [0,1,0,1,0,0|2,0,0]=4 6166 B14R2.269 CN1CCOC1c2cccc(c2)O Amb17335298 [0,1,0,1,0,0|2,0,0]=4 6167 B14R2.269 C[C@@H]1CCN[C@H]1c2cc(Br)ccc2 Amb18156533 [0,1,0,1,0,0|2,0,0]=4 6168 B14R2.269 C[C@@H]1CCN[C@H]1c2cc(Cl)ccc2 Amb18189121 [0,1,0,1,0,0|2,0,0]=4 6169 B14R2.269 C[C@@H]1CCN[C@H]1c2cc(F)ccc2 Amb18194452 [0,1,0,1,0,0|2,0,0]=4 6170 B14R2.269 C[C@@H]1CCN[C@H]1c2cc(O)ccc2 Amb18195880 [0,1,0,1,0,0|2,0,0]=4 6171 B14R2.269 C[C@H]1CCN[C@@H]1c2cc(O)ccc2 Amb24539884 [0,1,0,1,0,0|2,0,0]=4 6172 B14R2.269 Cc1cc(ccc1)C2OCCC2N Amb25106162 [0,1,0,1,0,0|2,0,0]=4 6173 B14R2.269 Cc1cccc(c1)C2CCNC2C Amb18279903 [0,1,0,1,0,0|1,0,0]=3 6174 B14R2.269 Cc1cccc(c1)[C@@H]2NCC[C@H]2C Amb18197092 [0,1,0,1,0,0|2,0,0]=4 6175 B14R2.269 NC1CCOC1c2cc(Br)ccc2 Amb25120336 [0,1,0,1,0,0|2,0,0]=4 6176 B14R2.269 NC1CCOC1c2cc(I)ccc2 Amb25253439 [0,1,0,1,0,0|2,0,0]=4 6177 B14R2.1038 CCC1CC1(N)c2cc(Br)ccc2 Amb25211569 [0,1,0,1,0,0|2,0,0]=4 6178 B14R2.1038 CCC1CC1(O)C2=CC=CC(=O)N2 Amb25089938 [0,1,0,1,0,0|2,0,0]=4 6179 B14R2.1038 CCC1CC1(O)c2c[n]cc(Br)c2 Amb24366470 [0,1,0,1,0,0|2,0,0]=4 6180 B14R2.1038 CCC1CC1(O)c2c[n]cc(Cl)c2 Amb24651851 [0,1,0,1,0,0|2,0,0]=4 6181 B14R2.1038 CCC1CC1(O)c2cc(Cl)ccc2 Amb25782327 [0,1,0,1,0,0|1,0,0]=3 6182 B14R2.1038 CCC1CC1(O)c2cc(F)ccc2 Amb25241476 [0,1,0,1,0,0|1,0,0]=3 6183 B14R2.1038 CCC1CC1(O)c2cc(N)ccc2 Amb24615422 [0,1,0,1,0,0|1,0,0]=3 6184 B14R2.1038 Cc1c[n]cc(c1)C2(O)CC2CC Amb24397516 [0,1,0,1,0,0|2,0,0]=4 6185 B14R2.1038 Cc1cc(cc[n]1)C2(O)CC2CC Amb25180396 [0,1,0,1,0,0|2,0,0]=4 6186 B14R2.1038 Cc1cccc([n]1)C2(O)CC2CC Amb24457384 [0,1,0,1,0,0|2,0,0]=4 6187 B14R2.1038 Cc1cccc(c1)C2(N)CC2CC Amb24605563 [0,1,0,1,0,0|2,0,0]=4 6188 B14R2.1060 CCC1Oc2ccc(Cl)cc2C1O Amb24362255 [0,1,0,1,0,0|2,0,0]=4 6189 B14R2.1060 CCC1Oc2ccc(F)cc2C1O Amb24748662 [0,1,0,1,0,0|2,0,0]=4 6190 B14R2.1060 Cc1ccc2OC(CC)C(O)c2c1 Amb25356601 [0,1,0,1,0,0|2,0,0]=4 6191 B14R2.2151 CNC1Cc2c(F)cccc2C1O Amb25377499 [0,1,0,1,0,0|0,0,0]=2 6192 B14R2.4513 CC1CCc2ccc(Cl)cc2C1N Amb18561713 [0,1,0,1,0,0|2,0,0]=4 6193 B14R2.4513 CC1CCc2ccc(Cl)cc2[C@@H]1N Amb24489095 [0,1,0,1,0,0|2,0,0]=4 6194 B14R2.4513 CC1CCc2ccc(F)cc2C1N Amb18561712 [0,1,0,1,0,0|2,0,0]=4 6195 B14R2.4513 CC1SCc2ccc(Br)cc2C1N Amb25090182 [0,1,0,1,0,0|2,0,0]=4 6196 B14R2.4513 CC1SCc2ccc(Br)cc2C1O Amb25740785 [0,1,0,1,0,0|1,0,0]=3 6197 B14R2.4513 CC1SCc2ccc(Cl)cc2C1N Amb24385805 [0,1,0,1,0,0|2,0,0]=4 6198 B14R2.4513 CC1SCc2ccc(Cl)cc2C1O Amb24404199 [0,1,0,1,0,0|1,0,0]=3 6199 B14R2.4513 C[C@@H]1CCc2ccc(Cl)cc2[C@@H]1N Amb25268215 [0,1,0,1,0,0|2,0,0]=4 6200 B14R2.4513 Cc1ccc2CCC(C)C(N)c2c1 Amb18561708 [0,1,0,1,0,0|2,0,0]=4 6201 B14R2.4513 Cc1ccc2CCC(O)C(O)c2c1 Amb25856414 [0,1,0,1,0,0|2,0,0]=4 6202 B14R2.4513 Cc1ccc2CC[C@H](O)[C@H](O)c2c1 Amb24613485 [0,1,0,1,0,0|2,0,0]=4 6203 B14R2.4513 Cc1ccc2CSC(C)C(O)c2c1 Amb24718913 [0,1,0,1,0,0|1,0,0]=3 6204 B14R2.4513 NC1CCc2c(C1O)cc(cc2)Br Amb2383074 [0,1,0,1,0,0|2,0,0]=4 6205 B14R2.4513 NC1CCc2c(C1O)cc(cc2)Cl Amb2383072 [0,1,0,1,0,0|2,0,0]=4 6206 B14R2.4513 NC1CCc2c(C1O)cc(cc2)F Amb2383073 [0,1,0,1,0,0|2,0,0]=4 6207 B14R2.4513 NC1CCc2ccc(Br)cc2C1O Amb22585792 [0,1,0,1,0,0|2,0,0]=4 6208 B14R2.4513 NC1CCc2ccc(Cl)cc2C1O Amb22585794 [0,1,0,1,0,0|2,0,0]=4 6209 B14R2.4513 NC1CCc2ccc(F)cc2C1O Amb22585796 [0,1,0,1,0,0|2,0,0]=4 6210 B14R2.4513 NC1CCc2ccc(O)cc2C1O Amb18128412 [0,1,0,1,0,0|2,0,0]=4 6211 B14R2.4513 N[C@H]1CCc2ccc(O)cc2[C@@H]1O Amb24546421 [0,1,0,1,0,0|2,0,0]=4 6212 B14R2.4513 OC1C(O)CCc2ccc(Cl)cc21 Amb25206302 [0,1,0,1,0,0|2,0,0]=4 6213 B14R2.8038 CC1CCc2c(cccc2F)C1N Amb18561722 [0,1,0,1,0,0|2,0,0]=4 6214 B14R2.8038 CC1OCc2c(cccc2O)C1O Amb24492739 [0,1,0,1,0,0|1,0,0]=3 6215 B14R2.8038 CC1OCc2c(cccc2O)[C@@H]1O Amb25190279 [0,1,0,1,0,0|1,0,0]=3 6216 B14R2.8038 CC1SCc2c(cccc2Br)C1O Amb25345360 [0,1,0,1,0,0|1,0,0]=3 6217 B14R2.8038 CC1SCc2c(cccc2Cl)C1N Amb25366793 [0,1,0,1,0,0|2,0,0]=4 6218 B14R2.8038 CC1SCc2c(cccc2F)C1N Amb25327074 [0,1,0,1,0,0|2,0,0]=4 6219 B14R2.8038 CC1SCc2c(cccc2F)C1O Amb25345358 [0,1,0,1,0,0|1,0,0]=3 6220 B14R2.8038 CN1CCc2c(N)cccc2C1O Amb18128242 [0,1,0,1,0,0|2,0,0]=4 6221 B14R2.8038 Cc1cccc2[C@H](O)[C@H](C)C=Cc12 Amb24587301 [0,1,0,1,0,0|1,0,1]=4 6222 B14R2.8038 NC1CCc2c(C1O)cccc2Cl Amb2383077 [0,1,0,1,0,0|2,0,0]=4 6223 B14R2.8038 NC1CCc2c(C1O)cccc2F Amb2383078 [0,1,0,1,0,0|2,0,0]=4 6224 B14R2.8038 NC1CCc2c(cccc2Cl)C1O Amb22585777 [0,1,0,1,0,0|2,0,0]=4 6225 B14R2.8038 NC1CCc2c(cccc2F)C1O Amb22585779 [0,1,0,1,0,0|2,0,0]=4 6226 B14R2.8038 NC1CCc2c(cccc2O)C1O Amb18128410 [0,1,0,1,0,0|2,0,0]=4 6227 B14R2.8038 Oc1cccc2C(O)C(O)CCc12 Amb18648343 [0,1,0,1,0,0|2,0,0]=4 6228 B14R2.8038 Oc1cccc2[C@H](O)[C@H](O)CCc12 Amb25366522 [0,1,0,1,0,0|2,0,0]=4 6229 B14R2.9035 CC1CC1C(N)c2cccc(Cl)c2 Amb25137558 [0,1,0,1,0,0|2,0,0]=4 6230 B14R2.9035 CC1CC1C(O)c2c[n]cc(F)c2 Amb25690750 [0,1,0,1,0,0|2,0,0]=4 6231 B14R2.9035 Cc1cc(ccc1)C(N)C2CC2C Amb25096052 [0,1,0,1,0,0|2,0,0]=4 6232 B14R2.9035 Cc1cc(ccc1)C(O)C2CC2C Amb25842873 [0,1,0,1,0,0|1,0,0]=3 6233 B14R2.20878 CC1CCC1(N)c2cccc(Br)c2 Amb24758676 [0,1,0,1,0,0|2,0,0]=4 6234 B14R2.20878 CC1CCC1(O)c2c[n]cc(F)c2 Amb25670520 [0,1,0,1,0,0|2,0,0]=4 6235 B14R2.20878 CC1CCC1(O)c2cccc(Cl)c2 Amb25153061 [0,1,0,1,0,0|1,0,0]=3 6236 B14R2.28485 CC1C(C)C(Br)c2cccc(F)c21 Amb25768028 [0,1,0,1,0,0|2,0,0]=4 6237 B14R2.28485 CC1C(C)C(Cl)c2cccc(F)c21 Amb25091519 [0,1,0,1,0,0|2,0,0]=4 6238 B14R2.28485 CC1C(C)C(O)c2cccc(F)c21 Amb25825628 [0,1,0,1,0,0|1,0,0]=3 6239 B14R2.28485 Cc1cccc2C(Br)C(C)C(C)c12 Amb25677718 [0,1,0,1,0,0|2,0,0]=4 6240 B14R2.28485 Cc1cccc2C(N)C(C)C(C)c12 Amb25688189 [0,1,0,1,0,0|2,0,0]=4 6241 B14R2.29767 Cc1cc([n]cc1)C(O)C2CCC2 Amb25819970 [0,1,0,1,0,0|2,0,0]=4 6242 B14R2.29767 Cc1cc(ccc1)C(N)C2CCC2 Amb22642962 [0,1,0,1,0,0|2,0,0]=4 6243 B14R2.29767 Cc1cc(ccc1)C(O)C2CCC2 Amb24709247 [0,1,0,1,0,0|1,0,0]=3 6244 B14R2.29767 Cc1cc(ccc1)[C@@H](N)C2CCC2 Amb24494266 [0,1,0,1,0,0|2,0,0]=4 6245 B14R2.29767 Cc1cc(ccc1)[C@H](N)C2CCC2 Amb25089450 [0,1,0,1,0,0|2,0,0]=4 6246 B14R2.29767 NC(C1CCC1)c2cc(Cl)ccc2 Amb22642961 [0,1,0,1,0,0|2,0,0]=4 6247 B14R2.29767 NC(C1CCC1)c2cc(F)ccc2 Amb22642954 [0,1,0,1,0,0|2,0,0]=4 6248 B14R2.29767 NC(C1CCC1)c2cc(I)ccc2 Amb24410338 [0,1,0,1,0,0|2,0,0]=4 6249 B14R2.29767 NC(C1CCC1)c2cc(S)ccc2 Amb24490846 [0,1,0,1,0,0|2,0,0]=4 6250 B14R2.29767 N[C@@H](C1CCC1)c2cc(Br)ccc2 Amb25687485 [0,1,0,1,0,0|2,0,0]=4 6251 B14R2.29767 N[C@@H](C1CCC1)c2cc(Cl)ccc2 Amb24659605 [0,1,0,1,0,0|2,0,0]=4 6252 B14R2.29767 N[C@@H](C1CCC1)c2cc(F)ccc2 Amb25674717 [0,1,0,1,0,0|2,0,0]=4 6253 B14R2.29767 N[C@@H](C1CCC1)c2cc(I)ccc2 Amb24490936 [0,1,0,1,0,0|2,0,0]=4 6254 B14R2.29767 N[C@H](C1CCC1)c2cc(Br)ccc2 Amb25859072 [0,1,0,1,0,0|2,0,0]=4 6255 B14R2.29767 Nc1cccc(c1)[C@H](N)C2CCC2 Amb24360468 [0,1,0,1,0,0|2,0,0]=4 6256 B14R2.29767 OC(C1CCC1)c2c[n]cc(Br)c2 Amb25755230 [0,1,0,1,0,0|2,0,0]=4 6257 B14R2.29767 OC(C1CCC1)c2c[n]cc(F)c2 Amb24689649 [0,1,0,1,0,0|2,0,0]=4 6258 B14R2.29767 OC(C1CCC1)c2cc(Cl)ccc2 Amb25687289 [0,1,0,1,0,0|1,0,0]=3 6259 B14R2.29767 OC(C1CCN1)c2cc(F)ccc2 Amb24536177 [0,1,0,1,0,0|0,0,0]=2 6260 B14R2.29767 OC(C1CNC1)c2cccc(Cl)c2 Amb25785455 [0,1,0,1,0,0|2,0,0]=4 6261 B14R2.29767 OC(C1CNC1)c2cccc(F)c2 Amb24758304 [0,1,0,1,0,0|2,0,0]=4 6262 B14R2.29767 O[C@@H](C1CCC1)c2cc(F)ccc2 Amb24702293 [0,1,0,1,0,0|1,0,0]=3 6263 B14R2.29767 O[C@H](C1CCC1)c2cc(Cl)ccc2 Amb25091695 [0,1,0,1,0,0|1,0,0]=3 6264 B14R2.29767 Oc1cccc(c1)C(O)C2CCC2 Amb25057723 [0,1,0,1,0,0|1,0,0]=3 6265 B14R2.29783 CC1(CC1)C(N)c2cccc(F)c2 Amb24729005 [0,1,0,1,0,0|2,0,0]=4 6266 B14R2.29783 Cc1cccc(c1)C(O)C2(C)CC2 Amb25068642 [0,1,0,1,0,0|1,0,0]=3 6267 B14R2.24 CC1CNCC=C1c2ccccc2 Amb24488874 [0,1,0,1,0,0|1,0,1]=4 6268 B14R2.24 CC1CNCCC1c2cccc[n]2 Amb24671555 [0,1,0,1,0,0|2,0,0]=4 6269 B14R2.24 CC1CNCCC1c2ccccc2 Amb19148751 [0,1,0,1,0,0|1,0,0]=3 6270 B14R2.24 CC1NCCCC1c2cccc[n]2 Amb24489048 [0,1,0,1,0,0|2,0,0]=4 6271 B14R2.24 CC1NCCCC1c2ccccc2 Amb18647927 [0,1,0,1,0,0|1,0,0]=3 6272 B14R2.24 CC1NCCNC1c2ccccc2 Amb24084752 [0,1,0,1,0,0|1,0,0]=3 6273 B14R2.24 CC1NCCOC1c2cc[n]cc2 Amb18195195 [0,1,0,1,0,0|1,0,0]=3 6274 B14R2.24 CC1OCCNC1c2ccccc2 Amb18065713 [0,1,0,1,0,0|2,0,0]=4 6275 B14R2.24 CC1SCCNC1c2ccccc2 Amb19374434 [0,1,0,1,0,0|2,0,0]=4 6276 B14R2.24 C[C@@H]1CNCCN1c2ccccc2 Amb24182079 [0,1,0,1,0,0|2,0,0]=4 6277 B14R2.24 C[C@@H]1CNCC[C@H]1c2ccccc2 Amb25302333 [0,1,0,1,0,0|1,0,0]=3 6278 B14R2.24 C[C@@H]1NCCC[C@@H]1c2ccccc2 Amb24727263 [0,1,0,1,0,0|1,0,0]=3 6279 B14R2.24 C[C@H]1CNCC[C@H]1c2ccccc2 Amb24714893 [0,1,0,1,0,0|1,0,0]=3 6280 B14R2.24 C[C@H]1NCCOC1c2ccccc2 Amb25766557 [0,1,0,1,0,0|0,0,0]=2 6281 B14R2.24 C[C@H]1NCCO[C@H]1c2ccccc2 Amb25176165 [0,1,0,1,0,0|0,0,0]=2 6282 B14R2.24 ClC1CCCOC1c2ccccc2 Amb24099915 [0,1,0,1,0,0|2,0,0]=4 6283 B14R2.24 ClC1COCOC1c2ccccc2 Amb25187890 [0,1,0,1,0,0|2,0,0]=4 6284 B14R2.24 Cl[C@@H]1CCCO[C@@H]1c2ccccc2 Amb24740815 [0,1,0,1,0,0|2,0,0]=4 6285 B14R2.24 Cl[C@H]1CCCO[C@H]1c2ccccc2 Amb25210425 [0,1,0,1,0,0|2,0,0]=4 6286 B14R2.24 Cl[C@H]1COCO[C@@H]1c2ccccc2 Amb24563413 [0,1,0,1,0,0|2,0,0]=4 6287 B14R2.24 FC1CNCCC1c2ccccc2 Amb25192087 [0,1,0,1,0,0|2,0,0]=4 6288 B14R2.24 NC1CCCOC1c2ccccc2 Amb24594942 [0,1,0,1,0,0|2,0,0]=4 6289 B14R2.24 NC1COCOC1c2ccccc2 Amb24429108 [0,1,0,1,0,0|2,0,0]=4 6290 B14R2.24 N[C@@H]1COCO[C@H]1c2ccccc2 Amb24635668 [0,1,0,1,0,0|2,0,0]=4 6291 B14R2.24 N[C@H]1COCO[C@H]1c2ccccc2 Amb25321883 [0,1,0,1,0,0|2,0,0]=4 6292 B14R2.24 OC1CNCCC1c2ccccc2 Amb18648066 [0,1,0,1,0,0|2,0,0]=4 6293 B14R2.24 O[C@H]1CCCO[C@H]1c2ccccc2 Amb24520211 [0,1,0,1,0,0|2,0,0]=4 6294 B14R2.24 O[C@H]1CNCC[C@H]1c2ccccc2 Amb25176178 [0,1,0,1,0,0|2,0,0]=4 6295 B14R2.35 CNCC1CCC1c2ccccc2 Amb25366827 [0,1,0,1,0,0|1,0,0]=3 6296 B14R2.35 O=CNC1COC1c2ccccc2 Amb25065265 [0,1,0,1,0,0|0,0,1]=3 6297 B14R2.44 C#CCC1Cc2ccccc2C1O Amb18807349 [0,1,0,1,0,0|1,0,1]=4 6298 B14R2.44 C=CCC1Cc2ccccc2C1O Amb18185828 [0,1,0,1,0,0|1,0,1]=4 6299 B14R2.44 CC1C(Cc2ccccc21)CNC Amb18127536 [0,1,0,1,0,0|1,0,0]=3 6300 B14R2.44 CCCC1Cc2ccccc2C1Cl Amb19080526 [0,1,0,1,0,0|2,0,0]=4 6301 B14R2.44 CCCC1Cc2ccccc2C1N Amb18956641 [0,1,0,1,0,0|2,0,0]=4 6302 B14R2.44 CCCC1Cc2ccccc2C1O Amb18186021 [0,1,0,1,0,0|1,0,0]=3 6303 B14R2.44 CCN[C@H]1Cc2ccccc2[C@H]1O Amb24656108 [0,1,0,1,0,0|0,0,0]=2 6304 B14R2.44 CCOC1Cc2c(C1N)cccc2 Amb1142177 [0,1,0,1,0,0|2,0,0]=4 6305 B14R2.44 CCOC1Cc2ccccc2C1O Amb18809063 [0,1,0,1,0,0|1,0,0]=3 6306 B14R2.44 CNCC1Cc2ccccc2C1O Amb24470029 [0,1,0,1,0,0|0,0,0]=2 6307 B14R2.44 CNCC1Cc2ccccc2N1C Amb24679444 [0,1,0,1,0,0|2,0,0]=4 6308 B14R2.44 NCCC1Cc2ccccc2C1O Amb18824971 [0,1,0,1,0,0|1,0,0]=3 6309 B14R2.44 NCCC1Oc2ccccc2C1O Amb18194704 [0,1,0,1,0,0|2,0,0]=4 6310 B14R2.44 NCCC1Sc2ccccc2C1O Amb18189298 [0,1,0,1,0,0|2,0,0]=4 6311 B14R2.44 N[C@@H]1[C@@H](CCO)Cc2ccccc21 Amb25175140 [0,1,0,1,0,0|2,0,0]=4 6312 B14R2.44 O=COC1Cc2c(C1O)cccc2 Amb17594527 [0,1,0,1,0,0|1,0,1]=4 6313 B14R2.44 OC1C(CCF)Cc2ccccc21 Amb25756449 [0,1,0,1,0,0|1,0,0]=3 6314 B14R2.44 O[C@@H]1[C@@H](Cc2ccccc21)OC=O Amb24576958 [0,1,0,1,0,0|1,0,1]=4 6315 B14R2.44 O[C@H]1[C@H](Cc2ccccc12)OC=O Amb17673664 [0,1,0,1,0,0|1,0,1]=4 6316 B14R2.44 [N-]=[N+]=NC1Cc2ccccc2[C@@H]1O Amb25695421 [0,1,0,1,0,0|1,0,1]=4 6317 B14R2.44 [N-]=[N+]=N[C@H]1Cc2ccccc2[C@@H]1O Amb25275246 [0,1,0,1,0,0|1,0,1]=4 6318 B14R2.44 [N-]=[N+]=N[C@H]1Cc2ccccc2[C@H]1O Amb25210954 [0,1,0,1,0,0|1,0,1]=4 6319 B14R2.114 BrC(C1CCCC1)c2ccccc2 Amb25106398 [0,1,0,1,0,0|2,0,0]=4 6320 B14R2.114 BrC(C1CCOC1)c2ccccc2 Amb24446311 [0,1,0,1,0,0|2,0,0]=4 6321 B14R2.114 C=C(C1CCCN1)c2ccccc2 Amb23536675 [0,1,0,1,0,0|1,0,1]=4 6322 B14R2.114 CC(C1CCCN1)c2ccccc2 Amb23536676 [0,1,0,1,0,0|1,0,0]=3 6323 B14R2.114 CC(C1CCNC1)c2c[n]ccc2 Amb25703240 [0,1,0,1,0,0|2,0,0]=4 6324 B14R2.114 CC(C1CCNC1)c2cccc[n]2 Amb25836696 [0,1,0,1,0,0|2,0,0]=4 6325 B14R2.114 CC(C1CCNC1)c2ccccc2 Amb18197082 [0,1,0,1,0,0|1,0,0]=3 6326 B14R2.114 CC(C1NCCS1)c2ccccc2 Amb18321178 [0,1,0,1,0,0|1,0,0]=3 6327 B14R2.114 CN(C1CNCC1)c2ccccc2 Amb25069354 [0,1,0,1,0,0|2,0,0]=4 6328 B14R2.114 ClC(C1CCCC1)c2ccccc2 Amb17689167 [0,1,0,1,0,0|2,0,0]=4 6329 B14R2.114 ClC(C1CCCO1)c2ccccc2 Amb18321596 [0,1,0,1,0,0|2,0,0]=4 6330 B14R2.114 ClC(C1CCOC1)c2ccccc2 Amb18318158 [0,1,0,1,0,0|2,0,0]=4 6331 B14R2.114 FC(C1CCCN1)c2ccc[n]c2 Amb25790883 [0,1,0,1,0,0|2,0,0]=4 6332 B14R2.114 NC(C1CCCS1)c2ccccc2 Amb25801544 [0,1,0,1,0,0|2,0,0]=4 6333 B14R2.114 NC(C1CCNC1)c2ccccc2 Amb18196474 [0,1,0,1,0,0|1,0,0]=3 6334 B14R2.114 NC(C1CCOC1)c2ccccc2 Amb18952434 [0,1,0,1,0,0|2,0,0]=4 6335 B14R2.114 NC(C=1NCCN1)c2ccccc2 Amb25123329 [0,1,0,1,0,0|1,0,1]=4 6336 B14R2.114 NC(c1ccccc1)C2CCCO2 Amb10609099 [0,1,0,1,0,0|2,0,0]=4 6337 B14R2.114 N[C@@H](C1CCCC1)c2ccccc2 Amb22746902 [0,1,0,1,0,0|2,0,0]=4 6338 B14R2.114 N[C@H](C1CCCC1)c2ccccc2 Amb22288670 [0,1,0,1,0,0|2,0,0]=4 6339 B14R2.114 N[C@H](C1CCCC1)c2ccccc2 Amb24744528 [0,1,0,1,0,0|2,0,0]=4 6340 B14R2.114 O=C(C1CCCN1)c2ccccc2 Amb17988466 [0,1,0,1,0,0|0,0,2]=4 6341 B14R2.114 O=C(C1CNCC1)c2ccccc2 Amb19889904 [0,1,0,1,0,0|0,0,2]=4 6342 B14R2.114 O=C(C1CNCC1)c2ccccc2 Amb21858469 [0,1,0,1,0,0|0,0,2]=4 6343 B14R2.114 O=C([C@@H]1CCCN1)c2ccccc2 Amb24743535 [0,1,0,1,0,0|0,0,2]=4 6344 B14R2.114 O=C([C@H]1CCCN1)c2ccccc2 Amb25175805 [0,1,0,1,0,0|0,0,2]=4 6345 B14R2.114 OC(C1=NCCO1)c2ccccc2 Amb24495694 [0,1,0,1,0,0|0,0,2]=4 6346 B14R2.114 OC(C1C=CCN1)c2ccc[n]c2 Amb25738880 [0,1,0,1,0,0|1,0,1]=4 6347 B14R2.114 OC(C1C=CCN1)c2ccccc2 Amb25827373 [0,1,0,1,0,0|0,0,1]=3 6348 B14R2.114 OC(C1CC=CC1)c2ccccc2 Amb25752960 [0,1,0,1,0,0|1,0,1]=4 6349 B14R2.114 OC(C1CCCC1)c2cc[n]cc2 Amb18795916 [0,1,0,1,0,0|2,0,0]=4 6350 B14R2.114 OC(C1CCCC1)c2cccc[n]2 Amb18180663 [0,1,0,1,0,0|2,0,0]=4 6351 B14R2.114 OC(C1CCCN1)c2c[n]c[n]c2 Amb24752811 [0,1,0,1,0,0|2,0,0]=4 6352 B14R2.114 OC(C1CCCN1)c2cc[n]c[n]2 Amb24357493 [0,1,0,1,0,0|2,0,0]=4 6353 B14R2.114 OC(C1CCCN1)c2ccccc2 Amb18065714 [0,1,0,1,0,0|0,0,0]=2 6354 B14R2.114 OC(C1CCCO1)c2ccc[n]c2 Amb23455426 [0,1,0,1,0,0|2,0,0]=4 6355 B14R2.114 OC(C1CCCO1)c2ccccc2 Amb18180774 [0,1,0,1,0,0|1,0,0]=3 6356 B14R2.114 OC(C1CCCS1)c2ccc[n]c2 Amb24359644 [0,1,0,1,0,0|2,0,0]=4 6357 B14R2.114 OC(C1CCOC1)c2c[n]ccc2 Amb25090626 [0,1,0,1,0,0|2,0,0]=4 6358 B14R2.114 OC(C1CCOC1)c2ccccc2 Amb18790941 [0,1,0,1,0,0|1,0,0]=3 6359 B14R2.114 OC(C1CCSC1)c2ccccc2 Amb24735457 [0,1,0,1,0,0|1,0,0]=3 6360 B14R2.114 OC([C@@H]1CCCN1)c2cccc[n]2 Amb24594732 [0,1,0,1,0,0|1,0,0]=3 6361 B14R2.114 OC([C@H]1CCCN1)c2ccccc2 Amb25719320 [0,1,0,1,0,0|0,0,0]=2 6362 B14R2.114 OC([C@H]1CCCO1)c2cccc[n]2 Amb24675328 [0,1,0,1,0,0|2,0,0]=4 6363 B14R2.114 OC(c1ccccc1)C2CCCC2 Amb17138792 [0,1,0,1,0,0|1,0,0]=3 6364 B14R2.114 OC(c1ccccc1)C2CCCN2 Amb17138819 [0,1,0,1,0,0|0,0,0]=2 6365 B14R2.114 OC(c1ccccc1)C=2CCCC2 Amb18808383 [0,1,0,1,0,0|1,0,1]=4 6366 B14R2.114 OC(c1ccccc1)C=2CCOC2 Amb25118599 [0,1,0,1,0,0|1,0,1]=4 6367 B14R2.114 OC(c1ccccc1)N2CCCC2 Amb25680669 [0,1,0,1,0,0|2,0,0]=4 6368 B14R2.114 OC(c1cccnc1)C2CCCC2 Amb17233268 [0,1,0,1,0,0|2,0,0]=4 6369 B14R2.114 OC(c1cccnc1)C2CCCN2 Amb17233438 [0,1,0,1,0,0|1,0,0]=3 6370 B14R2.114 O[C@@H](C1CCNC1)c2ccccc2 Amb25082591 [0,1,0,1,0,0|0,0,0]=2 6371 B14R2.114 O[C@@H]([C@@H]1CCCN1)c2ccccc2 Amb25294762 [0,1,0,1,0,0|0,0,0]=2 6372 B14R2.114 O[C@@H]([C@@H]1CCCO1)c2ccccc2 Amb25176419 [0,1,0,1,0,0|1,0,0]=3 6373 B14R2.114 O[C@@H]([C@@H]1COCO1)c2ccccc2 Amb25206342 [0,1,0,1,0,0|1,0,0]=3 6374 B14R2.114 O[C@@H]([C@H]1CCC=C1)c2ccccc2 Amb25236561 [0,1,0,1,0,0|1,0,0]=3 6375 B14R2.114 O[C@@H]([C@H]1CCCN1)c2ccccc2 Amb24680163 [0,1,0,1,0,0|0,0,0]=2 6376 B14R2.114 O[C@@H]([C@H]1CCCO1)c2ccccc2 Amb25176420 [0,1,0,1,0,0|1,0,0]=3 6377 B14R2.114 O[C@@H]([C@H]1COCO1)c2ccccc2 Amb25345020 [0,1,0,1,0,0|1,0,0]=3 6378 B14R2.114 O[C@H](C1CCCC1)c2ccccc2 Amb25089275 [0,1,0,1,0,0|1,0,0]=3 6379 B14R2.114 O[C@H](C=1NCCN1)c2ccccc2 Amb24495655 [0,1,0,1,0,0|0,0,1]=3 6380 B14R2.114 O[C@H]([C@H]1CCCN1)c2ccccc2 Amb25238672 [0,1,0,1,0,0|0,0,0]=2 6381 B14R2.114 O[C@H]([C@H]1CCCO1)c2ccccc2 Amb24575609 [0,1,0,1,0,0|1,0,0]=3 6382 B14R2.187 CC1(C(N)C1OC)c2ccccc2 Amb23538783 [0,1,0,1,0,0|2,0,0]=4 6383 B14R2.187 C[C@]1([C@@H](Cl)[C@@H]1SC)c2ccccc2 Amb25313120 [0,1,0,1,0,0|2,0,0]=4 6384 B14R2.187 C[C@]1([C@H](Cl)[C@H]1SC)c2ccccc2 Amb24640377 [0,1,0,1,0,0|2,0,0]=4 6385 B14R2.279 CC1CCCc2ccccc2C1Br Amb25680997 [0,1,0,1,0,0|2,0,0]=4 6386 B14R2.279 CC1CCCc2ccccc2C1Cl Amb19080527 [0,1,0,1,0,0|2,0,0]=4 6387 B14R2.279 CC1CCCc2ccccc2C1N Amb18943813 [0,1,0,1,0,0|2,0,0]=4 6388 B14R2.279 CC1CCCc2ccccc2C1O Amb18808900 [0,1,0,1,0,0|1,0,0]=3 6389 B14R2.279 NC1CCCc2c(C1O)cccc2 Amb2383091 [0,1,0,1,0,0|2,0,0]=4 6390 B14R2.279 NC1CCCc2ccccc2C1O Amb22586254 [0,1,0,1,0,0|2,0,0]=4 6391 B14R2.279 NC1CCOc2c(C1O)cccc2 Amb17578309 [0,1,0,1,0,0|2,0,0]=4 6392 B14R2.279 NC1CCOc2ccccc2C1O Amb22035228 [0,1,0,1,0,0|2,0,0]=4 6393 B14R2.279 NC1CCSc2ccccc2C1O Amb24694142 [0,1,0,1,0,0|2,0,0]=4 6394 B14R2.279 NC1CSCc2ccccc2C1O Amb25689778 [0,1,0,1,0,0|2,0,0]=4 6395 B14R2.279 N[C@H]1CCCc2ccccc2[C@H]1O Amb25339685 [0,1,0,1,0,0|2,0,0]=4 6396 B14R2.279 N[C@H]1CCOc2ccccc2[C@H]1O Amb24745858 [0,1,0,1,0,0|2,0,0]=4 6397 B14R2.279 N[C@H]1CCSc2ccccc2[C@@H]1O Amb24628990 [0,1,0,1,0,0|2,0,0]=4 6398 B14R2.279 OC1C(Br)CCOc2ccccc21 Amb22229675 [0,1,0,1,0,0|2,0,0]=4 6399 B14R2.279 OC1C(O)CCCc2ccccc21 Amb24533602 [0,1,0,1,0,0|2,0,0]=4 6400 B14R2.279 OC1C(S)CCCc2ccccc21 Amb24544435 [0,1,0,1,0,0|2,0,0]=4 6401 B14R2.279 O[C@@H]1[C@H](O)CCCc2ccccc21 Amb25245106 [0,1,0,1,0,0|2,0,0]=4 6402 B14R2.279 O[C@@H]1[C@H](O)CNCc2ccccc21 Amb24691660 [0,1,0,1,0,0|1,0,0]=3 6403 B14R2.279 O[C@H]1[C@H](O)CCCc2ccccc21 Amb24515338 [0,1,0,1,0,0|2,0,0]=4 6404 B14R2.317 CC1(OCCC1Cl)c2ccccc2 Amb24711242 [0,1,0,1,0,0|2,0,0]=4 6405 B14R2.317 CC1CCCC1(C)c2ccccc2 Amb24694087 [0,1,0,1,0,0|2,0,0]=4 6406 B14R2.317 CC1CCCC1(O)c2c[n]ccc2 Amb25678329 [0,1,0,1,0,0|2,0,0]=4 6407 B14R2.317 CC1CSCC1(O)c2c[n]ccc2 Amb25073775 [0,1,0,1,0,0|2,0,0]=4 6408 B14R2.317 CC1NCCC1(O)c2cc[n]c[n]2 Amb24396189 [0,1,0,1,0,0|2,0,0]=4 6409 B14R2.317 CC1OCCC1(O)c2c[n]ccc2 Amb25765492 [0,1,0,1,0,0|2,0,0]=4 6410 B14R2.317 CN1CCOC1(C)c2ccccc2 Amb25280070 [0,1,0,1,0,0|2,0,0]=4 6411 B14R2.317 C[C@H]1CCC[C@@]1(C)c2ccccc2 Amb24589220 [0,1,0,1,0,0|2,0,0]=4 6412 B14R2.317 C[C@]1(OCC[C@@H]1Cl)c2ccccc2 Amb25258381 [0,1,0,1,0,0|2,0,0]=4 6413 B14R2.317 NC1CCCC1(O)c2ccccc2 Amb18127986 [0,1,0,1,0,0|2,0,0]=4 6414 B14R2.317 N[C@H]1CCC[C@@]1(O)c2ccccc2 Amb24607370 [0,1,0,1,0,0|2,0,0]=4 6415 B14R2.317 O[C@@H]1CCC[C@@]1(O)c2ccccc2 Amb25280168 [0,1,0,1,0,0|2,0,0]=4 6416 B14R2.317 O[C@@H]1COC[C@@]1(O)c2ccccc2 Amb25306524 [0,1,0,1,0,0|2,0,0]=4 6417 B14R2.422 CC1CC(C1)C(O)c2ccccc2 Amb23590251 [0,1,0,1,0,0|1,0,0]=3 6418 B14R2.422 O[C@@H]([C@H]1CC(=O)N1)c2ccccc2 Amb25350566 [0,1,0,1,0,0|0,0,1]=3 6419 B14R2.433 C[C@@H]1NC(=O)[C@]1(Cl)c2ccccc2 Amb25179923 [0,1,0,1,0,0|1,0,1]=4 6420 B14R2.564 CCCC1CC1(O)c2c[n]ccc2 Amb24476262 [0,1,0,1,0,0|2,0,0]=4 6421 B14R2.564 CCCC1CC1(O)c2cccc[n]2 Amb24625469 [0,1,0,1,0,0|2,0,0]=4 6422 B14R2.564 CCCC1CC1(O)c2ccccc2 Amb25761756 [0,1,0,1,0,0|1,0,0]=3 6423 B14R2.564 CNCC1CC1(C)c2c[n]ccc2 Amb18995737 [0,1,0,1,0,0|2,0,0]=4 6424 B14R2.564 CNCC1CC1(C)c2cc[n]cc2 Amb18300521 [0,1,0,1,0,0|2,0,0]=4 6425 B14R2.564 CNCC1CC1(C)c2cccc[n]2 Amb18995735 [0,1,0,1,0,0|2,0,0]=4 6426 B14R2.564 CNCC1CC1(C)c2ccccc2 Amb18300531 [0,1,0,1,0,0|1,0,0]=3 6427 B14R2.564 NCC[C@@H]1C[C@]1(F)c2ccccc2 Amb24540922 [0,1,0,1,0,0|2,0,0]=4 6428 B14R2.564 N[C@@]1(C[C@@H]1CCO)c2ccccc2 Amb25205069 [0,1,0,1,0,0|2,0,0]=4 6429 B14R2.564 OCC[C@@H]1C[C@]1(O)c2ccccc2 Amb25333657 [0,1,0,1,0,0|1,0,0]=3 6430 B14R2.598 CC1=C[C@@H](O)O[C@H]1c2ccccc2 Amb24520097 [0,1,0,1,0,0|1,0,1]=4 6431 B14R2.598 CC1=C[C@H](O)O[C@H]1c2ccccc2 Amb24520098 [0,1,0,1,0,0|1,0,1]=4 6432 B14R2.598 CC1CC(O)OC1c2ccccc2 Amb25369358 [0,1,0,1,0,0|1,0,0]=3 6433 B14R2.598 CC1CC(O)ON1c2ccccc2 Amb24448061 [0,1,0,1,0,0|2,0,0]=4 6434 B14R2.598 CC1N=C(N)OC1c2ccccc2 Amb22055741 [0,1,0,1,0,0|0,0,2]=4 6435 B14R2.598 CC1NC(=O)OC1c2cc[n]cc2 Amb25765525 [0,1,0,1,0,0|1,0,1]=4 6436 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,1,0,1,0,0|0,0,1]=3 6437 B14R2.598 CC1NC(=S)NC1c2ccccc2 Amb25695491 [0,1,0,1,0,0|1,0,1]=4 6438 B14R2.598 CC1NC(=S)SC1c2ccccc2 Amb25055712 [0,1,0,1,0,0|0,1,1]=4 6439 B14R2.598 CC1NC(C)C=C1c2ccccc2 Amb24489052 [0,1,0,1,0,0|1,0,1]=4 6440 B14R2.598 CC1NC(C)CC1c2ccccc2 Amb19375040 [0,1,0,1,0,0|1,0,0]=3 6441 B14R2.598 CC1NC(C)CC1c2ccccc2 Amb22059523 [0,1,0,1,0,0|1,0,0]=3 6442 B14R2.598 CC1OC(=O)OC1c2ccccc2 Amb25263220 [0,1,0,1,0,0|1,0,1]=4 6443 B14R2.598 CC1O[C@H](C(O)O1)c2ccccc2 Amb24495604 [0,1,0,1,0,0|2,0,0]=4 6444 B14R2.598 CC=1NC(C(C)N1)c2ccccc2 Amb25808989 [0,1,0,1,0,0|1,0,1]=4 6445 B14R2.598 CC=1N[C@H]([C@H](C)N1)c2ccccc2 Amb25208406 [0,1,0,1,0,0|1,0,1]=4 6446 B14R2.598 CN1CC(C(N)C1)c2ccccc2 Amb18196529 [0,1,0,1,0,0|2,0,0]=4 6447 B14R2.598 CN1CC(C(N)C1)c2ccccc2 Amb20622384 [0,1,0,1,0,0|2,0,0]=4 6448 B14R2.598 C[C@@H]1C[C@@H](O)O[C@H]1c2ccccc2 Amb24577389 [0,1,0,1,0,0|1,0,0]=3 6449 B14R2.598 C[C@@H]1N=C(N)O[C@@H]1c2ccccc2 Amb25275397 [0,1,0,1,0,0|0,0,2]=4 6450 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2cc[n]cc2 Amb25265359 [0,1,0,1,0,0|1,0,1]=4 6451 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,1,0,1,0,0|0,0,1]=3 6452 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,1,0,1,0,0|0,0,1]=3 6453 B14R2.598 C[C@@H]1NC(=S)O[C@H]1c2ccccc2 Amb25179922 [0,1,0,1,0,0|0,0,1]=3 6454 B14R2.598 C[C@@H]1N[C@H](C)O[C@@H]1c2ccccc2 Amb24512029 [0,1,0,1,0,0|0,0,0]=2 6455 B14R2.598 C[C@H]1C[C@H](O)O[C@H]1c2ccccc2 Amb24588388 [0,1,0,1,0,0|1,0,0]=3 6456 B14R2.598 C[C@H]1NC(=O)OC1c2ccccc2 Amb24534608 [0,1,0,1,0,0|0,0,1]=3 6457 B14R2.598 C[C@H]1NC(=O)S[C@@H]1c2ccccc2 Amb24599009 [0,1,0,1,0,0|0,1,1]=4 6458 B14R2.598 C[C@H]1NC(=O)S[C@H]1c2ccccc2 Amb24610222 [0,1,0,1,0,0|0,1,1]=4 6459 B14R2.598 C[C@H]1NC(=S)O[C@H]1c2cc[n]cc2 Amb24591175 [0,1,0,1,0,0|1,0,1]=4 6460 B14R2.598 C[C@H]1NC(=S)S[C@@H]1c2ccccc2 Amb24582097 [0,1,0,1,0,0|0,1,1]=4 6461 B14R2.598 C[C@H]1NC(=S)S[C@H]1c2ccccc2 Amb24567126 [0,1,0,1,0,0|0,1,1]=4 6462 B14R2.598 C[C@H]1N[C@H](C)O[C@H]1c2ccccc2 Amb25364240 [0,1,0,1,0,0|0,0,0]=2 6463 B14R2.822 C[C@@]1(CCO)C[C@@H]1c2ccccc2 Amb25175291 [0,1,0,1,0,0|2,0,0]=4 6464 B14R2.15692 CC1(CCC1)C(O)c2ccccc2 Amb25179990 [0,1,0,1,0,0|1,0,0]=3 6465 B14R2.15692 CC1(CNC1)C(=O)c2ccccc2 Amb24622651 [0,1,0,1,0,0|0,0,2]=4 6466 B14R2.15692 NC(c1ccccc1)C2(O)CCC2 Amb22227644 [0,1,0,1,0,0|2,0,0]=4 6467 B14R2.15694 CC(C(Cl)c1ccccc1)C2CC2 Amb25127200 [0,1,0,1,0,0|2,0,0]=4 6468 B14R2.15694 CC(C(O)c1ccc[n]c1)C2CC2 Amb25158887 [0,1,0,1,0,0|2,0,0]=4 6469 B14R2.15694 CC(C(O)c1ccccc1)=C2CC2 Amb24495459 [0,1,0,1,0,0|1,0,1]=4 6470 B14R2.15694 CC(C(O)c1ccccc1)C2CC2 Amb25144914 [0,1,0,1,0,0|1,0,0]=3 6471 B14R2.15694 C[C@H]([C@H](O)c1ccccc1)[C@@H]2CO2 Amb24576955 [0,1,0,1,0,0|1,0,0]=3 6472 B14R2.15694 NC(C(O)c1ccccc1)C2CC2 Amb24745304 [0,1,0,1,0,0|2,0,0]=4 6473 B14R2.15694 OC(C(O)C1CC1)c2ccccc2 Amb25791802 [0,1,0,1,0,0|2,0,0]=4 6474 B14R2.15694 OC(C(O)C1CO1)c2ccccc2 Amb25343564 [0,1,0,1,0,0|2,0,0]=4 6475 B14R2.15694 O[C@@H]([C@H](O)[C@@H]1CO1)c2ccccc2 Amb24661272 [0,1,0,1,0,0|2,0,0]=4 6476 B14R2.19306 CC1C(N)c2ccccc2C1CC Amb25784874 [0,1,0,1,0,0|2,0,0]=4 6477 B14R2.19306 CC1C(NC)c2ccccc2S1=O Amb18324890 [0,1,0,1,0,0|1,0,1]=4 6478 B14R2.19306 CC1[C@H](O)c2ccccc2C1CC Amb24735073 [0,1,0,1,0,0|1,0,0]=3 6479 B14R2.19306 CCN1C(=O)C(O)c2ccccc12 Amb24496957 [0,1,0,1,0,0|1,0,1]=4 6480 B14R2.19306 CCN1C(O)C(O)c2ccccc12 Amb25285708 [0,1,0,1,0,0|1,0,0]=3 6481 B14R2.19306 CN1C(=O)C(CO)c2ccccc12 Amb24495886 [0,1,0,1,0,0|1,0,1]=4 6482 B14R2.19306 CNC1C(C)C(C)c2ccccc21 Amb24445858 [0,1,0,1,0,0|1,0,0]=3 6483 B14R2.19306 COC1C(=O)N(C)c2ccccc21 Amb25072825 [0,1,0,1,0,0|1,0,1]=4 6484 B14R2.19306 Cc1c(CO)c2ccccc2[n]1C Amb18224487 [0,1,0,1,0,0|0,0,2]=4 6485 B14R2.33858 CC(NCC)C1Cc2ccccc21 Amb25724844 [0,1,0,1,0,0|1,0,0]=3 6486 B14R2.14 CCC1CNCC1c2ccccc2 Amb24563782 [0,1,0,1,0,0|2,0,0]=4 6487 B14R2.14 CCC1NCCC1c2c[n]ccc2 Amb18285679 [0,1,0,1,0,0|2,0,0]=4 6488 B14R2.14 CCC1NCCC1c2cc[n]cc2 Amb18285677 [0,1,0,1,0,0|2,0,0]=4 6489 B14R2.14 CCC1NCCC1c2cccc[n]2 Amb18285663 [0,1,0,1,0,0|2,0,0]=4 6490 B14R2.14 CCC1NCCC1c2ccccc2 Amb18285662 [0,1,0,1,0,0|1,0,0]=3 6491 B14R2.14 CNC1CCCC1c2c[n]ccc2 Amb18962686 [0,1,0,1,0,0|2,0,0]=4 6492 B14R2.14 CNC1CCCC1c2ccccc2 Amb18286605 [0,1,0,1,0,0|1,0,0]=3 6493 B14R2.14 COC1CNCC1c2ccccc2 Amb24496970 [0,1,0,1,0,0|2,0,0]=4 6494 B14R2.14 CO[C@@H]1CNC[C@H]1c2ccccc2 Amb20241554 [0,1,0,1,0,0|2,0,0]=4 6495 B14R2.14 ClCC1CCOC1c2ccc[n]c2 Amb24489816 [0,1,0,1,0,0|2,0,0]=4 6496 B14R2.14 ClCC1CCOC1c2ccccc2 Amb25698101 [0,1,0,1,0,0|1,0,0]=3 6497 B14R2.14 N#CC1CCOC1c2ccccc2 Amb25304820 [0,1,0,1,0,0|1,0,1]=4 6498 B14R2.14 N#CC1NCCC1c2ccccc2 Amb25242558 [0,1,0,1,0,0|1,0,1]=4 6499 B14R2.14 NCC1CCNC1c2ccccc2 Amb18196530 [0,1,0,1,0,0|2,0,0]=4 6500 B14R2.14 NCC1CCOC1c2ccccc2 Amb19335842 [0,1,0,1,0,0|1,0,0]=3 6501 B14R2.14 NC[C@@H]1CCO[C@H]1c2ccccc2 Amb25168772 [0,1,0,1,0,0|1,0,0]=3 6502 B14R2.14 NC[C@H]1OCC[C@H]1c2ccccc2 Amb25176333 [0,1,0,1,0,0|2,0,0]=4 6503 B14R2.14 O=CC1CCOC1c2ccccc2 Amb18127702 [0,1,0,1,0,0|1,0,1]=4 6504 B14R2.14 OCC1C=COC1c2ccccc2 Amb25739819 [0,1,0,1,0,0|1,0,1]=4 6505 B14R2.14 OCC1CCCC1c2ccccc2 Amb24363590 [0,1,0,1,0,0|2,0,0]=4 6506 B14R2.14 OCC1CCOC1c2ccccc2 Amb25118296 [0,1,0,1,0,0|1,0,0]=3 6507 B14R2.14 OCC1NCCC1c2c[n]ccc2 Amb25753074 [0,1,0,1,0,0|2,0,0]=4 6508 B14R2.14 OCC1NCCC1c2cc[n]cc2 Amb25107874 [0,1,0,1,0,0|2,0,0]=4 6509 B14R2.14 OC[C@@H]1CCC[C@@H]1c2ccccc2 Amb25215686 [0,1,0,1,0,0|2,0,0]=4 6510 B14R2.14 OC[C@@H]1NCC[C@H]1c2ccccc2 Amb25374056 [0,1,0,1,0,0|1,0,0]=3 6511 B14R2.14 OC[C@H]1C=CO[C@H]1c2ccccc2 Amb24515325 [0,1,0,1,0,0|1,0,1]=4 6512 B14R2.14 OC[C@H]1CCO[C@H]1c2ccccc2 Amb25226391 [0,1,0,1,0,0|1,0,0]=3 6513 B14R2.14 OC[C@H]1NCC[C@@H]1c2ccccc2 Amb22265795 [0,1,0,1,0,0|1,0,0]=3 6514 B14R2.92 C#C[C@@H]1CCc2ccccc2[C@@H]1O Amb24515582 [0,1,0,1,0,0|1,0,1]=4 6515 B14R2.92 C=CC1COc2ccccc2C1O Amb24544418 [0,1,0,1,0,0|1,0,1]=4 6516 B14R2.92 C=C[C@@H]1COc2ccccc2[C@@H]1O Amb25176814 [0,1,0,1,0,0|1,0,1]=4 6517 B14R2.92 CC1C(CC)NCc2ccccc21 Amb18127527 [0,1,0,1,0,0|1,0,0]=3 6518 B14R2.92 CCC1CCc2ccccc2C1Cl Amb19080528 [0,1,0,1,0,0|2,0,0]=4 6519 B14R2.92 CCC1CCc2ccccc2C1O Amb18808899 [0,1,0,1,0,0|1,0,0]=3 6520 B14R2.92 CCC1SCc2ccccc2C1O Amb25332649 [0,1,0,1,0,0|1,0,0]=3 6521 B14R2.92 CC[C@H]1C=Cc2ccccc2[C@H]1O Amb24698658 [0,1,0,1,0,0|1,0,1]=4 6522 B14R2.92 CNC1CCc2ccccc2C1=O Amb24696513 [0,1,0,1,0,0|0,0,2]=4 6523 B14R2.92 CNC1COc2ccccc2C1O Amb25758910 [0,1,0,1,0,0|0,0,0]=2 6524 B14R2.92 CN[C@H]1CCc2ccccc2[C@@H]1O Amb24563825 [0,1,0,1,0,0|0,0,0]=2 6525 B14R2.92 COC1CCc2ccccc2C1O Amb18186192 [0,1,0,1,0,0|1,0,0]=3 6526 B14R2.92 COC1COc2ccccc2C1O Amb18809299 [0,1,0,1,0,0|1,0,0]=3 6527 B14R2.92 CO[C@@H]1C=Cc2ccccc2C1O Amb24495723 [0,1,0,1,0,0|1,0,1]=4 6528 B14R2.92 CO[C@@H]1C=Cc2ccccc2[C@H]1O Amb24566208 [0,1,0,1,0,0|1,0,1]=4 6529 B14R2.92 CO[C@H]1C=Cc2ccccc2C1O Amb25788918 [0,1,0,1,0,0|1,0,1]=4 6530 B14R2.92 CO[C@H]1C=Cc2ccccc2[C@@H]1O Amb24595802 [0,1,0,1,0,0|1,0,1]=4 6531 B14R2.92 CSC1CCc2ccccc2C1N Amb24577124 [0,1,0,1,0,0|2,0,0]=4 6532 B14R2.92 CSC1COc2ccccc2C1N Amb25105308 [0,1,0,1,0,0|2,0,0]=4 6533 B14R2.92 C[C@@H]1[C@@H](CCc2ccccc21)CO Amb25333391 [0,1,0,1,0,0|2,0,0]=4 6534 B14R2.92 N#CC1CCc2ccccc2C1O Amb25191705 [0,1,0,1,0,0|1,0,1]=4 6535 B14R2.92 N#CC1COc2ccccc2C1O Amb25266789 [0,1,0,1,0,0|2,0,0]=4 6536 B14R2.92 N#C[C@@H]1CCc2ccccc2[C@@H]1O Amb25226314 [0,1,0,1,0,0|1,0,1]=4 6537 B14R2.92 NCC1CNc2ccccc2C1O Amb18063868 [0,1,0,1,0,0|2,0,0]=4 6538 B14R2.92 NCC1COc2ccccc2C1O Amb18561744 [0,1,0,1,0,0|2,0,0]=4 6539 B14R2.215 CC1C(CC)C(O)c2ccccc21 Amb24474268 [0,1,0,1,0,0|1,0,0]=3 6540 B14R2.215 COC1C(=O)c2ccccc2N1C Amb24078920 [0,1,0,1,0,0|0,0,2]=4 6541 B14R2.215 NCC1C(C)c2c(N1C)cccc2 Amb10562322 [0,1,0,1,0,0|1,0,0]=3 6542 B14R2.3469 C=CC1(CC1)C(O)c2ccccc2 Amb25803022 [0,1,0,1,0,0|1,0,1]=4 6543 B14R2.3469 CCC1(CC1)C(Br)c2ccccc2 Amb25699510 [0,1,0,1,0,0|2,0,0]=4 6544 B14R2.3469 CCC1(CC1)C(Cl)c2ccccc2 Amb25847394 [0,1,0,1,0,0|2,0,0]=4 6545 B14R2.3469 CCC1(CC1)C(N)c2ccccc2 Amb25761703 [0,1,0,1,0,0|2,0,0]=4 6546 B14R2.3469 CCC1(CC1)C(O)c2ccccc2 Amb24495780 [0,1,0,1,0,0|1,0,0]=3 6547 B14R2.3469 CSC1(CC1)C(O)c2c[n]ccc2 Amb25753299 [0,1,0,1,0,0|2,0,0]=4 6548 B14R2.3469 N#CC1(CC1)C(O)c2ccccc2 Amb22755208 [0,1,0,1,0,0|1,0,1]=4 6549 B14R2.3469 OCC1(CC1)C(O)c2ccccc2 Amb25787221 [0,1,0,1,0,0|1,0,0]=3 6550 B14R2.3510 CCC1(C=O)OC1c2ccccc2 Amb24584540 [0,1,0,1,0,0|1,0,1]=4 6551 B14R2.3510 CC[C@]1(C=O)O[C@@H]1c2ccccc2 Amb24574748 [0,1,0,1,0,0|1,0,1]=4 6552 B14R2.3510 NCC1(C#N)OC1c2ccccc2 Amb24374774 [0,1,0,1,0,0|2,0,0]=4 6553 B14R2.30431 CCC(NN)C1Cc2ccccc21 Amb24602210 [0,1,0,1,0,0|2,0,0]=4 6554 B14R2.450 CC(=O)C1Oc2ccccc2C1O Amb25767041 [0,1,0,1,0,0|2,0,0]=4 6555 B14R2.450 CC(C)C1Oc2ccccc2C1O Amb25051286 [0,1,0,1,0,0|2,0,0]=4 6556 B14R2.450 CC(C)[C@H]1Oc2ccccc2[C@@H]1O Amb25220579 [0,1,0,1,0,0|2,0,0]=4 6557 B14R2.450 CC(O)C1Cc2ccccc2C1O Amb25740515 [0,1,0,1,0,0|1,0,0]=3 6558 B14R2.450 CN(C)C1Cc2ccccc2C1O Amb18808991 [0,1,0,1,0,0|0,0,0]=2 6559 B14R2.450 CN(C)[C@H]1Cc2ccccc2[C@@H]1O Amb25271379 [0,1,0,1,0,0|0,0,0]=2 6560 B14R2.450 CN(C1Cc2c(C1N)cccc2)C Amb1125596 [0,1,0,1,0,0|1,0,0]=3 6561 B14R2.450 CN(N)[C@H]1Cc2ccccc2[C@@H]1O Amb24719583 [0,1,0,1,0,0|0,0,0]=2 6562 B14R2.450 C[C@@H](O)[C@@H]1Cc2ccccc2[C@@H]1O Amb24515211 [0,1,0,1,0,0|1,0,0]=3 6563 B14R2.450 C[C@@H](O)[C@H]1Cc2ccccc2[C@H]1O Amb24515213 [0,1,0,1,0,0|1,0,0]=3 6564 B14R2.450 C[C@H](O)[C@H]1Cc2ccccc2[C@H]1O Amb24577087 [0,1,0,1,0,0|1,0,0]=3 6565 B14R2.780 CC(=O)C1CCC1c2ccccc2 Amb24548830 [0,1,0,1,0,0|2,0,0]=4 6566 B14R2.780 CC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24724006 [0,1,0,1,0,0|2,0,0]=4 6567 B14R2.780 CC(C)C1CNC1c2ccccc2 Amb25265563 [0,1,0,1,0,0|2,0,0]=4 6568 B14R2.786 CC(=O)C1(C)CC1c2ccccc2 Amb25231294 [0,1,0,1,0,0|2,0,0]=4 6569 B14R2.786 CC(=O)[C@]1(C)C[C@@H]1c2ccccc2 Amb24617250 [0,1,0,1,0,0|2,0,0]=4 6570 B14R2.786 CC1(OC1c2ccccc2)C(=O)Cl Amb24366113 [0,1,0,1,0,0|2,0,0]=4 6571 B14R2.786 C[C@@]1(O[C@@H]1c2ccccc2)C(=O)Cl Amb24559917 [0,1,0,1,0,0|2,0,0]=4 6572 B14R2.786 C[C@]1(O[C@H]1c2ccccc2)C(N)=O Amb24591298 [0,1,0,1,0,0|2,0,0]=4 6573 B14R2.6178 CC(C)C1(C)C(O)c2ccccc12 Amb24474997 [0,1,0,1,0,0|1,0,0]=3 6574 B14R2.9520 CC(C)C1CC1(N)c2ccccc2 Amb25157135 [0,1,0,1,0,0|2,0,0]=4 6575 B14R2.9520 CC(N)C1CC1(C)c2ccccc2 Amb24730697 [0,1,0,1,0,0|2,0,0]=4 6576 B14R2.9520 CC(O)C1CC1(C)c2ccccc2 Amb25317429 [0,1,0,1,0,0|2,0,0]=4 6577 B14R2.9520 CC(O)[C@@H]1C[C@]1(C)c2ccccc2 Amb24705865 [0,1,0,1,0,0|2,0,0]=4 6578 B14R2.9520 C[C@@H](N)[C@@H]1C[C@@]1(C)c2ccccc2 Amb24612633 [0,1,0,1,0,0|2,0,0]=4 6579 B14R2.9520 C[C@H](N)[C@H]1C[C@]1(C)c2ccccc2 Amb24619576 [0,1,0,1,0,0|2,0,0]=4 6580 B14R2.15693 CC1(C)CC1C(Br)c2ccccc2 Amb24718270 [0,1,0,1,0,0|2,0,0]=4 6581 B14R2.15693 CC1(C)CC1C(Cl)c2ccccc2 Amb25084451 [0,1,0,1,0,0|2,0,0]=4 6582 B14R2.15693 CC1(C)CC1C(N)c2ccccc2 Amb23590882 [0,1,0,1,0,0|2,0,0]=4 6583 B14R2.15693 CC1(C)CC1C(O)c2ccccc2 Amb25713312 [0,1,0,1,0,0|1,0,0]=3 6584 B14R2.15693 CC1(C)OC1C(O)c2ccccc2 Amb24648165 [0,1,0,1,0,0|2,0,0]=4 6585 B14R2.15693 CC1(O)CC1C(O)c2ccccc2 Amb25296234 [0,1,0,1,0,0|1,0,0]=3 6586 B14R2.15693 C[C@@]1(O)C[C@@H]1[C@H](O)c2ccccc2 Amb24698614 [0,1,0,1,0,0|1,0,0]=3 6587 B14R2.57380 CC1N(C)c2ccccc2C1(C)C Amb19394422 [0,1,0,1,0,0|1,0,0]=3 6588 B14R2.57380 CN1C(O)C(C)(C)c2ccccc12 Amb17778658 [0,1,0,1,0,0|2,0,0]=4 6589 B14R2.333 CC1(C)CCNC1c2ccccc2 Amb18280539 [0,1,0,1,0,0|2,0,0]=4 6590 B14R2.333 CC1(C)NCCC1c2c[n]ccc2 Amb18279983 [0,1,0,1,0,0|2,0,0]=4 6591 B14R2.333 CC1(C)NCCC1c2cc[n]cc2 Amb18279982 [0,1,0,1,0,0|2,0,0]=4 6592 B14R2.333 CC1(C)NCCC1c2cccc[n]2 Amb18279948 [0,1,0,1,0,0|2,0,0]=4 6593 B14R2.333 CC1(C)NCCC1c2ccccc2 Amb18279937 [0,1,0,1,0,0|1,0,0]=3 6594 B14R2.2969 CC1(CO)OCC1c2ccccc2 Amb24414910 [0,1,0,1,0,0|2,0,0]=4 6595 B14R2.2969 CCC1(C)CNC1c2ccccc2 Amb24372749 [0,1,0,1,0,0|2,0,0]=4 6596 B14R2.2969 C[C@@]1(CO)OC[C@@H]1c2ccccc2 Amb25306643 [0,1,0,1,0,0|2,0,0]=4 6597 B14R2.2969 C[C@]1(CCl)CO[C@H]1c2ccccc2 Amb25179040 [0,1,0,1,0,0|2,0,0]=4 6598 B14R2.3512 CC1(C=O)Oc2ccccc2C1O Amb24588960 [0,1,0,1,0,0|2,0,0]=4 6599 B14R2.3512 C[C@]1(Cc2ccccc2[C@@H]1O)CO Amb24547010 [0,1,0,1,0,0|2,0,0]=4 6600 B14R2.3512 C[C@]1(Cc2ccccc2[C@H]1O)CO Amb25292300 [0,1,0,1,0,0|2,0,0]=4 6601 B14R2.4654 CC1(C)CCC1(O)c2c[n]ccc2 Amb25153107 [0,1,0,1,0,0|2,0,0]=4 6602 B14R2.4654 CC1(C)CCC1(O)c2ccccc2 Amb25196606 [0,1,0,1,0,0|1,0,0]=3 6603 B14R2.4654 CC1(C)NCC1(N)c2ccccc2 Amb25718550 [0,1,0,1,0,0|1,0,0]=3 6604 B14R2.6175 CC1(C)CCc2ccccc2C1N Amb22059730 [0,1,0,1,0,0|2,0,0]=4 6605 B14R2.6175 CC1(C)CSc2ccccc2C1O Amb24641637 [0,1,0,1,0,0|2,0,0]=4 6606 B14R2.6175 CC1(C)SCc2ccccc2C1O Amb25836468 [0,1,0,1,0,0|1,0,0]=3 6607 B14R2.6180 CC1(C)[C@@H](O)c2ccccc2C1O Amb25205093 [0,1,0,1,0,0|2,0,0]=4 6608 B14R2.6180 CC1(C)[C@H](O)c2ccccc2[C@@H]1O Amb25753158 [0,1,0,1,0,0|2,0,0]=4 6609 B14R2.6180 CC1c2c[n]ccc2C(O)C1(C)C Amb24592139 [0,1,0,1,0,0|2,0,0]=4 6610 B14R2.6180 CN1c2ccccc2C(=O)C1(C)C Amb24633353 [0,1,0,1,0,0|0,0,2]=4 6611 B14R2.84 OC1CC(CO)C1c2ccccc2 Amb24403758 [0,1,0,1,0,0|2,0,0]=4 6612 B14R2.95 CC(C=O)C1COc2ccccc21 Amb18196803 [0,1,0,1,0,0|2,0,0]=4 6613 B14R2.95 CC(CC)C1CNc2ccccc21 Amb25770435 [0,1,0,1,0,0|2,0,0]=4 6614 B14R2.95 CC(CC)C1NCc2ccccc21 Amb25104052 [0,1,0,1,0,0|2,0,0]=4 6615 B14R2.95 CC(NN)C1CSc2ccccc21 Amb25824549 [0,1,0,1,0,0|1,1,0]=4 6616 B14R2.95 CCC(O)C1COc2ccccc21 Amb25073885 [0,1,0,1,0,0|2,0,0]=4 6617 B14R2.95 CC[C@@H](N)C1COc2ccccc21 Amb24703178 [0,1,0,1,0,0|2,0,0]=4 6618 B14R2.95 CC[C@@H](O)C1COc2ccccc21 Amb25717323 [0,1,0,1,0,0|2,0,0]=4 6619 B14R2.95 CC[C@H](O)C1COc2ccccc21 Amb25304897 [0,1,0,1,0,0|2,0,0]=4 6620 B14R2.95 CNC(C)c1c[nH]c2ccccc12 Amb18243591 [0,1,0,1,0,0|1,0,1]=4 6621 B14R2.95 CNC(C)c1coc2ccccc21 Amb25342095 [0,1,0,1,0,0|0,0,1]=3 6622 B14R2.95 CN[C@@H](C)c1c[s]c2ccccc21 Amb25254716 [0,1,0,1,0,0|0,1,1]=4 6623 B14R2.203 CC/1CCc2ccccc2\C1=N/O Amb25702994 [0,1,0,1,0,0|1,0,1]=4 6624 B14R2.203 CC1C=Cc2ccccc2C1CO Amb24718472 [0,1,0,1,0,0|1,0,1]=4 6625 B14R2.203 CC1CCc2ccccc2C1NC Amb18279402 [0,1,0,1,0,0|2,0,0]=4 6626 B14R2.203 CC1CCc2ccccc2C1NN Amb24671928 [0,1,0,1,0,0|2,0,0]=4 6627 B14R2.203 CC1COc2ccccc2C1CO Amb25673793 [0,1,0,1,0,0|2,0,0]=4 6628 B14R2.203 CC1NCc2ccccc2C1CC Amb24709325 [0,1,0,1,0,0|1,0,0]=3 6629 B14R2.203 CC1OCc2ccccc2C1CN Amb25040978 [0,1,0,1,0,0|2,0,0]=4 6630 B14R2.203 CC1SCc2ccccc2C1NC Amb25832087 [0,1,0,1,0,0|2,0,0]=4 6631 B14R2.203 COC1c2ccccc2CCN1C Amb24496973 [0,1,0,1,0,0|2,0,0]=4 6632 B14R2.203 CO[C@@H]1[C@@H](O)CCc2ccccc21 Amb25233048 [0,1,0,1,0,0|2,0,0]=4 6633 B14R2.203 CO[C@@H]1[C@H](O)CCc2ccccc21 Amb24733486 [0,1,0,1,0,0|2,0,0]=4 6634 B14R2.203 C[C@@H]1C=Cc2ccccc2[C@@H]1CO Amb24515176 [0,1,0,1,0,0|1,0,1]=4 6635 B14R2.203 C[C@H]1C=Cc2ccccc2[C@H]1CO Amb24515177 [0,1,0,1,0,0|1,0,1]=4 6636 B14R2.277 CC1CCC(O)C1c2ccccc2 Amb25069604 [0,1,0,1,0,0|1,0,0]=3 6637 B14R2.277 CC1NCC(C)C1c2c[n]ccc2 Amb24548556 [0,1,0,1,0,0|2,0,0]=4 6638 B14R2.277 CC1NCC(C)C1c2cccc[n]2 Amb25231051 [0,1,0,1,0,0|2,0,0]=4 6639 B14R2.277 CC1NCC(C)C1c2ccccc2 Amb25260177 [0,1,0,1,0,0|1,0,0]=3 6640 B14R2.277 CN1CCC(O)C1c2ccccc2 Amb18824965 [0,1,0,1,0,0|2,0,0]=4 6641 B14R2.277 C[C@@H]1CCC(=O)[C@@H]1c2ccccc2 Amb25205730 [0,1,0,1,0,0|1,0,1]=4 6642 B14R2.277 C[C@H]1CCC(=O)[C@H]1c2ccccc2 Amb25373309 [0,1,0,1,0,0|1,0,1]=4 6643 B14R2.277 OC1CCC(O)C1c2ccccc2 Amb25180210 [0,1,0,1,0,0|2,0,0]=4 6644 B14R2.979 CNC(C)C1(CC1)c2ccccc2 Amb19002704 [0,1,0,1,0,0|1,0,0]=3 6645 B14R2.1033 C=CC1CC1(CO)c2ccccc2 Amb25051418 [0,1,0,1,0,0|1,0,1]=4 6646 B14R2.1033 C=C[C@H]1C[C@]1(CO)c2ccccc2 Amb25220631 [0,1,0,1,0,0|1,0,1]=4 6647 B14R2.1033 COC1(CC1CN)c2ccccc2 Amb23538752 [0,1,0,1,0,0|2,0,0]=4 6648 B14R2.1033 COC1(CC1CO)c2ccccc2 Amb23538751 [0,1,0,1,0,0|2,0,0]=4 6649 B14R2.1033 COC1(OC1CC)c2ccccc2 Amb24747174 [0,1,0,1,0,0|2,0,0]=4 6650 B14R2.1033 OC[C@@]1(C[C@@H]1CO)c2ccccc2 Amb25333464 [0,1,0,1,0,0|2,0,0]=4 6651 B14R2.1033 OC[C@]1(C[C@H]1CCl)c2ccccc2 Amb25172951 [0,1,0,1,0,0|2,0,0]=4 6652 B14R2.1033 OC[C@]1(C[C@H]1CO)c2ccccc2 Amb24576573 [0,1,0,1,0,0|2,0,0]=4 6653 B14R2.1129 CCC1Cc2ccccc2C1NC Amb18958578 [0,1,0,1,0,0|2,0,0]=4 6654 B14R2.1129 CNC1C(Cc2ccccc21)OC Amb18956889 [0,1,0,1,0,0|2,0,0]=4 6655 B14R2.1129 CNC1C(Cc2ccccc21)SC Amb25088061 [0,1,0,1,0,0|2,0,0]=4 6656 B14R2.1258 CC1CC1C(NN)c2ccccc2 Amb25267476 [0,1,0,1,0,0|2,0,0]=4 6657 B14R2.2850 BrCC(C1CCC1)c2ccccc2 Amb25772200 [0,1,0,1,0,0|2,0,0]=4 6658 B14R2.2850 ClCC(C1CCC1)c2ccccc2 Amb25224246 [0,1,0,1,0,0|2,0,0]=4 6659 B14R2.2850 NCC(c1ccccc1)C2CCC2 Amb17087352 [0,1,0,1,0,0|2,0,0]=4 6660 B14R2.2850 NNC(C1CCC1)c2ccccc2 Amb25777634 [0,1,0,1,0,0|2,0,0]=4 6661 B14R2.2850 O=CC(C1CCC1)c2ccccc2 Amb25839748 [0,1,0,1,0,0|1,0,1]=4 6662 B14R2.2850 OCC(C1CNC1)c2ccccc2 Amb25239037 [0,1,0,1,0,0|2,0,0]=4 6663 B14R2.3392 CC1CCC1(C#N)c2ccccc2 Amb25739183 [0,1,0,1,0,0|2,0,0]=4 6664 B14R2.3392 CC1CCC1(CN)c2ccccc2 Amb24489789 [0,1,0,1,0,0|2,0,0]=4 6665 B14R2.3392 OCC1(CNC1=O)c2ccccc2 Amb25791776 [0,1,0,1,0,0|1,0,1]=4 6666 B14R2.296 CC1CCNC1c2ccccc2Cl Amb24375417 [0,1,0,1,0,0|2,0,0]=4 6667 B14R2.296 CC1NCCC1c2ccccc2Br Amb18730965 [0,1,0,1,0,0|1,0,0]=3 6668 B14R2.296 CC1NCCC1c2ccccc2Cl Amb18280034 [0,1,0,1,0,0|1,0,0]=3 6669 B14R2.296 CC1NCCC1c2ccccc2F Amb18279917 [0,1,0,1,0,0|1,0,0]=3 6670 B14R2.296 CN1CCOC1c2ccccc2Br Amb24089579 [0,1,0,1,0,0|2,0,0]=4 6671 B14R2.296 CN1CCOC1c2ccccc2C Amb17335175 [0,1,0,1,0,0|2,0,0]=4 6672 B14R2.296 CN1CCOC1c2ccccc2F Amb17335481 [0,1,0,1,0,0|2,0,0]=4 6673 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2Br Amb18156536 [0,1,0,1,0,0|2,0,0]=4 6674 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2Cl Amb18189118 [0,1,0,1,0,0|2,0,0]=4 6675 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2F Amb18194451 [0,1,0,1,0,0|2,0,0]=4 6676 B14R2.296 C[C@@H]1CCN[C@H]1c2ccccc2O Amb18195878 [0,1,0,1,0,0|2,0,0]=4 6677 B14R2.296 Cc1cc[n]cc1C2CCNC2C Amb24637486 [0,1,0,1,0,0|2,0,0]=4 6678 B14R2.296 Cc1ccccc1C2CCNC2C Amb18279913 [0,1,0,1,0,0|1,0,0]=3 6679 B14R2.296 Cc1ccccc1[C@@H]2NCC[C@H]2C Amb18197089 [0,1,0,1,0,0|2,0,0]=4 6680 B14R2.4618 CC1CC1C(N)c2ccccc2Cl Amb25118484 [0,1,0,1,0,0|2,0,0]=4 6681 B14R2.4618 CC1CC1C(N)c2ccccc2F Amb25137557 [0,1,0,1,0,0|2,0,0]=4 6682 B14R2.4618 CC1CC1C(O)c2ccc[n]c2N Amb24474292 [0,1,0,1,0,0|2,0,0]=4 6683 B14R2.4618 CC1CC1C(O)c2ccccc2Cl Amb24367083 [0,1,0,1,0,0|1,0,0]=3 6684 B14R2.4618 CC1CC1C(O)c2ccccc2F Amb25104158 [0,1,0,1,0,0|1,0,0]=3 6685 B14R2.4618 Cc1cc[n]cc1C(O)C2CC2C Amb25726246 [0,1,0,1,0,0|2,0,0]=4 6686 B14R2.4618 Cc1ccccc1C(N)C2CC2C Amb25123083 [0,1,0,1,0,0|2,0,0]=4 6687 B14R2.4618 Cc1ccccc1C(O)C2CC2C Amb25082448 [0,1,0,1,0,0|1,0,0]=3 6688 B14R2.4628 CC1CCC1(N)c2ccccc2F Amb24758677 [0,1,0,1,0,0|2,0,0]=4 6689 B14R2.4628 CC1CCC1(O)c2c[n]ccc2N Amb24378837 [0,1,0,1,0,0|2,0,0]=4 6690 B14R2.4628 CC1CCC1(O)c2cc[n]cc2F Amb25153108 [0,1,0,1,0,0|2,0,0]=4 6691 B14R2.4628 CC1CCC1(O)c2ccc[n]c2N Amb25066655 [0,1,0,1,0,0|2,0,0]=4 6692 B14R2.4628 CC1CCC1(O)c2ccccc2Cl Amb24594897 [0,1,0,1,0,0|1,0,0]=3 6693 B14R2.4628 Cc1cc[n]cc1C2(O)CCC2C Amb24737986 [0,1,0,1,0,0|2,0,0]=4 6694 B14R2.7957 CC1(CC1)C(N)c2ccccc2Br Amb18731585 [0,1,0,1,0,0|2,0,0]=4 6695 B14R2.7957 CC1(CC1)C(N)c2ccccc2F Amb24434814 [0,1,0,1,0,0|2,0,0]=4 6696 B14R2.7957 CC1(CC1)C(O)c2c[n]ccc2N Amb24676926 [0,1,0,1,0,0|2,0,0]=4 6697 B14R2.7957 CC1(CC1)C(O)c2cc[n]cc2F Amb25313783 [0,1,0,1,0,0|2,0,0]=4 6698 B14R2.7957 CC1(CC1)C(O)c2ccccc2Cl Amb24720156 [0,1,0,1,0,0|1,0,0]=3 6699 B14R2.7957 Cc1ccccc1C(O)C2(C)CC2 Amb24526626 [0,1,0,1,0,0|1,0,0]=3 6700 B14R2.7957 OC1(CC1)C(O)c2ccccc2F Amb24752224 [0,1,0,1,0,0|2,0,0]=4 6701 B14R2.11166 CCC1CC1(N)c2ccccc2Br Amb24446140 [0,1,0,1,0,0|2,0,0]=4 6702 B14R2.11166 CCC1CC1(N)c2ccccc2O Amb24564171 [0,1,0,1,0,0|2,0,0]=4 6703 B14R2.11166 CCC1CC1(O)C2=CNC=CC2=O Amb25755216 [0,1,0,1,0,0|2,0,0]=4 6704 B14R2.11166 CCC1CC1(O)c2cc[n]cc2Br Amb25210642 [0,1,0,1,0,0|2,0,0]=4 6705 B14R2.11166 CCC1CC1(O)c2ccccc2Br Amb24394577 [0,1,0,1,0,0|1,0,0]=3 6706 B14R2.11166 Cc1c[n]ccc1C2(O)CC2CC Amb24732473 [0,1,0,1,0,0|2,0,0]=4 6707 B14R2.11166 Cc1ccc[n]c1C2(O)CC2CC Amb25771205 [0,1,0,1,0,0|2,0,0]=4 6708 B14R2.11166 Cc1ccccc1C2(N)CC2CC Amb25202826 [0,1,0,1,0,0|2,0,0]=4 6709 B14R2.11166 Cc1ccccc1C2(O)CC2CC Amb24380032 [0,1,0,1,0,0|1,0,0]=3 6710 B14R2.21545 Cc1c[n]ccc1C(O)C2CCC2 Amb25155935 [0,1,0,1,0,0|2,0,0]=4 6711 B14R2.21545 Cc1ccc[n]c1C(O)C2CCC2 Amb25042194 [0,1,0,1,0,0|2,0,0]=4 6712 B14R2.21545 Cc1ccccc1C(N)C2CCC2 Amb22642960 [0,1,0,1,0,0|2,0,0]=4 6713 B14R2.21545 Cc1ccccc1C(O)C2CCC2 Amb24496679 [0,1,0,1,0,0|1,0,0]=3 6714 B14R2.21545 Cc1ccccc1C(O)C2CCN2 Amb24754223 [0,1,0,1,0,0|0,0,0]=2 6715 B14R2.21545 Cc1ccccc1C(O)C2CNC2 Amb24464169 [0,1,0,1,0,0|2,0,0]=4 6716 B14R2.21545 Cc1ccccc1[C@@H](N)C2CCC2 Amb25347647 [0,1,0,1,0,0|2,0,0]=4 6717 B14R2.21545 Cc1ccccc1[C@H](N)C2CCC2 Amb24395375 [0,1,0,1,0,0|2,0,0]=4 6718 B14R2.21545 NC(C1CCC1)c2ccccc2Br Amb25133669 [0,1,0,1,0,0|2,0,0]=4 6719 B14R2.21545 NC(C1CCC1)c2ccccc2Cl Amb22642965 [0,1,0,1,0,0|2,0,0]=4 6720 B14R2.21545 NC(C1CCC1)c2ccccc2F Amb22642956 [0,1,0,1,0,0|2,0,0]=4 6721 B14R2.21545 NC(C1CCC1)c2ccccc2I Amb24494271 [0,1,0,1,0,0|2,0,0]=4 6722 B14R2.21545 NC(C1CCC1)c2ccccc2O Amb25720204 [0,1,0,1,0,0|2,0,0]=4 6723 B14R2.21545 N[C@@H](C1CCC1)c2ccccc2F Amb25073436 [0,1,0,1,0,0|2,0,0]=4 6724 B14R2.21545 N[C@@H](C1CCC1)c2ccccc2O Amb24490954 [0,1,0,1,0,0|2,0,0]=4 6725 B14R2.21545 N[C@H](C1CCC1)c2ccccc2I Amb24701244 [0,1,0,1,0,0|2,0,0]=4 6726 B14R2.21545 N[C@H](C1CCC1)c2ccccc2O Amb25085943 [0,1,0,1,0,0|2,0,0]=4 6727 B14R2.21545 Nc1cc[n]cc1C(O)C2CCC2 Amb24707718 [0,1,0,1,0,0|2,0,0]=4 6728 B14R2.21545 Nc1ccccc1C(=O)C2CCN2 Amb25311631 [0,1,0,1,0,0|0,0,2]=4 6729 B14R2.21545 Nc1ccccc1C(O)C2CCC2 Amb25679006 [0,1,0,1,0,0|1,0,0]=3 6730 B14R2.21545 OC(C1CCC1)c2[n]cccc2F Amb25155901 [0,1,0,1,0,0|2,0,0]=4 6731 B14R2.21545 OC(C1CCC1)c2cc[n]cc2Br Amb24603375 [0,1,0,1,0,0|2,0,0]=4 6732 B14R2.21545 OC(C1CCC1)c2cc[n]cc2Cl Amb25726779 [0,1,0,1,0,0|2,0,0]=4 6733 B14R2.21545 OC(C1CCC1)c2ccc[n]c2Cl Amb23455054 [0,1,0,1,0,0|2,0,0]=4 6734 B14R2.21545 OC(C1CCC1)c2ccccc2Br Amb25676491 [0,1,0,1,0,0|1,0,0]=3 6735 B14R2.21545 OC(C1CCC1)c2ccccc2F Amb25807006 [0,1,0,1,0,0|1,0,0]=3 6736 B14R2.21545 OC(C1CCN1)c2ccccc2Br Amb25194960 [0,1,0,1,0,0|0,0,0]=2 6737 B14R2.21545 O[C@@H](C1CCC1)c2ccccc2Br Amb25100519 [0,1,0,1,0,0|1,0,0]=3 6738 B14R2.21545 O[C@@H](C1CCC1)c2ccccc2F Amb25070663 [0,1,0,1,0,0|1,0,0]=3 6739 B14R2.21545 O[C@H](C1CCC1)c2ccccc2Br Amb25710434 [0,1,0,1,0,0|1,0,0]=3 6740 B14R2.21545 Oc1ccccc1C(=O)C2CCN2 Amb25350703 [0,1,0,1,0,0|0,0,2]=4 6741 B14R2.21545 Oc1ccccc1C(O)C2CCN2 Amb25249847 [0,1,0,1,0,0|0,0,0]=2 6742 B14R2.28523 CC1CCc2cccc(O)c2C1O Amb25723322 [0,1,0,1,0,0|1,0,0]=3 6743 B14R2.28523 Cc1cccc2C=CC(C)C(O)c12 Amb25056820 [0,1,0,1,0,0|1,0,1]=4 6744 B14R2.28523 Cc1cccc2C=C[C@H](C)[C@H](O)c12 Amb25328829 [0,1,0,1,0,0|1,0,1]=4 6745 B14R2.28523 Cc1cccc2CNC(C)C(C)c12 Amb25348502 [0,1,0,1,0,0|1,0,0]=3 6746 B14R2.28523 NC1CCc2c(C1O)c(Br)ccc2 Amb2383083 [0,1,0,1,0,0|2,0,0]=4 6747 B14R2.28523 NC1CCc2c(C1O)c(Cl)ccc2 Amb2383081 [0,1,0,1,0,0|2,0,0]=4 6748 B14R2.28523 NC1CCc2c(C1O)c(F)ccc2 Amb2383082 [0,1,0,1,0,0|2,0,0]=4 6749 B14R2.28523 NC1CCc2cccc(Br)c2C1O Amb22585799 [0,1,0,1,0,0|2,0,0]=4 6750 B14R2.28523 NC1CCc2cccc(Cl)c2C1O Amb22585800 [0,1,0,1,0,0|2,0,0]=4 6751 B14R2.28523 NC1CCc2cccc(F)c2C1O Amb22585801 [0,1,0,1,0,0|2,0,0]=4 6752 B14R2.359 CC1CC1C(C)(O)c2ccccc2 Amb25290961 [0,1,0,1,0,0|1,0,0]=3 6753 B14R2.743 CC1(O)C(Cl)CCc2ccccc12 Amb25806059 [0,1,0,1,0,0|2,0,0]=4 6754 B14R2.743 CC1(O)C(O)CCc2ccccc12 Amb25845260 [0,1,0,1,0,0|2,0,0]=4 6755 B14R2.743 C[C@@]1(O)[C@@H](O)CCc2ccccc12 Amb25306454 [0,1,0,1,0,0|2,0,0]=4 6756 B14R2.4878 CC1(CC1)C(C)(O)c2c[n]ccc2 Amb25192073 [0,1,0,1,0,0|2,0,0]=4 6757 B14R2.21287 CC(O)(C1CCC1)c2ccccc2 Amb24428307 [0,1,0,1,0,0|1,0,0]=3 6758 B14R2.21287 FC(F)(C1CCC1)c2ccccc2 Amb20670167 [0,1,0,1,0,0|2,0,0]=4 6759 B14R3.49 C1C2NCCC2c3ccccc31 Amb25055187 [0,0,0,2,0,0|1,0,0]=3 6760 B14R3.608 O[C@@H]1C[C@@H]2O[C@H]1c3ccccc32 Amb25324991 [0,0,0,2,0,0|2,0,0]=4 6761 B14R3.418 CC1C2Cc3ccccc3C21N Amb24663124 [0,0,0,2,0,0|2,0,0]=4 6762 B14R3.418 CC1[C@H]2Cc3ccccc3[C@]21N Amb24552837 [0,0,0,2,0,0|2,0,0]=4 6763 B14R3.455 O[C@@H]1[C@H]2C[C@H]2Cc3ccccc31 Amb25294328 [0,0,0,2,0,0|1,0,0]=3 6764 B14R3.455 O[C@H]1[C@H]2C[C@H]2Cc3ccccc31 Amb25332191 [0,0,0,2,0,0|1,0,0]=3 6765 B14R3.457 NC1C2CC(C2)c3ccccc31 Amb25798658 [0,0,0,2,0,0|2,0,0]=4 6766 B14R3.457 OC1C2CC(C2)c3ccccc31 Amb25687886 [0,0,0,2,0,0|1,0,0]=3 6767 B14R3.6900 CC12CC1c3ccccc3C2O Amb25823091 [0,0,0,2,0,0|1,0,0]=3 6768 B14R3.6900 CC12OC1c3ccccc3C2=O Amb24449022 [0,0,0,2,0,0|2,0,0]=4 6769 B14R3.6900 C[C@]12C[C@H]1c3ccccc3C2O Amb25221362 [0,0,0,2,0,0|1,0,0]=3 6770 B14R3.6900 C[C@]12C[C@H]1c3ccccc3[C@@H]2O Amb25175424 [0,0,0,2,0,0|1,0,0]=3 6771 B14R3.6900 C[C@]12C[C@H]1c3ccccc3[C@H]2O Amb24544432 [0,0,0,2,0,0|1,0,0]=3 6772 B14R3.453 NC1c2ccccc2CC13CC3 Amb18063823 [0,0,0,2,0,0|2,0,0]=4 6773 B14R3.453 OC1c2ccccc2NC13CC3 Amb18829939 [0,0,0,2,0,0|2,0,0]=4 6774 B14R3.453 OC1c2ccccc2OC13CC3 Amb25043839 [0,0,0,2,0,0|2,0,0]=4 6775 B14R3.456 C[C@@H]1[C@@H]2C(O)c3ccccc3[C@@H]21 Amb24661309 [0,0,0,2,0,0|1,0,0]=3 6776 B14R3.458 CC12CC1C(O)c3ccccc23 Amb25156871 [0,0,0,2,0,0|1,0,0]=3 6777 B14R3.458 C[C@]12C[C@H]1[C@H](O)c3ccccc23 Amb25206751 [0,0,0,2,0,0|1,0,0]=3 6778 B14R3.15335 OC(c1ccccc1)C23CC2C3 Amb24497644 [0,0,0,2,0,0|1,0,0]=3 6779 B10R1.11 CCCC(O)c1c[nH]cc1 Amb24476783 [1,0,0,0,1,0|2,0,0]=4 6780 B10R1.11 CCCC(O)c1c[s]cc1 Amb18791762 [1,0,0,0,1,0|2,0,0]=4 6781 B10R1.11 CCCC(O)c1ccc[nH]1 Amb24679736 [1,0,0,0,1,0|2,0,0]=4 6782 B10R1.11 CCCC(O)c1cocc1 Amb24418353 [1,0,0,0,1,0|2,0,0]=4 6783 B10R1.11 CCC[C@@H](O)c1c[s]cc1 Amb25043988 [1,0,0,0,1,0|2,0,0]=4 6784 B10R1.11 CCC[C@@H](O)c1ccc[s]1 Amb25226068 [1,0,0,0,1,0|2,0,0]=4 6785 B10R1.11 CCC[C@@H](O)c1ccco1 Amb24371424 [1,0,0,0,1,0|2,0,0]=4 6786 B10R1.11 CCC[C@H](O)c1c[s]cc1 Amb24358455 [1,0,0,0,1,0|2,0,0]=4 6787 B10R1.11 CCC[C@H](O)c1cocc1 Amb24358352 [1,0,0,0,1,0|2,0,0]=4 6788 B10R1.11 CNCC(C)C=1CC=CC1 Amb24478978 [1,0,0,0,1,0|1,0,1]=4 6789 B10R1.11 CNCC(O)c1[n]cc[s]1 Amb24334731 [1,0,0,0,1,0|2,0,0]=4 6790 B10R1.11 CNCC(O)c1c[nH]c[n]1 Amb18831733 [1,0,0,0,1,0|2,0,0]=4 6791 B10R1.11 CNCC(O)c1c[nH]cc1 Amb18563135 [1,0,0,0,1,0|1,0,0]=3 6792 B10R1.11 CNCC(O)c1c[n]c[s]1 Amb24478439 [1,0,0,0,1,0|2,0,0]=4 6793 B10R1.11 CNCC(O)c1c[s]c[n]1 Amb24371861 [1,0,0,0,1,0|2,0,0]=4 6794 B10R1.11 CNCC(O)c1c[s]cc1 Amb18997460 [1,0,0,0,1,0|1,0,0]=3 6795 B10R1.11 CNCC(O)c1cc[n][nH]1 Amb24540313 [1,0,0,0,1,0|2,0,0]=4 6796 B10R1.11 CNCC(O)c1cc[n][s]1 Amb25281123 [1,0,0,0,1,0|2,0,0]=4 6797 B10R1.11 CNCC(O)c1cc[n]o1 Amb24741960 [1,0,0,0,1,0|2,0,0]=4 6798 B10R1.11 CNCC(c1cccs1)C Amb17232163 [1,0,0,0,1,0|2,0,0]=4 6799 B10R1.11 CNC[C@@H](O)c1c[s]cc1 Amb25322154 [1,0,0,0,1,0|1,0,0]=3 6800 B10R1.11 CNC[C@H](O)c1[n]cc[s]1 Amb24355929 [1,0,0,0,1,0|2,0,0]=4 6801 B10R1.11 CNC[C@H](O)c1ccc[s]1 Amb25065288 [1,0,0,0,1,0|1,0,0]=3 6802 B10R1.11 CNC[C@H](O)c1ccco1 Amb24409577 [1,0,0,0,1,0|1,0,0]=3 6803 B10R1.11 COCC(O)c1c[s]cc1 Amb25135510 [1,0,0,0,1,0|2,0,0]=4 6804 B10R1.11 COCC(O)c1ccc[s]1 Amb18791923 [1,0,0,0,1,0|2,0,0]=4 6805 B10R1.11 CSCC(O)c1c[s]cc1 Amb24429312 [1,0,0,0,1,0|2,0,0]=4 6806 B10R1.11 CSCC(O)c1ccc[nH]1 Amb25744397 [1,0,0,0,1,0|2,0,0]=4 6807 B10R1.11 CSCC(O)c1ccc[s]1 Amb18183876 [1,0,0,0,1,0|2,0,0]=4 6808 B10R1.11 CSCC(O)c1ccco1 Amb25703539 [1,0,0,0,1,0|2,0,0]=4 6809 B10R1.11 NNCC(O)c1c[nH]cc1 Amb18563436 [1,0,0,0,1,0|2,0,0]=4 6810 B10R1.11 NNCC(c1ccco1)O Amb17231941 [1,0,0,0,1,0|2,0,0]=4 6811 B10R1.11 NNCC(c1cccs1)O Amb17232256 [1,0,0,0,1,0|2,0,0]=4 6812 B10R1.11 ONCC(c1ccco1)O Amb17334210 [1,0,0,0,1,0|2,0,0]=4 6813 B10R1.11 ONCC(c1cccs1)O Amb17334462 [1,0,0,0,1,0|2,0,0]=4 6814 B10R1.23 CC(C(C)N)c1c[s]cc1 Amb25793847 [1,0,0,0,1,0|2,0,0]=4 6815 B10R1.23 CC(C(C)N)c1ccc[nH]1 Amb25169381 [1,0,0,0,1,0|2,0,0]=4 6816 B10R1.23 CC(C(C)N)c1ccc[s]1 Amb18830838 [1,0,0,0,1,0|2,0,0]=4 6817 B10R1.23 CC(C(C)N)c1ccco1 Amb18832017 [1,0,0,0,1,0|2,0,0]=4 6818 B10R1.23 CC(C(C)N)c1cocc1 Amb24698824 [1,0,0,0,1,0|2,0,0]=4 6819 B10R1.23 CC(C(c1ccco1)Cl)C Amb17138478 [1,0,0,0,1,0|2,0,0]=4 6820 B10R1.23 CC(C(c1ccco1)O)C Amb17138390 [1,0,0,0,1,0|1,0,0]=3 6821 B10R1.23 CC(C(c1cccs1)Cl)C Amb17138752 [1,0,0,0,1,0|2,0,0]=4 6822 B10R1.23 CC(C(c1cccs1)N)C Amb1163534 [1,0,0,0,1,0|2,0,0]=4 6823 B10R1.23 CC(C(c1cccs1)O)N Amb17138465 [1,0,0,0,1,0|1,0,0]=3 6824 B10R1.23 CC(C)C(Br)c1ccc[s]1 Amb25360638 [1,0,0,0,1,0|2,0,0]=4 6825 B10R1.23 CC(C)C(N)c1cc[nH]c1 Amb18064759 [1,0,0,0,1,0|2,0,0]=4 6826 B10R1.23 CC(C)C(N)c1cc[s]c1 Amb18949713 [1,0,0,0,1,0|2,0,0]=4 6827 B10R1.23 CC(C)C(N)c1ccco1 Amb18283654 [1,0,0,0,1,0|2,0,0]=4 6828 B10R1.23 CC(C)C(O)[n]1cccc1 Amb24538042 [1,0,0,0,1,0|1,0,0]=3 6829 B10R1.23 CC(C)C(O)c1[n]cc[s]1 Amb24470222 [1,0,0,0,1,0|2,0,0]=4 6830 B10R1.23 CC(C)C(O)c1cc[nH]c1 Amb25363823 [1,0,0,0,1,0|1,0,0]=3 6831 B10R1.23 CC(C)C(O)c1cc[s]c1 Amb18791761 [1,0,0,0,1,0|1,0,0]=3 6832 B10R1.23 CC(C)C(S)c1ccc[s]1 Amb18180378 [1,0,0,0,1,0|1,1,0]=4 6833 B10R1.23 CC(C)[C@@H](N)c1cc[s]c1 Amb25146395 [1,0,0,0,1,0|2,0,0]=4 6834 B10R1.23 CC(C)[C@@H](N)c1ccc[s]1 Amb24546973 [1,0,0,0,1,0|2,0,0]=4 6835 B10R1.23 CC(C)[C@@H](N)c1ccoc1 Amb24334561 [1,0,0,0,1,0|2,0,0]=4 6836 B10R1.23 CC(C)[C@H](N)c1ccco1 Amb24381682 [1,0,0,0,1,0|2,0,0]=4 6837 B10R1.23 CC(N)C(O)c1c[nH]c[n]1 Amb25328588 [1,0,0,0,1,0|2,0,0]=4 6838 B10R1.23 CC(N)C(O)c1c[n]c[s]1 Amb18830454 [1,0,0,0,1,0|2,0,0]=4 6839 B10R1.23 CC(N)C(O)c1c[s]c[n]1 Amb18830457 [1,0,0,0,1,0|2,0,0]=4 6840 B10R1.23 CC(N)C(O)c1cc[nH]c1 Amb18063237 [1,0,0,0,1,0|1,0,0]=3 6841 B10R1.23 CC(N)C(O)c1ccco1 Amb18283444 [1,0,0,0,1,0|1,0,0]=3 6842 B10R1.23 CC(O)C(O)c1c[s]cc1 Amb25078680 [1,0,0,0,1,0|2,0,0]=4 6843 B10R1.23 CC(O)C(O)c1ccco1 Amb25725430 [1,0,0,0,1,0|2,0,0]=4 6844 B10R1.23 CC(O)C(O)c1cocc1 Amb24406335 [1,0,0,0,1,0|2,0,0]=4 6845 B10R1.23 CN(C)C(O)c1ccco1 Amb24406606 [1,0,0,0,1,0|2,0,0]=4 6846 B10R1.23 C[C@@H](N)[C@@H](O)c1cc[s]c1 Amb25364977 [1,0,0,0,1,0|1,0,0]=3 6847 B10R1.23 C[C@@H](N)[C@@H](O)c1ccoc1 Amb25259896 [1,0,0,0,1,0|1,0,0]=3 6848 B10R1.23 C[C@@H](O)[C@H](O)c1ccc[s]1 Amb24482584 [1,0,0,0,1,0|2,0,0]=4 6849 B10R1.23 C[C@@H](O)[C@H](O)c1ccco1 Amb25688681 [1,0,0,0,1,0|2,0,0]=4 6850 B10R1.23 C[C@H](N)[C@@H](N)c1ccco1 Amb24579953 [1,0,0,0,1,0|2,0,0]=4 6851 B10R1.23 C[C@H](N)[C@@H](N)c1cocc1 Amb24745730 [1,0,0,0,1,0|2,0,0]=4 6852 B10R1.23 C[C@H](N)[C@@H](O)c1[n]cc[s]1 Amb25681448 [1,0,0,0,1,0|2,0,0]=4 6853 B10R1.23 C[C@H](N)[C@@H](O)c1cc[s]c1 Amb24482049 [1,0,0,0,1,0|1,0,0]=3 6854 B10R1.23 C[C@H](N)[C@H](N)c1c[s]cc1 Amb24578478 [1,0,0,0,1,0|2,0,0]=4 6855 B10R1.23 C[C@H](N)[C@H](O)c1ccc[s]1 Amb24728252 [1,0,0,0,1,0|1,0,0]=3 6856 B10R1.23 C[C@H](N)[C@H](O)c1ccoc1 Amb25709123 [1,0,0,0,1,0|1,0,0]=3 6857 B10R1.27 CC(Cc1ccc[s]1)NO Amb24756454 [1,0,0,0,1,0|2,0,0]=4 6858 B10R1.27 CC(Cc1ccco1)NN Amb25795773 [1,0,0,0,1,0|2,0,0]=4 6859 B10R1.27 CC(Cc1ccco1)NO Amb24615522 [1,0,0,0,1,0|2,0,0]=4 6860 B10R1.27 CNC(C)C[n]1c[n]cc1 Amb18291633 [1,0,0,0,1,0|2,0,0]=4 6861 B10R1.27 CNC(C)C[n]1ccc[n]1 Amb18982366 [1,0,0,0,1,0|2,0,0]=4 6862 B10R1.27 CNC(C)Cc1c[nH]c[n]1 Amb25776654 [1,0,0,0,1,0|2,0,0]=4 6863 B10R1.27 CNC(C)Cc1c[s]cc1 Amb18292049 [1,0,0,0,1,0|1,0,0]=3 6864 B10R1.27 CNC(C)Cc1c[s]cc1 Amb20623806 [1,0,0,0,1,0|1,0,0]=3 6865 B10R1.27 CNC(C)Cc1ccc[s]1 Amb20623809 [1,0,0,0,1,0|1,0,0]=3 6866 B10R1.27 CNC(Cc1nccs1)C Amb17232177 [1,0,0,0,1,0|2,0,0]=4 6867 B10R1.27 CN[C@@H](C)Cc1c[nH]c[n]1 Amb24714623 [1,0,0,0,1,0|2,0,0]=4 6868 B10R1.27 CN[C@H](C)Cc1c[nH]c[n]1 Amb25738510 [1,0,0,0,1,0|2,0,0]=4 6869 B10R1.27 CSC(C)C[n]1cccc1 Amb25172852 [1,0,0,0,1,0|2,0,0]=4 6870 B12R1.2197 CC(C)C(O)C1CCC=CC=C1 Amb25221460 [1,0,0,0,0,1|0,0,2]=4 6871 B12R1.2197 CN(C)C(O)=C1C=CC=CC=C1 Amb25359188 [1,0,0,0,0,1|1,0,1]=4 6872 B12R1.27 CC(C#C)OCc1ccccc1 Amb25208112 [1,0,0,0,0,1|1,0,1]=4 6873 B12R1.27 CC(C#N)NCc1ccccc1 Amb17044860 [1,0,0,0,0,1|2,0,0]=4 6874 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [1,0,0,0,0,1|2,0,0]=4 6875 B12R1.27 CC(C#N)SCc1ccccc1 Amb18808999 [1,0,0,0,0,1|2,0,0]=4 6876 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [1,0,0,0,0,1|2,0,0]=4 6877 B12R1.27 CC(CCc1ccccc1)NN Amb22445317 [1,0,0,0,0,1|1,0,0]=3 6878 B12R1.27 CC(CCl)CNc1ccccc1 Amb22756334 [1,0,0,0,0,1|2,0,0]=4 6879 B12R1.27 CC(CCl)OCc1ccccc1 Amb25257973 [1,0,0,0,0,1|2,0,0]=4 6880 B12R1.27 CC(CF)NCc1ccccc1 Amb24536598 [1,0,0,0,0,1|2,0,0]=4 6881 B12R1.27 CC(CN)CNc1ccccc1 Amb19027860 [1,0,0,0,0,1|2,0,0]=4 6882 B12R1.27 CC(CN)NCc1ccccc1 Amb18646179 [1,0,0,0,0,1|2,0,0]=4 6883 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [1,0,0,0,0,1|2,0,0]=4 6884 B12R1.27 CC(CNc1ccccc1)C=C Amb25080486 [1,0,0,0,0,1|1,0,1]=4 6885 B12R1.27 CC(CNc1ccccc1)NN Amb18646401 [1,0,0,0,0,1|1,0,0]=3 6886 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [1,0,0,0,0,1|2,0,0]=4 6887 B12R1.27 CC(COc1ccccc1)NN Amb18563755 [1,0,0,0,0,1|1,0,0]=3 6888 B12R1.27 CCC(C)CNc1cc[n]cc1 Amb19028789 [1,0,0,0,0,1|2,0,0]=4 6889 B12R1.27 CCC(C)CNc1cccc[n]1 Amb19031075 [1,0,0,0,0,1|2,0,0]=4 6890 B12R1.27 CCC(C)NCc1c[n]ccc1 Amb20673665 [1,0,0,0,0,1|2,0,0]=4 6891 B12R1.27 CCC(C)NCc1cc[n]cc1 Amb20673659 [1,0,0,0,0,1|2,0,0]=4 6892 B12R1.27 CCC(C)NCc1cccc[n]1 Amb20673664 [1,0,0,0,0,1|2,0,0]=4 6893 B12R1.27 CCC(CCc1ccccc1)O Amb17138574 [1,0,0,0,0,1|2,0,0]=4 6894 B12R1.27 CCC(CNc1ccccc1)O Amb13952005 [1,0,0,0,0,1|2,0,0]=4 6895 B12R1.27 CCC(CSc1ccccc1)N Amb17485970 [1,0,0,0,0,1|2,0,0]=4 6896 B12R1.27 CCC(N)CNc1ccccc1 Amb19009674 [1,0,0,0,0,1|2,0,0]=4 6897 B12R1.27 CCC(N)COc1ccccc1 Amb19029691 [1,0,0,0,0,1|2,0,0]=4 6898 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [1,0,0,0,0,1|2,0,0]=4 6899 B12R1.27 CC[C@H](C)CNc1ccccc1 Amb25843960 [1,0,0,0,0,1|1,0,0]=3 6900 B12R1.27 CNC(=N)COc1ccccc1 Amb25336063 [1,0,0,0,0,1|1,0,1]=4 6901 B12R1.27 CNC(=N)CSc1ccccc1 Amb24485624 [1,0,0,0,0,1|1,0,1]=4 6902 B12R1.27 CNC(=N)NCc1ccccc1 Amb18798221 [1,0,0,0,0,1|1,0,1]=4 6903 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [1,0,0,0,0,1|1,0,1]=4 6904 B12R1.27 CNC(C)CNc1[n]ccc[n]1 Amb25036484 [1,0,0,0,0,1|2,0,0]=4 6905 B12R1.27 CNC(C)CNc1c[n]cc[n]1 Amb24456004 [1,0,0,0,0,1|2,0,0]=4 6906 B12R1.27 CNC(C)CNc1cc[n]cc1 Amb24368269 [1,0,0,0,0,1|1,0,0]=3 6907 B12R1.27 CNC(C)CNc1ccccc1 Amb18312626 [1,0,0,0,0,1|0,0,0]=2 6908 B12R1.27 CNC(C)COc1c[n]c[n]c1 Amb24082600 [1,0,0,0,0,1|2,0,0]=4 6909 B12R1.27 CNC(C)\C=C\c1c[n]ccc1 Amb23442768 [1,0,0,0,0,1|1,0,1]=4 6910 B12R1.27 CNC(C)\C=C\c1cc[n]cc1 Amb25158209 [1,0,0,0,0,1|1,0,1]=4 6911 B12R1.27 CNC(C)\C=C\c1ccccc1 Amb18126307 [1,0,0,0,0,1|0,0,1]=3 6912 B12R1.27 CNC(CCc1ccccc1)C Amb1138722 [1,0,0,0,0,1|0,0,0]=2 6913 B12R1.27 CNC(CCc1cccnc1)C Amb17507452 [1,0,0,0,0,1|1,0,0]=3 6914 B12R1.27 COC(C)CNc1c[n]ccc1 Amb25359695 [1,0,0,0,0,1|2,0,0]=4 6915 B12R1.27 COC(C)CNc1cccc[n]1 Amb25689750 [1,0,0,0,0,1|2,0,0]=4 6916 B12R1.27 COC(C)CNc1ccccc1 Amb19025483 [1,0,0,0,0,1|1,0,0]=3 6917 B12R1.27 CSC(C)CNc1ccccc1 Amb18312645 [1,0,0,0,0,1|1,0,0]=3 6918 B12R1.27 C[C@@H](CCl)OCc1ccccc1 Amb25320908 [1,0,0,0,0,1|2,0,0]=4 6919 B12R1.27 C[C@@H](CN)NCc1ccccc1 Amb24396541 [1,0,0,0,0,1|2,0,0]=4 6920 B12R1.27 C[C@@H](CO)NCc1ccccc1 Amb19301927 [1,0,0,0,0,1|2,0,0]=4 6921 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [1,0,0,0,0,1|2,0,0]=4 6922 B12R1.27 C[C@H](CO)NCc1ccccc1 Amb19375302 [1,0,0,0,0,1|2,0,0]=4 6923 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [1,0,0,0,0,1|2,0,0]=4 6924 B12R1.27 C\C(\CNc1ccccc1)=C\C Amb24636864 [1,0,0,0,0,1|1,0,1]=4 6925 B12R1.27 O=CC(CSc1ccccc1)C Amb17594629 [1,0,0,0,0,1|2,0,0]=4 6926 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [1,0,0,0,0,1|2,0,0]=4 6927 B12R1.27 OCC(COc1ccccc1)C Amb17232599 [1,0,0,0,0,1|2,0,0]=4 6928 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [1,0,0,0,0,1|2,0,0]=4 6929 B12R1.1748 CC(CC1C=CC=CC=C1)NC Amb24696440 [1,0,0,0,0,1|0,0,1]=3 6930 B14R1.163 CCC(NCC(c1ccccc1)C)C Amb2119579 [0,0,0,0,0,2|2,0,0]=4 6931 B14R1.163 CCC(O)C#CC(O)c1ccccc1 Amb25848529 [0,0,0,0,0,2|2,0,0]=4 6932 B14R1.163 CNC(=N)NCC(O)c1ccccc1 Amb19061797 [0,0,0,0,0,2|1,0,1]=4 6933 B14R1.163 CNC(=O)CCC(c1ccccc1)O Amb17336618 [0,0,0,0,0,2|1,0,1]=4 6934 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,0,0,0,0,2|1,0,1]=4 6935 B14R1.743 CNC(C)CN(C)Cc1ccccc1 Amb19079136 [0,0,0,0,0,2|2,0,0]=4 6936 B14R1.756 CNC(=O)C(O)\C=C\c1ccccc1 Amb25243537 [0,0,0,0,0,2|1,0,1]=4 6937 B14R1.756 CNC(C)C(=O)NCc1ccccc1 Amb19025716 [0,0,0,0,0,2|0,0,2]=4 6938 B14R1.756 CNC(C)C(=O)OCc1ccccc1 Amb19061736 [0,0,0,0,0,2|0,0,2]=4 6939 B14R1.756 CNC(C)C(C)OCc1ccccc1 Amb19079559 [0,0,0,0,0,2|1,0,0]=3 6940 B14R1.756 CN[C@H](C)C(=O)NCc1ccccc1 Amb25758968 [0,0,0,0,0,2|0,0,2]=4 6941 B14R1.756 CN[C@H](C)C(=O)OCc1ccccc1 Amb24348171 [0,0,0,0,0,2|0,0,2]=4 6942 B14R1.756 C[C@@H](C#C)[C@@H](O)\C=C\c1ccccc1 Amb24688331 [0,0,0,0,0,2|1,0,1]=4 6943 B14R1.756 C[C@@H](C#N)[C@@H](O)\C=C\c1ccccc1 Amb25681394 [0,0,0,0,0,2|2,0,0]=4 6944 B14R1.756 C[C@@H](CO)[C@@H](O)C#Cc1ccccc1 Amb25343860 [0,0,0,0,0,2|2,0,0]=4 6945 B14R1.756 C[C@H](C#N)[C@@H](O)\C=C\c1ccccc1 Amb25098590 [0,0,0,0,0,2|2,0,0]=4 6946 B14R1.756 C[C@H](C=O)[C@@H](O)C#Cc1ccccc1 Amb25261874 [0,0,0,0,0,2|2,0,0]=4 6947 B14R1.756 C[C@H](CC)[C@@H](O)C#Cc1ccccc1 Amb24386917 [0,0,0,0,0,2|1,0,0]=3 6948 B14R1.756 C\C(=C\C)\[C@@H](O)C#Cc1ccccc1 Amb25051457 [0,0,0,0,0,2|1,0,1]=4