0 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.43 BrC(C(=O)C)Cc1ccncc1 Amb17507815 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.43 BrC(C(=O)O)C[n+]1ccccc1 Amb1030017 [0,0,0,0,0,0|2,0,1]=3 3 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [0,0,0,0,0,0|1,0,1]=2 4 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [0,0,0,0,0,0|1,0,1]=2 5 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [0,0,0,0,0,0|2,0,1]=3 6 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.43 C=C(Cc1ccccc1)C(N)=S Amb24359154 [0,0,0,0,0,0|2,1,0]=3 8 B12R1.43 C=C(Cl)C(=O)Nc1cccc[n]1 Amb25244198 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.43 C=C(F)C(=O)Cc1ccccc1 Amb25205433 [0,0,0,0,0,0|2,0,0]=2 10 B12R1.43 C=C(F)C(=O)Oc1ccccc1 Amb25174018 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.43 C=C(Oc1ccccc1)C(O)=O Amb24692764 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.43 C=C(Sc1ccccc1)C(N)=O Amb24739855 [0,0,0,0,0,0|3,0,0]=3 13 B12R1.43 CC(=C(C)C)C[n+]1ccccc1 Amb10552995 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.43 CC(=C)C(=O)Cc1ccc[n]c1 Amb24703221 [0,0,0,0,0,0|3,0,0]=3 15 B12R1.43 CC(=C)C(=O)Nc1ccc[n]c1 Amb25320521 [0,0,0,0,0,0|4,0,0]=4 16 B12R1.43 CC(=C)C(=O)Nc1cccc[n]1 Amb25035026 [0,0,0,0,0,0|4,0,0]=4 17 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [0,0,0,0,0,0|3,0,1]=4 18 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [0,0,0,0,0,0|2,0,2]=4 19 B12R1.43 CC(=Cc1ccccc1)C(=O)Cl Amb24061289 [0,0,0,0,0,0|2,0,1]=3 20 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.43 CC(=O)C(=O)Cc1c[n]ccc1 Amb24556780 [0,0,0,0,0,0|2,0,0]=2 22 B12R1.43 CC(=O)C(=O)Cc1cc[n]cc1 Amb24555440 [0,0,0,0,0,0|2,0,0]=2 23 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [0,0,0,0,0,0|1,0,0]=1 24 B12R1.43 CC(=O)C(C)Cc1cc[n]cc1 Amb25303664 [0,0,0,0,0,0|3,0,1]=4 25 B12R1.43 CC(=O)C(Cc1ccccn1)Br Amb17507813 [0,0,0,0,0,0|3,0,1]=4 26 B12R1.43 CC(=O)C(Cc1ccccn1)Cl Amb17507767 [0,0,0,0,0,0|3,0,1]=4 27 B12R1.43 CC(=O)C(Cc1cccnc1)Br Amb17507814 [0,0,0,0,0,0|3,0,1]=4 28 B12R1.43 CC(=O)C(Cc1cccnc1)Cl Amb17507768 [0,0,0,0,0,0|3,0,1]=4 29 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [0,0,0,0,0,0|1,0,2]=3 30 B12R1.43 CC(=O)N(C)Cc1cc[n]cc1 Amb25152576 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [0,0,0,0,0,0|2,0,1]=3 33 B12R1.43 CC(=O)[C@@H](C)Cc1cc[n]cc1 Amb25358977 [0,0,0,0,0,0|3,0,1]=4 34 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [0,0,0,0,0,0|2,0,1]=3 35 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [0,0,0,0,0,0|3,0,1]=4 36 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [0,0,0,0,0,0|2,0,1]=3 37 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [0,0,0,0,0,0|1,0,2]=3 38 B12R1.43 CC(=O)[C@H](C)Cc1cc[n]cc1 Amb24380859 [0,0,0,0,0,0|3,0,1]=4 39 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [0,0,0,0,0,0|2,0,1]=3 40 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [0,0,0,0,0,0|1,0,2]=3 41 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [0,0,0,0,0,0|3,1,0]=4 42 B12R1.43 CC(Br)C(=O)Oc1ccccc1 Amb24367978 [0,0,0,0,0,0|3,0,1]=4 43 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [0,0,0,0,0,0|2,0,1]=3 44 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [0,0,0,0,0,0|3,0,1]=4 45 B12R1.43 CC(C(=O)Cc1ccccc1)Cl Amb10609316 [0,0,0,0,0,0|2,0,1]=3 46 B12R1.43 CC(C(=O)Cl)Sc1ccccc1 Amb17143250 [0,0,0,0,0,0|3,0,1]=4 47 B12R1.43 CC(C(=O)N)Sc1ccccc1 Amb10665761 [0,0,0,0,0,0|3,0,1]=4 48 B12R1.43 CC(C(=O)Nc1ccccc1)Br Amb10786673 [0,0,0,0,0,0|3,0,1]=4 49 B12R1.43 CC(C(=O)Nc1ccccc1)Cl Amb1646335 [0,0,0,0,0,0|3,0,1]=4 50 B12R1.43 CC(C(=O)Nc1ccccc1)O Amb1230509 [0,0,0,0,0,0|2,0,1]=3 51 B12R1.43 CC(C(=O)O)Nc1ccccc1 Amb1213440 [0,0,0,0,0,0|2,0,1]=3 52 B12R1.43 CC(C(=O)O)Sc1ccccc1 Amb1215286 [0,0,0,0,0,0|2,0,1]=3 53 B12R1.43 CC(C(=O)Oc1ccccc1)N Amb17334632 [0,0,0,0,0,0|3,0,1]=4 54 B12R1.43 CC(C(=O)Sc1ccccc1)C Amb10575811 [0,0,0,0,0,0|3,0,1]=4 55 B12R1.43 CC(C(O)C)Cc1ccccc1 Amb17232485 [0,0,0,0,0,0|2,0,2]=4 56 B12R1.43 CC(C)C(=O)Cc1cc[n]cc1 Amb18800716 [0,0,0,0,0,0|3,0,1]=4 57 B12R1.43 CC(C)C(=O)Cc1ccc[n]c1 Amb18800713 [0,0,0,0,0,0|3,0,1]=4 58 B12R1.43 CC(Cc1c[n]c[n]c1)C(O)=O Amb24375035 [0,0,0,0,0,0|3,0,1]=4 59 B12R1.43 CC(Cc1ccccc1)[N+]([O-])=O Amb17689219 [0,0,0,0,0,0|2,0,2]=4 60 B12R1.43 CC(F)C(=O)Sc1ccccc1 Amb25174184 [0,0,0,0,0,0|3,0,1]=4 61 B12R1.43 CC(I)C(=O)Nc1ccccc1 Amb23579961 [0,0,0,0,0,0|3,0,1]=4 62 B12R1.43 CC(N)C(=O)Cc1ccc[n]c1 Amb18199768 [0,0,0,0,0,0|3,0,1]=4 63 B12R1.43 CC(N)C(=O)Cc1ccccc1 Amb18829240 [0,0,0,0,0,0|2,0,1]=3 64 B12R1.43 CC(N)C(=O)Nc1ccccc1 Amb19419695 [0,0,0,0,0,0|3,0,1]=4 65 B12R1.43 CC(N)C(=O)Sc1ccccc1 Amb25321042 [0,0,0,0,0,0|3,0,1]=4 66 B12R1.43 CC(Nc1ccc[n]c1)C(O)=O Amb18270393 [0,0,0,0,0,0|3,0,1]=4 67 B12R1.43 CC(Nc1ccccc1)P(O)=O Amb25270636 [0,0,0,0,0,0|3,0,1]=4 68 B12R1.43 CC(O)C(=C)Cc1ccccc1 Amb25155687 [0,0,0,0,0,0|2,0,1]=3 69 B12R1.43 CC(O)C(=O)Cc1ccc[n]c1 Amb24344752 [0,0,0,0,0,0|2,0,1]=3 70 B12R1.43 CC(O)C(=O)Cc1cccc[n]1 Amb25205815 [0,0,0,0,0,0|2,0,1]=3 71 B12R1.43 CC(O)C(=O)Cc1ccccc1 Amb24487306 [0,0,0,0,0,0|1,0,1]=2 72 B12R1.43 CC(O)C(=O)Nc1cc[n]cc1 Amb24748070 [0,0,0,0,0,0|3,0,1]=4 73 B12R1.43 CC(O)C(=O)Nc1ccc[n]c1 Amb25159906 [0,0,0,0,0,0|3,0,1]=4 74 B12R1.43 CC(O)C(=O)Oc1ccc[n]c1 Amb25182794 [0,0,0,0,0,0|3,0,1]=4 75 B12R1.43 CC(O)C(=O)Oc1ccccc1 Amb25154221 [0,0,0,0,0,0|2,0,1]=3 76 B12R1.43 CC(O)C(Cl)Cc1ccccc1 Amb25082706 [0,0,0,0,0,0|2,0,2]=4 77 B12R1.43 CC(O)C(N)Cc1ccccc1 Amb18646379 [0,0,0,0,0,0|2,0,2]=4 78 B12R1.43 CC(O)C(O)Cc1ccccc1 Amb25159724 [0,0,0,0,0,0|1,0,3]=4 79 B12R1.43 CC(O)[C@@H](N)Cc1ccccc1 Amb24682603 [0,0,0,0,0,0|2,0,2]=4 80 B12R1.43 CC(O)[C@@H](O)Cc1ccccc1 Amb24354395 [0,0,0,0,0,0|1,0,3]=4 81 B12R1.43 CC(O)[C@H](N)Cc1ccccc1 Amb25730054 [0,0,0,0,0,0|2,0,2]=4 82 B12R1.43 CC(Pc1ccccc1)C(O)=O Amb25059181 [0,0,0,0,0,0|2,0,1]=3 83 B12R1.43 CC(S)C(=O)Nc1ccccc1 Amb25103698 [0,0,0,0,0,0|2,1,1]=4 84 B12R1.43 CN(C(=O)Cc1ccccc1)C Amb1803686 [0,0,0,0,0,0|3,0,0]=3 85 B12R1.43 CN(C(=O)Cl)Cc1ccccc1 Amb17563090 [0,0,0,0,0,0|3,0,0]=3 86 B12R1.43 CN(C(=O)Nc1ccccc1)C Amb1221366 [0,0,0,0,0,0|4,0,0]=4 87 B12R1.43 CN(C(=S)Cc1ccccc1)C Amb1078624 [0,0,0,0,0,0|3,1,0]=4 88 B12R1.43 CN(C)C(=N)Cc1ccccc1 Amb23447116 [0,0,0,0,0,0|4,0,0]=4 89 B12R1.43 CN(C)C(=O)Cc1cc[n]cc1 Amb24387884 [0,0,0,0,0,0|4,0,0]=4 90 B12R1.43 CN(C)C(=O)Cc1ccc[n]c1 Amb24413047 [0,0,0,0,0,0|4,0,0]=4 91 B12R1.43 CN(C)C(=O)Cc1cccc[n]1 Amb25369283 [0,0,0,0,0,0|4,0,0]=4 92 B12R1.43 CN(Cc1cc[n]cc1)C(=O)Cl Amb24357639 [0,0,0,0,0,0|4,0,0]=4 93 B12R1.43 CN(Cc1ccc[n]c1)C(=O)Cl Amb25034672 [0,0,0,0,0,0|4,0,0]=4 94 B12R1.43 CN(Cc1ccccc1)C(N)=N Amb22586446 [0,0,0,0,0,0|4,0,0]=4 95 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [0,0,0,0,0,0|1,0,1]=2 96 B12R1.43 C[C@@H](C(=O)O)Nc1ccncc1 Amb10604191 [0,0,0,0,0,0|3,0,1]=4 97 B12R1.43 C[C@@H](Cc1ccccc1)C(C)O Amb25769503 [0,0,0,0,0,0|2,0,2]=4 98 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [0,0,0,0,0,0|2,0,1]=3 99 B12R1.43 C[C@@H](Cc1ccccc1)[C@@H](C)O Amb25795494 [0,0,0,0,0,0|2,0,2]=4 100 B12R1.43 C[C@@H](N)C(=O)Nc1ccccc1 Amb18527911 [0,0,0,0,0,0|3,0,1]=4 101 B12R1.43 C[C@@H](Nc1cccc[n]1)C(O)=O Amb24475793 [0,0,0,0,0,0|3,0,1]=4 102 B12R1.43 C[C@@H](Nc1ccccc1)C(O)=O Amb22801823 [0,0,0,0,0,0|2,0,1]=3 103 B12R1.43 C[C@@H](O)C(=O)Cc1ccccc1 Amb25792955 [0,0,0,0,0,0|1,0,1]=2 104 B12R1.43 C[C@@H](O)C(=O)Nc1cc[n]cc1 Amb25734324 [0,0,0,0,0,0|3,0,1]=4 105 B12R1.43 C[C@@H](O)C(=O)Nc1ccccc1 Amb25229042 [0,0,0,0,0,0|2,0,1]=3 106 B12R1.43 C[C@@H](O)C(=O)Oc1ccc[n]c1 Amb24343534 [0,0,0,0,0,0|3,0,1]=4 107 B12R1.43 C[C@@H](O)C(=O)Oc1ccccc1 Amb25763938 [0,0,0,0,0,0|2,0,1]=3 108 B12R1.43 C[C@@H](O)C(=O)Sc1ccccc1 Amb25847054 [0,0,0,0,0,0|2,0,1]=3 109 B12R1.43 C[C@@H](O)[C@@H](O)Cc1ccccc1 Amb25847064 [0,0,0,0,0,0|1,0,3]=4 110 B12R1.43 C[C@@H](O)[C@H](Cl)Cc1ccccc1 Amb25823111 [0,0,0,0,0,0|2,0,2]=4 111 B12R1.43 C[C@@H](O)[C@H](N)Cc1ccccc1 Amb24664138 [0,0,0,0,0,0|2,0,2]=4 112 B12R1.43 C[C@@H](Oc1ccccc1)C(O)=O Amb22736710 [0,0,0,0,0,0|2,0,1]=3 113 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [0,0,0,0,0,0|1,0,1]=2 114 B12R1.43 C[C@H](Cc1ccccc1)[C@@H](C)O Amb25157972 [0,0,0,0,0,0|2,0,2]=4 115 B12R1.43 C[C@H](Cc1ccccc1)[C@H](C)O Amb25769397 [0,0,0,0,0,0|2,0,2]=4 116 B12R1.43 C[C@H](F)C(=O)Nc1ccccc1 Amb25159508 [0,0,0,0,0,0|3,0,1]=4 117 B12R1.43 C[C@H](N)C(=O)Sc1ccccc1 Amb24485426 [0,0,0,0,0,0|3,0,1]=4 118 B12R1.43 C[C@H](Nc1ccc[n]c1)C(O)=O Amb25320831 [0,0,0,0,0,0|3,0,1]=4 119 B12R1.43 C[C@H](Nc1cccc[n]1)C(O)=O Amb24066967 [0,0,0,0,0,0|3,0,1]=4 120 B12R1.43 C[C@H](Nc1ccccc1)C(O)=O Amb24434019 [0,0,0,0,0,0|2,0,1]=3 121 B12R1.43 C[C@H](O)C(=O)Cc1ccccc1 Amb25143432 [0,0,0,0,0,0|1,0,1]=2 122 B12R1.43 C[C@H](O)C(=O)Nc1cc[n]cc1 Amb25728744 [0,0,0,0,0,0|3,0,1]=4 123 B12R1.43 C[C@H](O)C(=O)Nc1ccc[n]c1 Amb25052812 [0,0,0,0,0,0|3,0,1]=4 124 B12R1.43 C[C@H](O)C(=O)Oc1ccccc1 Amb25769345 [0,0,0,0,0,0|2,0,1]=3 125 B12R1.43 C[C@H](O)C(=O)Sc1cccc[n]1 Amb24355253 [0,0,0,0,0,0|3,0,1]=4 126 B12R1.43 C[C@H](O)[C@@H](N)Cc1ccccc1 Amb25690953 [0,0,0,0,0,0|2,0,2]=4 127 B12R1.43 C[C@H](O)[C@@H](O)Cc1ccccc1 Amb24496614 [0,0,0,0,0,0|1,0,3]=4 128 B12R1.43 C[C@H](O)[C@H](N)Cc1ccccc1 Amb25375788 [0,0,0,0,0,0|2,0,2]=4 129 B12R1.43 C[C@H](Oc1ccccc1)C(O)=O Amb22736711 [0,0,0,0,0,0|2,0,1]=3 130 B12R1.43 C[C@H](Sc1cccc[n]1)C(O)=O Amb22388633 [0,0,0,0,0,0|3,0,1]=4 131 B12R1.43 C[C@H](Sc1ccccc1)C(O)=O Amb24390829 [0,0,0,0,0,0|2,0,1]=3 132 B12R1.43 C\C(=C/c1c[n]ccc1)\C(C)=O Amb25373091 [0,0,0,0,0,0|3,0,1]=4 133 B12R1.43 C\C(=C/c1cc[n]cc1)\C(C)=O Amb24424922 [0,0,0,0,0,0|3,0,1]=4 134 B12R1.43 C\C(=C/c1cccc[n]1)\C(C)=O Amb25066316 [0,0,0,0,0,0|3,0,1]=4 135 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [0,0,0,0,0,0|2,0,1]=3 136 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O Amb2099512 [0,0,0,0,0,0|1,0,1]=2 137 B12R1.43 C\C(=C/c1ccccc1)\[C@@H](C)O Amb25816522 [0,0,0,0,0,0|2,0,2]=4 138 B12R1.43 C\C(=C\c1cc[n]c[n]1)\C(O)=O Amb25383291 [0,0,0,0,0,0|3,0,1]=4 139 B12R1.43 C\C(=C\c1ccccc1)\C(N)=O Amb24388896 [0,0,0,0,0,0|2,0,1]=3 140 B12R1.43 C\C(=C\c1ccccc1)\C(O)=O Amb24603461 [0,0,0,0,0,0|1,0,1]=2 141 B12R1.43 C\C(=C\c1ccccc1)\[N+]([O-])=O Amb21520351 [0,0,0,0,0,0|2,0,2]=4 142 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [0,0,0,0,0,0|3,0,0]=3 143 B12R1.43 C\C(=N\c1ccccc1)\C(O)=O Amb24068331 [0,0,0,0,0,0|2,0,0]=2 144 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [0,0,0,0,0,0|2,0,1]=3 145 B12R1.43 ClC(C(=O)C)Cc1ccncc1 Amb17507769 [0,0,0,0,0,0|3,0,1]=4 146 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [0,0,0,0,0,0|2,0,1]=3 147 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [0,0,0,0,0,0|2,0,1]=3 148 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [0,0,0,0,0,0|1,0,1]=2 149 B12R1.43 FC(=C(F)F)Oc1ccccc1 Amb10841028 [0,0,0,0,0,0|4,0,0]=4 150 B12R1.43 FC(F)C(=O)Nc1ccccc1 Amb17689208 [0,0,0,0,0,0|3,0,1]=4 151 B12R1.43 N=C(Nc1ccccc1)C(O)=O Amb18645991 [0,0,0,0,0,0|2,0,0]=2 152 B12R1.43 NC(=Cc1ccccc1)C(O)=O Amb24081025 [0,0,0,0,0,0|1,0,1]=2 153 B12R1.43 NC(=N)C(=N)Oc1ccccc1 Amb24096860 [0,0,0,0,0,0|4,0,0]=4 154 B12R1.43 NC(=N)N(N)Cc1ccccc1 Amb25760721 [0,0,0,0,0,0|4,0,0]=4 155 B12R1.43 NC(=N)N(O)Cc1ccccc1 Amb25291446 [0,0,0,0,0,0|3,0,1]=4 156 B12R1.43 NC(=O)C(=N)Nc1cccc[n]1 Amb24398928 [0,0,0,0,0,0|4,0,0]=4 157 B12R1.43 NC(=O)C(=N)Nc1ccccc1 Amb24106231 [0,0,0,0,0,0|3,0,0]=3 158 B12R1.43 NC(=O)C(=O)Cc1c[n]ccc1 Amb24400568 [0,0,0,0,0,0|2,0,0]=2 159 B12R1.43 NC(=O)C(=O)Nc1c[n]c[n]c1 Amb24495797 [0,0,0,0,0,0|4,0,0]=4 160 B12R1.43 NC(=O)C(=O)Nc1cccnc1 Amb10972675 [0,0,0,0,0,0|3,0,0]=3 161 B12R1.43 NC(=O)C(=S)Nc1cc[n]cc1 Amb24601360 [0,0,0,0,0,0|3,1,0]=4 162 B12R1.43 NC(=O)C(Br)Cc1ccc[n]c1 Amb25741625 [0,0,0,0,0,0|3,0,1]=4 163 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [0,0,0,0,0,0|2,0,1]=3 164 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [0,0,0,0,0,0|2,0,1]=3 165 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [0,0,0,0,0,0|2,0,1]=3 166 B12R1.43 NC(=O)C(N)Oc1ccccc1 Amb25696007 [0,0,0,0,0,0|3,0,1]=4 167 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [0,0,0,0,0,0|1,0,2]=3 168 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [0,0,0,0,0,0|2,0,1]=3 169 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [0,0,0,0,0,0|1,0,2]=3 170 B12R1.43 NC(=S)C(=S)Nc1ccccc1 Amb22484116 [0,0,0,0,0,0|2,2,0]=4 171 B12R1.43 NC(=S)C(N)Cc1ccccc1 Amb25765717 [0,0,0,0,0,0|2,1,1]=4 172 B12R1.43 NC(=S)N(Cl)Cc1ccccc1 Amb24681100 [0,0,0,0,0,0|3,1,0]=4 173 B12R1.43 NC(=S)[C@H](O)Cc1ccccc1 Amb24419006 [0,0,0,0,0,0|1,1,2]=4 174 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [0,0,0,0,0,0|2,0,1]=3 175 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [0,0,0,0,0,0|1,0,1]=2 176 B12R1.43 NC(Cc1[n]ccc[n]1)C(O)=O Amb18995251 [0,0,0,0,0,0|3,0,1]=4 177 B12R1.43 NC(Cc1c[n]c[n]c1)C(O)=O Amb18302429 [0,0,0,0,0,0|3,0,1]=4 178 B12R1.43 NC(Cc1c[n]cc[n]1)C(O)=O Amb19000859 [0,0,0,0,0,0|3,0,1]=4 179 B12R1.43 NC(Cc1cc[n]c[n]1)C(O)=O Amb19000856 [0,0,0,0,0,0|3,0,1]=4 180 B12R1.43 NC(Cc1cc[n]cc1)C(O)=O Amb22728340 [0,0,0,0,0,0|2,0,1]=3 181 B12R1.43 NC(Cc1ccc[n][n]1)C(O)=O Amb18827268 [0,0,0,0,0,0|3,0,1]=4 182 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22301544 [0,0,0,0,0,0|2,0,1]=3 183 B12R1.43 NC(Cc1ccc[n]c1)C(O)=O Amb22497387 [0,0,0,0,0,0|2,0,1]=3 184 B12R1.43 NC(Cc1cccc[n]1)C(O)=O Amb22234042 [0,0,0,0,0,0|2,0,1]=3 185 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [0,0,0,0,0,0|2,0,1]=3 186 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [0,0,0,0,0,0|1,1,1]=3 187 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [0,0,0,0,0,0|1,0,1]=2 188 B12R1.43 NC(Cc1ccccc1)P(O)O Amb25227409 [0,0,0,0,0,0|2,0,2]=4 189 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [0,0,0,0,0,0|1,0,1]=2 190 B12R1.43 NC(Nc1ccccc1)C(=O)Cl Amb24558423 [0,0,0,0,0,0|3,0,1]=4 191 B12R1.43 NC(Oc1ccccc1)C(O)=O Amb25060706 [0,0,0,0,0,0|2,0,1]=3 192 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [0,0,0,0,0,0|1,0,1]=2 193 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [0,0,0,0,0,0|1,0,1]=2 194 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [0,0,0,0,0,0|1,0,1]=2 195 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [0,0,0,0,0,0|1,0,1]=2 196 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [0,0,0,0,0,0|2,0,1]=3 197 B12R1.43 N[C@@H](CC=1CC=CCC1)C(O)=O Amb24080592 [0,0,0,0,0,0|1,0,3]=4 198 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [0,0,0,0,0,0|1,0,1]=2 199 B12R1.43 N[C@@H](Cc1[n]ccc[n]1)C(O)=O Amb24524889 [0,0,0,0,0,0|3,0,1]=4 200 B12R1.43 N[C@@H](Cc1c[n]c[n]c1)C(O)=O Amb19149168 [0,0,0,0,0,0|3,0,1]=4 201 B12R1.43 N[C@@H](Cc1c[n]cc[n]1)C(O)=O Amb22801697 [0,0,0,0,0,0|3,0,1]=4 202 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb20241997 [0,0,0,0,0,0|2,0,1]=3 203 B12R1.43 N[C@@H](Cc1cc[n]cc1)C(O)=O Amb22745959 [0,0,0,0,0,0|2,0,1]=3 204 B12R1.43 N[C@@H](Cc1ccc[n]c1)C(O)=O Amb22008701 [0,0,0,0,0,0|2,0,1]=3 205 B12R1.43 N[C@@H](Cc1ccccc1)B(O)O Amb25366514 [0,0,0,0,0,0|2,0,2]=4 206 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [0,0,0,0,0,0|1,0,1]=2 207 B12R1.43 N[C@@H](Cc1ccccc1)P(O)O Amb25828976 [0,0,0,0,0,0|2,0,2]=4 208 B12R1.43 N[C@H](Cc1c[n]cc[n]1)C(O)=O Amb24671229 [0,0,0,0,0,0|3,0,1]=4 209 B12R1.43 N[C@H](Cc1cc[n]cc1)C(O)=O Amb19944301 [0,0,0,0,0,0|2,0,1]=3 210 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb19930749 [0,0,0,0,0,0|2,0,1]=3 211 B12R1.43 N[C@H](Cc1ccc[n]c1)C(O)=O Amb22008700 [0,0,0,0,0,0|2,0,1]=3 212 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [0,0,0,0,0,0|2,0,1]=3 213 B12R1.43 N[C@H](Cc1ccccc1)P(O)=O Amb24355910 [0,0,0,0,0,0|2,0,1]=3 214 B12R1.43 N\C(=C/c1cc[n]c[n]1)\C(O)=O Amb24390213 [0,0,0,0,0,0|3,0,1]=4 215 B12R1.43 N\C(=C\c1cc[n]c[n]1)\C(O)=O Amb24518466 [0,0,0,0,0,0|3,0,1]=4 216 B12R1.43 N\C(=C\c1ccc[n]c1)\C(O)=O Amb25254657 [0,0,0,0,0,0|2,0,1]=3 217 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [0,0,0,0,0,0|2,0,0]=2 218 B12R1.43 O=C(C(=O)N)Nc1ccccc1 Amb1859924 [0,0,0,0,0,0|2,0,0]=2 219 B12R1.43 O=C(C(=O)O)Cc1ccncc1 Amb17477816 [0,0,0,0,0,0|1,0,0]=1 220 B12R1.43 O=C(Cc1cc[n]cc1)C(F)F Amb24377394 [0,0,0,0,0,0|3,0,1]=4 221 B12R1.43 O=C(Cc1ccc[n]c1)C(F)F Amb25259697 [0,0,0,0,0,0|3,0,1]=4 222 B12R1.43 O=C(Cc1cccc[n]1)C(F)F Amb24453669 [0,0,0,0,0,0|3,0,1]=4 223 B12R1.43 O=C(Cc1ccccc1)C(F)F Amb18180246 [0,0,0,0,0,0|2,0,1]=3 224 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [0,0,0,0,0,0|2,0,1]=3 225 B12R1.43 O=C(Nc1ccccc1)C(=O)Cl Amb24537614 [0,0,0,0,0,0|2,0,0]=2 226 B12R1.43 O=C(Nc1ccccc1)C(F)Cl Amb25138763 [0,0,0,0,0,0|3,0,1]=4 227 B12R1.43 O=C(Oc1ccccc1)C(=O)Cl Amb25207901 [0,0,0,0,0,0|2,0,0]=2 228 B12R1.43 O=C(Oc1ccccc1)C(F)F Amb25297093 [0,0,0,0,0,0|3,0,1]=4 229 B12R1.43 OB(O)C(Cl)Cc1ccccc1 Amb24419999 [0,0,0,0,0,0|2,0,2]=4 230 B12R1.43 OB(O)[C@H](Cl)Cc1ccccc1 Amb25779933 [0,0,0,0,0,0|2,0,2]=4 231 B12R1.43 OB(O)\C(\F)=C\c1ccccc1 Amb25667549 [0,0,0,0,0,0|2,0,2]=4 232 B12R1.43 OC(=O)C(=O)Cc1ccccn1 Amb17477815 [0,0,0,0,0,0|1,0,0]=1 233 B12R1.43 OC(=O)C(=O)Cc1cccnc1 Amb17232515 [0,0,0,0,0,0|1,0,0]=1 234 B12R1.43 OC(=O)C(=O)Nc1ccc[n][n]1 Amb25687966 [0,0,0,0,0,0|3,0,0]=3 235 B12R1.43 OC(=O)C(=S)Cc1cccc[n]1 Amb25059246 [0,0,0,0,0,0|1,1,0]=2 236 B12R1.43 OC(=O)C(=S)Nc1cc[n]cc1 Amb24368096 [0,0,0,0,0,0|2,1,0]=3 237 B12R1.43 OC(=O)C(Br)Cc1c[n]c[n]c1 Amb23571329 [0,0,0,0,0,0|3,0,1]=4 238 B12R1.43 OC(=O)C(Br)Oc1ccccc1 Amb24406770 [0,0,0,0,0,0|2,0,1]=3 239 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [0,0,0,0,0,0|1,0,1]=2 240 B12R1.43 OC(=O)C(Cc1ccccn1)O Amb17138619 [0,0,0,0,0,0|1,0,2]=3 241 B12R1.43 OC(=O)C(Cl)Oc1ccccc1 Amb24635704 [0,0,0,0,0,0|2,0,1]=3 242 B12R1.43 OC(=O)C(F)=Cc1ccccc1 Amb24093652 [0,0,0,0,0,0|1,0,1]=2 243 B12R1.43 OC(=O)C(F)Oc1ccccc1 Amb24433426 [0,0,0,0,0,0|2,0,1]=3 244 B12R1.43 OC(=O)C(F)Sc1cc[n]cc1 Amb24487398 [0,0,0,0,0,0|3,0,1]=4 245 B12R1.43 OC(=O)C(F)Sc1ccccc1 Amb24350687 [0,0,0,0,0,0|2,0,1]=3 246 B12R1.43 OC(=O)C(O)Cc1c[n]c[n]c1 Amb25722221 [0,0,0,0,0,0|2,0,2]=4 247 B12R1.43 OC(=O)C(O)Sc1ccccc1 Amb24748903 [0,0,0,0,0,0|1,0,2]=3 248 B12R1.43 OC(=O)C(S)Cc1cc[n]c[n]1 Amb24587068 [0,0,0,0,0,0|2,1,1]=4 249 B12R1.43 OC(=O)C(S)Cc1cc[n]cc1 Amb18289016 [0,0,0,0,0,0|1,1,1]=3 250 B12R1.43 OC(=O)C(S)Cc1ccc[n]c1 Amb18968269 [0,0,0,0,0,0|1,1,1]=3 251 B12R1.43 OC(=O)C(S)Cc1cccc[n]1 Amb18289034 [0,0,0,0,0,0|1,1,1]=3 252 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [0,0,0,0,0,0|0,1,1]=2 253 B12R1.43 OC(=O)C(Sc1ccccn1)C Amb1139396 [0,0,0,0,0,0|3,0,1]=4 254 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [0,0,0,0,0,0|1,0,1]=2 255 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [0,0,0,0,0,0|0,1,1]=2 256 B12R1.43 OC(=O)[C@H](Cc1cccnc1)N Amb16231985 [0,0,0,0,0,0|2,0,1]=3 257 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [0,0,0,0,0,0|1,0,1]=2 258 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [0,0,0,0,0,0|1,0,1]=2 259 B12R1.43 OC(=O)[C@H](O)Cc1c[n]ccc1 Amb24726274 [0,0,0,0,0,0|1,0,2]=3 260 B12R1.43 OC(=O)[C@H](O)Cc1cc[n]cc1 Amb25260488 [0,0,0,0,0,0|1,0,2]=3 261 B12R1.43 OC(=O)\C(=C\c1ccccn1)\S Amb1761004 [0,0,0,0,0,0|1,1,1]=3 262 B12R1.43 OC(=O)\C(=C\c1cccnc1)\F Amb17614474 [0,0,0,0,0,0|2,0,1]=3 263 B12R1.43 OC(=O)\C(=C\c1cccnc1)\S Amb1761005 [0,0,0,0,0,0|1,1,1]=3 264 B12R1.43 OC(=O)\C(\Cl)=C/c1ccccc1 Amb18648695 [0,0,0,0,0,0|1,0,1]=2 265 B12R1.43 OC(=O)\C(\Cl)=C\c1ccccc1 Amb19651416 [0,0,0,0,0,0|1,0,1]=2 266 B12R1.43 OC(=O)\C(\F)=C\c1cc[n]cc1 Amb24377793 [0,0,0,0,0,0|2,0,1]=3 267 B12R1.43 OC(=S)C(I)Cc1ccccc1 Amb24061263 [0,0,0,0,0,0|1,1,1]=3 268 B12R1.43 OC(C(=O)O)Cc1ccncc1 Amb17138620 [0,0,0,0,0,0|1,0,2]=3 269 B12R1.43 OC(Cl)C(=O)Oc1ccccc1 Amb24658483 [0,0,0,0,0,0|2,0,1]=3 270 B12R1.43 OC(S)C(=O)Oc1ccccc1 Amb25285714 [0,0,0,0,0,0|1,1,1]=3 271 B12R1.43 O\C(=C/c1ccccc1)\C(O)=O Amb18645966 [0,0,0,0,0,0|0,0,2]=2 272 B12R1.43 S=C(C(=O)O)Nc1ccccc1 Amb10558556 [0,0,0,0,0,0|1,1,0]=2 273 B12R1.43 S\C(=C/c1ccccc1)\C(=O)O Amb1250109 [0,0,0,0,0,0|0,1,1]=2 274 B12R1.43 S\C(=C/c1ccncc1)\C(=O)O Amb1761003 [0,0,0,0,0,0|1,1,1]=3 275 B12R1.43 S\C(=C\c1ccccc1)\C(=O)O Amb2550972 [0,0,0,0,0,0|0,1,1]=2 276 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [0,0,0,0,0,0|1,0,1]=2 277 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [0,0,0,0,0,0|0,0,1]=1 278 B12R1.43 [O-][N+](=O)\C(\Br)=C\c1ccccc1 Amb22476019 [0,0,0,0,0,0|2,0,2]=4 279 B11R1.40 BrCC(=O)Cc1ccccc1 Amb17569850 [1,0,0,0,0,0|1,0,1]=3 280 B11R1.40 BrCC(=O)Nc1ccccc1 Amb2222053 [1,0,0,0,0,0|2,0,1]=4 281 B11R1.40 C#CC(=O)Cc1cc[n]cc1 Amb25758182 [1,0,0,0,0,0|2,0,1]=4 282 B11R1.40 C#CC(=O)Cc1ccc[n]c1 Amb25070158 [1,0,0,0,0,0|2,0,1]=4 283 B11R1.40 C#CC(=O)Cc1ccccc1 Amb22059749 [1,0,0,0,0,0|1,0,1]=3 284 B11R1.40 C#CC(=O)Nc1ccccc1 Amb2444736 [1,0,0,0,0,0|2,0,1]=4 285 B11R1.40 C=C(C=C)Nc1ccccc1 Amb25131122 [1,0,0,0,0,0|3,0,0]=4 286 B11R1.40 C=C(C=O)Oc1ccccc1 Amb18124880 [1,0,0,0,0,0|2,0,0]=3 287 B11R1.40 C=C(C=O)Sc1ccccc1 Amb25347672 [1,0,0,0,0,0|2,0,0]=3 288 B11R1.40 C=C(Cc1ccccc1)CCl Amb25185403 [1,0,0,0,0,0|2,0,1]=4 289 B11R1.40 C=CC(=O)Cc1cccc[n]1 Amb24425169 [1,0,0,0,0,0|2,0,0]=3 290 B11R1.40 C=CC(=O)Cc1ccccc1 Amb25353450 [1,0,0,0,0,0|1,0,0]=2 291 B11R1.40 C=CC(=O)Oc1ccccc1 Amb17934129 [1,0,0,0,0,0|2,0,0]=3 292 B11R1.40 C=CC(N)Cc1ccccc1 Amb25064298 [1,0,0,0,0,0|2,0,1]=4 293 B11R1.40 C=CC(O)Cc1ccccc1 Amb24664362 [1,0,0,0,0,0|1,0,2]=4 294 B11R1.40 C=C[C@H](Cc1ccccc1)N Amb10982592 [1,0,0,0,0,0|2,0,1]=4 295 B11R1.40 C=C[C@H](N)Cc1ccccc1 Amb19929662 [1,0,0,0,0,0|2,0,1]=4 296 B11R1.40 CC(C=O)Oc1ccccc1 Amb22011729 [1,0,0,0,0,0|2,0,1]=4 297 B11R1.40 CC(C=O)Sc1ccccc1 Amb18646621 [1,0,0,0,0,0|2,0,1]=4 298 B11R1.40 CC(Cc1ccccc1)=[N+]=[N-] Amb25173943 [1,0,0,0,0,0|3,0,0]=4 299 B11R1.40 CC(Cc1ccccc1)C=C Amb25850978 [1,0,0,0,0,0|2,0,1]=4 300 B11R1.40 CCC(=O)Cc1cccnc1 Amb17477730 [1,0,0,0,0,0|2,0,1]=4 301 B11R1.40 CCC(=O)Cc1ccncc1 Amb17477729 [1,0,0,0,0,0|2,0,1]=4 302 B11R1.40 CCS(=O)Cc1ccccc1 Amb24485048 [1,0,0,0,0,0|2,0,1]=4 303 B11R1.40 CN(CO)Cc1ccccc1 Amb24555500 [1,0,0,0,0,0|2,0,1]=4 304 B11R1.40 CN(Cc1c[n]ccc1)C=O Amb24096746 [1,0,0,0,0,0|3,0,0]=4 305 B11R1.40 CN(Cc1cccc[n]1)C=O Amb25189288 [1,0,0,0,0,0|3,0,0]=4 306 B11R1.40 CN(Cc1ccccc1)C=S Amb25793091 [1,0,0,0,0,0|2,1,0]=4 307 B11R1.40 CN(Cc1ccccc1)N=O Amb24074071 [1,0,0,0,0,0|3,0,0]=4 308 B11R1.40 CNC(=O)C[n+]1ccccc1 Amb10553027 [1,0,0,0,0,0|3,0,0]=4 309 B11R1.40 CNC(=O)Cc1cccnc1 Amb16231203 [1,0,0,0,0,0|3,0,0]=4 310 B11R1.40 CNC(=O)Cc1ccncc1 Amb16231202 [1,0,0,0,0,0|3,0,0]=4 311 B11R1.40 CNC(=S)Cc1ccccc1 Amb24559245 [1,0,0,0,0,0|2,1,0]=4 312 B11R1.40 COC(=N)Cc1ccccc1 Amb17673180 [1,0,0,0,0,0|3,0,0]=4 313 B11R1.40 COC(=N)Cc1ccccc1 Amb22366095 [1,0,0,0,0,0|3,0,0]=4 314 B11R1.40 COC(=O)Cc1cc[n]cc1 Amb20240688 [1,0,0,0,0,0|3,0,0]=4 315 B11R1.40 COC(=O)Cc1ccc[n]c1 Amb22497118 [1,0,0,0,0,0|3,0,0]=4 316 B11R1.40 COC(=O)Cc1ccccn1 Amb1223230 [1,0,0,0,0,0|3,0,0]=4 317 B11R1.40 COC(=O)Nc1ccccc1 Amb1200636 [1,0,0,0,0,0|3,0,0]=4 318 B11R1.40 COC(=O)Oc1ccccc1 Amb10807421 [1,0,0,0,0,0|3,0,0]=4 319 B11R1.40 CSC(=N)Cc1ccccc1 Amb25211803 [1,0,0,0,0,0|3,0,0]=4 320 B11R1.40 CSC(=O)Cc1ccccc1 Amb25293907 [1,0,0,0,0,0|2,0,0]=3 321 B11R1.40 C[C@@H](C=O)Nc1ccccc1 Amb25836355 [1,0,0,0,0,0|2,0,1]=4 322 B11R1.40 C[C@@H](C=O)Oc1ccccc1 Amb24504931 [1,0,0,0,0,0|2,0,1]=4 323 B11R1.40 C[C@@H](Cc1cc[n]cc1)C=O Amb24608169 [1,0,0,0,0,0|2,0,1]=4 324 B11R1.40 C[C@H](CO)Cc1ccccc1 Amb25266388 [1,0,0,0,0,0|1,0,2]=4 325 B11R1.40 C[C@H](Cc1ccccc1)C=O Amb25255421 [1,0,0,0,0,0|1,0,1]=3 326 B11R1.40 C\C(=C/Cl)\Sc1ccccc1 Amb24694004 [1,0,0,0,0,0|3,0,0]=4 327 B11R1.40 C\C(=C\c1cc[n]cc1)\C=O Amb24366948 [1,0,0,0,0,0|2,0,1]=4 328 B11R1.40 C\C(=C\c1cccc[n]1)\C=O Amb25149235 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.40 C\C(=C\c1ccccc1)\C=O Amb22058732 [1,0,0,0,0,0|1,0,1]=3 330 B11R1.40 C\C(=C\c1ccccc1)\N=O Amb25246172 [1,0,0,0,0,0|2,0,1]=4 331 B11R1.40 C\C(\Cc1cc[n]cc1)=N/O Amb24630186 [1,0,0,0,0,0|3,0,0]=4 332 B11R1.40 C\C(\Cc1cc[n]cc1)=N\O Amb24417230 [1,0,0,0,0,0|3,0,0]=4 333 B11R1.40 C\C(\Cc1ccccc1)=C\Cl Amb24718044 [1,0,0,0,0,0|2,0,0]=3 334 B11R1.40 C\C(\Cc1ccccc1)=N\N Amb24501436 [1,0,0,0,0,0|3,0,0]=4 335 B11R1.40 C\N=C(\N)/Cc1ccccc1 Amb23569051 [1,0,0,0,0,0|3,0,0]=4 336 B11R1.40 ClCC(=O)Cc1ccccc1 Amb2371529 [1,0,0,0,0,0|1,0,1]=3 337 B11R1.40 ClCC(=O)Oc1ccccc1 Amb1914503 [1,0,0,0,0,0|2,0,1]=4 338 B11R1.40 N=C(Cc1ccccc1)NO Amb20671380 [1,0,0,0,0,0|2,0,0]=3 339 B11R1.40 NC(Cc1ccccc1)=S=O Amb25053951 [1,0,0,0,0,0|2,0,0]=3 340 B11R1.40 NC(Cc1ccccc1)NO Amb25047325 [1,0,0,0,0,0|2,0,1]=4 341 B11R1.40 NC(Nc1ccccc1)=NO Amb18799378 [1,0,0,0,0,0|3,0,0]=4 342 B11R1.40 NCC(=O)Cc1c[n]ccc1 Amb18251321 [1,0,0,0,0,0|2,0,1]=4 343 B11R1.40 NCC(=O)Cc1cc[n]cc1 Amb18201930 [1,0,0,0,0,0|2,0,1]=4 344 B11R1.40 NCC(=O)Cc1cccc[n]1 Amb18908409 [1,0,0,0,0,0|2,0,1]=4 345 B11R1.40 NCC(=O)Cc1ccccc1 Amb18202084 [1,0,0,0,0,0|1,0,1]=3 346 B11R1.40 NCC(=O)Cc1ccccc1 Amb19516183 [1,0,0,0,0,0|1,0,1]=3 347 B11R1.40 NCC(=O)Nc1ccccc1 Amb10609338 [1,0,0,0,0,0|2,0,1]=4 348 B11R1.40 NCC(=O)Oc1ccccc1 Amb17334310 [1,0,0,0,0,0|2,0,1]=4 349 B11R1.40 NNC(=O)C[N]1=CC=CC=C1 Amb17836433 [1,0,0,0,0,0|3,0,0]=4 350 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb10552843 [1,0,0,0,0,0|3,0,0]=4 351 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb1154171 [1,0,0,0,0,0|3,0,0]=4 352 B11R1.40 NNC(=O)C[n+]1ccccc1 Amb19748594 [1,0,0,0,0,0|3,0,0]=4 353 B11R1.40 NNC(=O)Cc1cccc[n]1 Amb19373217 [1,0,0,0,0,0|3,0,0]=4 354 B11R1.40 NNC(=O)Cc1ccccc1 Amb24081244 [1,0,0,0,0,0|2,0,0]=3 355 B11R1.40 NNC(=O)Cc1ccncc1 Amb1133661 [1,0,0,0,0,0|3,0,0]=4 356 B11R1.40 NNC(=O)Nc1ccccc1 Amb1204373 [1,0,0,0,0,0|3,0,0]=4 357 B11R1.40 NNC(=S)Cc1ccccc1 Amb24377114 [1,0,0,0,0,0|2,1,0]=4 358 B11R1.40 NOC(=O)Nc1ccccc1 Amb24484939 [1,0,0,0,0,0|3,0,0]=4 359 B11R1.40 N[C@@H](CO)Cc1ccccc1 Amb20242871 [1,0,0,0,0,0|1,0,2]=4 360 B11R1.40 N[C@H](Cc1ccccc1)C=O Amb24746755 [1,0,0,0,0,0|1,0,1]=3 361 B11R1.40 N\C(\Cc1ccccc1)=C\O Amb25152159 [1,0,0,0,0,0|1,0,0]=2 362 B11R1.40 N\C(\Cc1ccccc1)=N/N Amb17933233 [1,0,0,0,0,0|3,0,0]=4 363 B11R1.40 N\C(\Cc1ccccc1)=N\Cl Amb25689858 [1,0,0,0,0,0|3,0,0]=4 364 B11R1.40 N\N=C(\Cl)/Cc1ccccc1 Amb25188651 [1,0,0,0,0,0|3,0,0]=4 365 B11R1.40 O=C(C=O)Nc1cc[n]cc1 Amb24360354 [1,0,0,0,0,0|2,0,0]=3 366 B11R1.40 O=C(C=O)Oc1c[n]ccc1 Amb24484745 [1,0,0,0,0,0|2,0,0]=3 367 B11R1.40 O=C(C=O)Oc1ccccc1 Amb18125060 [1,0,0,0,0,0|1,0,0]=2 368 B11R1.40 O=C(CBr)C[n+]1ccccc1 Amb24641641 [1,0,0,0,0,0|2,0,1]=4 369 B11R1.40 O=C(CBr)Sc1ccccc1 Amb24730786 [1,0,0,0,0,0|2,0,1]=4 370 B11R1.40 O=C(CCl)Sc1ccccc1 Amb24712200 [1,0,0,0,0,0|2,0,1]=4 371 B11R1.40 O=C(CF)Nc1ccccc1 Amb20246909 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.40 O=C(CI)Nc1ccccc1 Amb21964671 [1,0,0,0,0,0|2,0,1]=4 373 B11R1.40 O=C(CP)Nc1ccccc1 Amb25032359 [1,0,0,0,0,0|2,0,1]=4 374 B11R1.40 O=C(Cc1cc[n]cc1)CCl Amb22494556 [1,0,0,0,0,0|2,0,1]=4 375 B11R1.40 O=C(Cc1ccccc1)CF Amb22234964 [1,0,0,0,0,0|1,0,1]=3 376 B11R1.40 O=C(Cc1ccccc1)CS Amb25294429 [1,0,0,0,0,0|0,1,1]=3 377 B11R1.40 O=C(Cc1ccccc1)O[Ag] Amb22359200 [1,0,0,0,0,0|2,0,0]=3 378 B11R1.40 O=C(Nc1ccccc1)NCl Amb25756195 [1,0,0,0,0,0|3,0,0]=4 379 B11R1.40 O=C(Nc1ccccc1)SCl Amb25095177 [1,0,0,0,0,0|3,0,0]=4 380 B11R1.40 O=CC(=O)Cc1ccccc1 Amb17593687 [1,0,0,0,0,0|0,0,0]=1 381 B11R1.40 O=CC(Br)Cc1c[n]ccc1 Amb25365114 [1,0,0,0,0,0|2,0,1]=4 382 B11R1.40 O=CC(Br)Cc1ccccc1 Amb18657408 [1,0,0,0,0,0|1,0,1]=3 383 B11R1.40 O=CC(Cc1ccccc1)Cl Amb17204312 [1,0,0,0,0,0|1,0,1]=3 384 B11R1.40 O=CC(F)Cc1cc[n]cc1 Amb25053677 [1,0,0,0,0,0|2,0,1]=4 385 B11R1.40 O=CC(F)Cc1ccccc1 Amb24714702 [1,0,0,0,0,0|1,0,1]=3 386 B11R1.40 O=C[C@@H](Br)Cc1ccccc1 Amb24461614 [1,0,0,0,0,0|1,0,1]=3 387 B11R1.40 O=C[C@@H](F)Cc1ccccc1 Amb24724556 [1,0,0,0,0,0|1,0,1]=3 388 B11R1.40 O=C[C@H](Br)Cc1ccccc1 Amb25778238 [1,0,0,0,0,0|1,0,1]=3 389 B11R1.40 O=C\C(=C\c1ccccn1)\C Amb1014105 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.40 O=C\C(=C\c1cccnc1)\C Amb17334266 [1,0,0,0,0,0|2,0,1]=4 391 B11R1.40 O=C\C(=C\c1ccncc1)\C Amb17334268 [1,0,0,0,0,0|2,0,1]=4 392 B11R1.40 O=C\C(\Br)=C/c1ccccc1 Amb25047719 [1,0,0,0,0,0|1,0,1]=3 393 B11R1.40 O=C\C(\Cl)=C/c1ccc[n]c1 Amb24357125 [1,0,0,0,0,0|2,0,1]=4 394 B11R1.40 O=C\C(\Cl)=C\c1cccc[n]1 Amb18126489 [1,0,0,0,0,0|2,0,1]=4 395 B11R1.40 O=C\C(\F)=C/c1ccccc1 Amb25714375 [1,0,0,0,0,0|1,0,1]=3 396 B11R1.40 O=C\C(\F)=C\c1cccc[n]1 Amb24689556 [1,0,0,0,0,0|2,0,1]=4 397 B11R1.40 O=C\C(\F)=C\c1ccccc1 Amb18125101 [1,0,0,0,0,0|1,0,1]=3 398 B11R1.40 O=N\C(\Br)=C\c1ccccc1 Amb24666519 [1,0,0,0,0,0|2,0,1]=4 399 B11R1.40 O=S(CCl)Cc1ccccc1 Amb24373167 [1,0,0,0,0,0|2,0,1]=4 400 B11R1.40 OC(Cc1c[n]ccc1)C=O Amb24533570 [1,0,0,0,0,0|1,0,2]=4 401 B11R1.40 OC(Cc1cc[n]cc1)C=O Amb24751695 [1,0,0,0,0,0|1,0,2]=4 402 B11R1.40 OC(Cc1ccccc1)C=O Amb25065752 [1,0,0,0,0,0|0,0,2]=3 403 B11R1.40 OCC(=O)Cc1ccccc1 Amb18182729 [1,0,0,0,0,0|0,0,1]=2 404 B11R1.40 OCC(=O)Nc1ccccc1 Amb1110212 [1,0,0,0,0,0|1,0,1]=3 405 B11R1.40 OCC(=O)Oc1ccccc1 Amb25149728 [1,0,0,0,0,0|1,0,1]=3 406 B11R1.40 OCC(Cc1ccccc1)C Amb17477578 [1,0,0,0,0,0|1,0,2]=4 407 B11R1.40 OCC(Cc1ccccc1)O Amb17593786 [1,0,0,0,0,0|0,0,3]=4 408 B11R1.40 OCC(Cl)Cc1ccccc1 Amb24373181 [1,0,0,0,0,0|1,0,2]=4 409 B11R1.40 OCC(F)Cc1ccccc1 Amb25225922 [1,0,0,0,0,0|1,0,2]=4 410 B11R1.40 OC[C@@H](O)Cc1ccccc1 Amb25204361 [1,0,0,0,0,0|0,0,3]=4 411 B11R1.40 OC[C@H](Br)Cc1ccccc1 Amb24639076 [1,0,0,0,0,0|1,0,2]=4 412 B11R1.40 OC[C@H](O)Cc1ccccc1 Amb24392862 [1,0,0,0,0,0|0,0,3]=4 413 B11R1.40 OC\C(\Br)=C\c1ccccc1 Amb25187542 [1,0,0,0,0,0|1,0,2]=4 414 B11R1.40 ON=C(Cc1ccccn1)N Amb13994155 [1,0,0,0,0,0|3,0,0]=4 415 B11R1.40 ONC(=O)Cc1ccc[n]c1 Amb25052392 [1,0,0,0,0,0|2,0,0]=3 416 B11R1.40 ONC(=O)Oc1ccccc1 Amb22493600 [1,0,0,0,0,0|2,0,0]=3 417 B11R1.40 O[C@H](Cc1ccccc1)C=O Amb25683436 [1,0,0,0,0,0|0,0,2]=3 418 B11R1.40 O\C(=C/c1ccccc1)\C=O Amb18124881 [1,0,0,0,0,0|0,0,2]=3 419 B11R1.40 O\C(=C\c1ccccc1)\C=O Amb24595210 [1,0,0,0,0,0|0,0,2]=3 420 B11R1.40 O\C(\Cc1ccccc1)=N/O Amb19986986 [1,0,0,0,0,0|1,0,1]=3 421 B11R1.40 O\N=C(/Cc1ccccc1)\N Amb1106303 [1,0,0,0,0,0|2,0,0]=3 422 B11R1.40 O\N=C(\Cc1ccccc1)/N Amb1159399 [1,0,0,0,0,0|2,0,0]=3 423 B11R1.40 O\N=C(\Cl)/Cc1ccccc1 Amb25721012 [1,0,0,0,0,0|2,0,0]=3 424 B11R1.40 SCC(=O)Nc1ccccc1 Amb1349645 [1,0,0,0,0,0|1,1,1]=4 425 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [1,0,0,0,0,0|3,0,0]=4 426 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [1,0,0,0,0,0|2,0,1]=4 427 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,0,0,0,0,0|3,0,0]=4 428 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,0,0,0,0,0|3,0,0]=4 429 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [1,0,0,0,0,0|3,0,0]=4 430 B11R1.91 CC(=O)C=Cc1ccc[nH+]c1 Amb24099599 [1,0,0,0,0,0|2,0,1]=4 431 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,0,0,0,0,0|2,0,1]=4 432 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,0,0|2,0,1]=4 433 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,0,0|2,0,1]=4 434 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,0,0,0,0,0|2,0,1]=4 435 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,0,0,0,0,0|2,0,0]=3 436 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [1,0,0,0,0,0|3,0,0]=4 437 B11R1.91 CC(=O)SCc1ccc[n]c1 Amb22274513 [1,0,0,0,0,0|3,0,0]=4 438 B11R1.91 CC(=O)SCc1cccc[n]1 Amb22274512 [1,0,0,0,0,0|3,0,0]=4 439 B11R1.91 CC(=O)SSc1ccccc1 Amb24370825 [1,0,0,0,0,0|3,0,0]=4 440 B11R1.91 CC(=O)\C=C/c1cccc[n]1 Amb24532942 [1,0,0,0,0,0|2,0,1]=4 441 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [1,0,0,0,0,0|1,0,1]=3 442 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,0,0,0,0|1,0,1]=3 443 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [1,0,0,0,0,0|2,0,1]=4 444 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb17477757 [1,0,0,0,0,0|2,0,1]=4 445 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb17477756 [1,0,0,0,0,0|2,0,1]=4 446 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [1,0,0,0,0,0|2,0,0]=3 447 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,0,0,0,0,0|3,0,0]=4 448 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,0,0,0,0,0|2,1,0]=4 449 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [1,0,0,0,0,0|2,1,0]=4 450 B11R1.91 CC(C)=CNc1ccccc1 Amb24715634 [1,0,0,0,0,0|3,0,0]=4 451 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [1,0,0,0,0,0|2,0,1]=4 452 B11R1.91 CC(\C=C\c1ccccc1)O Amb17593695 [1,0,0,0,0,0|1,0,2]=4 453 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,0,0,0,0,0|1,0,2]=4 454 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,0,0,0,0,0|1,0,2]=4 455 B11R1.91 C\C(=C\C[n+]1ccccc1)\Cl Amb2228412 [1,0,0,0,0,0|3,0,0]=4 456 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [1,0,0,0,0,0|3,0,0]=4 457 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [1,0,0,0,0,0|3,0,0]=4 458 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [1,0,0,0,0,0|3,0,0]=4 459 B11R1.91 NC(=N)C=Cc1ccccc1 Amb22464717 [1,0,0,0,0,0|2,0,1]=4 460 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [1,0,0,0,0,0|3,0,0]=4 461 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [1,0,0,0,0,0|3,0,0]=4 463 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [1,0,0,0,0,0|3,0,0]=4 464 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22755484 [1,0,0,0,0,0|2,0,1]=4 465 B11R1.91 NC(=N)\C=C\c1ccccc1 Amb22756994 [1,0,0,0,0,0|2,0,1]=4 466 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [1,0,0,0,0,0|3,0,0]=4 467 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [1,0,0,0,0,0|2,0,1]=4 468 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [1,0,0,0,0,0|2,0,1]=4 469 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,0,0,0,0,0|2,0,0]=3 470 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [1,0,0,0,0,0|3,0,0]=4 471 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [1,0,0,0,0,0|3,0,0]=4 473 B11R1.91 NC(=O)\C=C/c1cccnc1 Amb10552966 [1,0,0,0,0,0|2,0,1]=4 474 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,0,0,0,0,0|1,1,1]=4 475 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [1,0,0,0,0,0|2,1,0]=4 476 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [1,0,0,0,0,0|2,1,0]=4 477 B11R1.91 NC(=S)\C=C\c1ccccc1 Amb18105844 [1,0,0,0,0,0|1,1,1]=4 478 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [1,0,0,0,0,0|3,0,0]=4 479 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [1,0,0,0,0,0|3,0,0]=4 480 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [1,0,0,0,0,0|3,0,0]=4 481 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [1,0,0,0,0,0|2,0,1]=4 482 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [1,0,0,0,0,0|2,0,0]=3 483 B11R1.91 O=C(Cl)OCc1cc[n]cc1 Amb24559531 [1,0,0,0,0,0|3,0,0]=4 484 B11R1.91 O=C(Cl)OCc1ccc[n]c1 Amb25852784 [1,0,0,0,0,0|3,0,0]=4 485 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [1,0,0,0,0,0|0,1,1]=3 486 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [1,0,0,0,0,0|2,0,1]=4 487 B11R1.91 OB(CCc1ccccc1)O Amb2456045 [1,0,0,0,0,0|1,0,2]=4 488 B11R1.91 OB(O)\C=C/c1ccccc1 Amb24117859 [1,0,0,0,0,0|1,0,2]=4 489 B11R1.91 OB(\C=C\c1ccccc1)O Amb2447227 [1,0,0,0,0,0|1,0,2]=4 490 B11R1.91 OC(=O)C#Cc1c[n]ccc1 Amb20673066 [1,0,0,0,0,0|1,0,2]=4 491 B11R1.91 OC(=O)C#Cc1cc[n]cc1 Amb20673077 [1,0,0,0,0,0|1,0,2]=4 492 B11R1.91 OC(=O)C#Cc1ccccn1 Amb16233314 [1,0,0,0,0,0|1,0,2]=4 493 B11R1.91 OC(=O)C=Cc1c[n]cc[n]1 Amb24082749 [1,0,0,0,0,0|2,0,1]=4 494 B11R1.91 OC(=O)CCc1c[n]c[n]c1 Amb18201449 [1,0,0,0,0,0|2,0,1]=4 495 B11R1.91 OC(=O)CCc1cc[n][n]c1 Amb22499259 [1,0,0,0,0,0|2,0,1]=4 496 B11R1.91 OC(=O)CCc1ccc[n][n]1 Amb23592184 [1,0,0,0,0,0|2,0,1]=4 497 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [1,0,0,0,0,0|0,0,1]=2 498 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [1,0,0,0,0,0|1,0,1]=3 499 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [1,0,0,0,0,0|1,0,1]=3 500 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [1,0,0,0,0,0|1,0,1]=3 501 B11R1.91 OC(=O)CNc1cc[n]cc1 Amb21955325 [1,0,0,0,0,0|2,0,1]=4 502 B11R1.91 OC(=O)CNc1ccc[n]c1 Amb22035240 [1,0,0,0,0,0|2,0,1]=4 503 B11R1.91 OC(=O)CNc1cccc[nH+]1 Amb10564534 [1,0,0,0,0,0|2,0,1]=4 504 B11R1.91 OC(=O)CNc1cccc[n]1 Amb22495404 [1,0,0,0,0,0|2,0,1]=4 505 B11R1.91 OC(=O)CNc1cccnc1 Amb17593781 [1,0,0,0,0,0|2,0,1]=4 506 B11R1.91 OC(=O)COc1c[n]ccc1 Amb22738612 [1,0,0,0,0,0|2,0,1]=4 507 B11R1.91 OC(=O)COc1cc[n]cc1 Amb18125520 [1,0,0,0,0,0|2,0,1]=4 508 B11R1.91 OC(=O)COc1ccc[nH+]c1 Amb22370885 [1,0,0,0,0,0|2,0,1]=4 509 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [1,0,0,0,0,0|1,0,1]=3 510 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [1,0,0,0,0,0|1,0,1]=3 511 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [1,0,0,0,0,0|1,0,1]=3 512 B11R1.91 OC(=O)CSc1cc[n]cc1 Amb24053001 [1,0,0,0,0,0|2,0,1]=4 513 B11R1.91 OC(=O)CSc1ccc[n]c1 Amb24692785 [1,0,0,0,0,0|2,0,1]=4 514 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [1,0,0,0,0,0|1,0,1]=3 515 B11R1.91 OC(=O)CSc1ccccn1 Amb1130490 [1,0,0,0,0,0|2,0,1]=4 516 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [1,0,0,0,0,0|1,0,0]=2 517 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [1,0,0,0,0,0|0,0,1]=2 518 B11R1.91 OC(=O)\C=C/c1[n]ccc[n]1 Amb25830337 [1,0,0,0,0,0|2,0,1]=4 519 B11R1.91 OC(=O)\C=C/c1cc[n]cc1 Amb20622011 [1,0,0,0,0,0|1,0,1]=3 520 B11R1.91 OC(=O)\C=C/c1ccc[n]c1 Amb25378742 [1,0,0,0,0,0|1,0,1]=3 521 B11R1.91 OC(=O)\C=C/c1ccccn1 Amb10071558 [1,0,0,0,0,0|1,0,1]=3 522 B11R1.91 OC(=O)\C=C\N1CC=CC=C1 Amb22015329 [1,0,0,0,0,0|1,0,2]=4 523 B11R1.91 OC(=O)\C=C\c1cc[n][n]c1 Amb18125071 [1,0,0,0,0,0|2,0,1]=4 524 B11R1.91 OC(=O)\C=C\c1cc[n]c[n]1 Amb25337419 [1,0,0,0,0,0|2,0,1]=4 525 B11R1.91 OC(=O)\C=C\c1ccc[n][n]1 Amb18125070 [1,0,0,0,0,0|2,0,1]=4 526 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [1,0,0,0,0,0|0,0,1]=2 527 B11R1.91 OC(=O)\C=C\c1ccncc1 Amb1107607 [1,0,0,0,0,0|1,0,1]=3 528 B11R1.91 OC(=O)\C=C\c1cnccn1 Amb10609139 [1,0,0,0,0,0|2,0,1]=4 529 B11R1.91 OC(=O)\C=C\c1ncccn1 Amb17593721 [1,0,0,0,0,0|2,0,1]=4 530 B11R1.91 OC(=O)\C=N/c1cc[n]cc1 Amb24068310 [1,0,0,0,0,0|2,0,0]=3 531 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [1,0,0,0,0,0|1,0,0]=2 532 B11R1.91 OC(O)CCc1ccccc1 Amb25829695 [1,0,0,0,0,0|0,0,3]=4 533 B11R1.91 OS(=O)CCc1cc[n]cc1 Amb24546017 [1,0,0,0,0,0|2,0,1]=4 534 B11R1.91 OS(=O)CNc1ccccc1 Amb25798133 [1,0,0,0,0,0|2,0,1]=4 535 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [1,0,0,0,0,0|0,0,1]=2 536 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [1,0,0,0,0,0|0,2,1]=4 537 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [1,0,0,0,0,0|1,2,0]=4 538 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [1,0,0,0,0,0|1,2,0]=4 539 B11R1.91 [O-]C(=O)C#Cc1ccccc1 Amb22753901 [1,0,0,0,0,0|0,0,3]=4 540 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [1,0,0,0,0,0|0,0,2]=3 541 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [1,0,0,0,0,0|1,0,2]=4 542 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [1,0,0,0,0,0|1,0,2]=4 543 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [1,0,0,0,0,0|1,0,2]=4 544 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [1,0,0,0,0,0|0,0,2]=3 545 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [1,0,0,0,0,0|0,0,2]=3 546 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [1,0,0,0,0,0|2,0,1]=4 547 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [1,0,0,0,0,0|2,0,1]=4 548 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [1,0,0,0,0,0|1,0,2]=4 549 B13R1.133 Bc1ccc(CC(N)C(O)=O)cc1 Amb25056890 [0,1,0,0,0,0|1,0,1]=3 550 B13R1.133 Bc1ccc(C[C@H](N)C(O)=O)cc1 Amb24495483 [0,1,0,0,0,0|1,0,1]=3 551 B13R1.133 BrC(C(=O)C)Cc1ccc(cc1)Cl Amb17507836 [0,1,0,0,0,0|2,0,1]=4 552 B13R1.133 BrC(C(=O)C)Cc1ccc(cc1)F Amb17507837 [0,1,0,0,0,0|2,0,1]=4 553 B13R1.133 BrC(C(=O)O)Cc1ccc(cc1)F Amb2480736 [0,1,0,0,0,0|1,0,1]=3 554 B13R1.133 Br\C(=C/c1ccc(cc1)Cl)\C(=O)C Amb2433257 [0,1,0,0,0,0|2,0,1]=4 555 B13R1.133 C=C(Cc1ccc(Cl)cc1)C(O)=O Amb18130358 [0,1,0,0,0,0|1,0,0]=2 556 B13R1.133 C=C(Cl)C(=O)Nc1ccc(Br)cc1 Amb22460391 [0,1,0,0,0,0|3,0,0]=4 557 B13R1.133 C=C(Cl)C(=O)Nc1ccc(I)cc1 Amb22460397 [0,1,0,0,0,0|3,0,0]=4 558 B13R1.133 C=C(Cl)C(=O)Nc1ccc(O)cc1 Amb25766511 [0,1,0,0,0,0|3,0,0]=4 559 B13R1.133 C=C(Oc1ccc(Cl)cc1)C(O)=O Amb18130544 [0,1,0,0,0,0|2,0,0]=3 560 B13R1.133 CC(=C)C(=O)Cc1ccc(Cl)cc1 Amb25696266 [0,1,0,0,0,0|2,0,0]=3 561 B13R1.133 CC(=C)C(=O)Cc1ccc(N)cc1 Amb25104589 [0,1,0,0,0,0|2,0,0]=3 562 B13R1.133 CC(=C)C(=O)Nc1ccc(Br)cc1 Amb22001452 [0,1,0,0,0,0|3,0,0]=4 563 B13R1.133 CC(=C)C(=O)Nc1ccc(N)cc1 Amb24390819 [0,1,0,0,0,0|3,0,0]=4 564 B13R1.133 CC(=C)C(=O)Nc1ccc(O)cc1 Amb17934074 [0,1,0,0,0,0|3,0,0]=4 565 B13R1.133 CC(=C)C(=O)Oc1ccc(Cl)cc1 Amb25138122 [0,1,0,0,0,0|3,0,0]=4 566 B13R1.133 CC(=C)C(=O)Oc1ccc(N)cc1 Amb18127866 [0,1,0,0,0,0|3,0,0]=4 567 B13R1.133 CC(=Cc1ccc(I)cc1)C(O)=O Amb17844105 [0,1,0,0,0,0|1,0,1]=3 568 B13R1.133 CC(=O)C(=C)Sc1ccc(Cl)cc1 Amb24496391 [0,1,0,0,0,0|3,0,0]=4 569 B13R1.133 CC(=O)C(=O)Cc1ccc(Br)cc1 Amb23603629 [0,1,0,0,0,0|1,0,0]=2 570 B13R1.133 CC(=O)C(=O)Cc1ccc(C)cc1 Amb23603620 [0,1,0,0,0,0|1,0,0]=2 571 B13R1.133 CC(=O)C(=O)Cc1ccc(Cl)cc1 Amb23603627 [0,1,0,0,0,0|1,0,0]=2 572 B13R1.133 CC(=O)C(=O)Cc1ccc(F)cc1 Amb23603622 [0,1,0,0,0,0|1,0,0]=2 573 B13R1.133 CC(=O)C(=O)Nc1ccc(I)cc1 Amb21949004 [0,1,0,0,0,0|2,0,0]=3 574 B13R1.133 CC(=O)C(=O)Oc1ccc(O)cc1 Amb25730163 [0,1,0,0,0,0|2,0,0]=3 575 B13R1.133 CC(=O)C(=S)Nc1ccc(Br)cc1 Amb21949008 [0,1,0,0,0,0|2,1,0]=4 576 B13R1.133 CC(=O)C(=S)Nc1ccc(Cl)cc1 Amb21949007 [0,1,0,0,0,0|2,1,0]=4 577 B13R1.133 CC(=O)C(=S)Nc1ccc(I)cc1 Amb21949009 [0,1,0,0,0,0|2,1,0]=4 578 B13R1.133 CC(=O)C(Br)Cc1ccc(Br)cc1 Amb18088195 [0,1,0,0,0,0|2,0,1]=4 579 B13R1.133 CC(=O)C(Br)Cc1ccc(I)cc1 Amb25252609 [0,1,0,0,0,0|2,0,1]=4 580 B13R1.133 CC(=O)C(Br)Cc1ccc(O)cc1 Amb25280115 [0,1,0,0,0,0|2,0,1]=4 581 B13R1.133 CC(=O)C(C)Cc1ccc(I)cc1 Amb25841136 [0,1,0,0,0,0|2,0,1]=4 582 B13R1.133 CC(=O)C(Cc1ccc(cc1)C)C Amb17233205 [0,1,0,0,0,0|2,0,1]=4 583 B13R1.133 CC(=O)C(Cc1ccc(cc1)C)Cl Amb17204370 [0,1,0,0,0,0|2,0,1]=4 584 B13R1.133 CC(=O)C(F)Cc1ccc(O)cc1 Amb24553647 [0,1,0,0,0,0|2,0,1]=4 585 B13R1.133 CC(=O)N(C)Cc1ccc(Br)cc1 Amb21520986 [0,1,0,0,0,0|3,0,0]=4 586 B13R1.133 CC(=O)N(Cl)Cc1ccc(Cl)cc1 Amb22479406 [0,1,0,0,0,0|3,0,0]=4 587 B13R1.133 CC(=O)[C@@H](C)Cc1ccc(O)cc1 Amb25703862 [0,1,0,0,0,0|2,0,1]=4 588 B13R1.133 CC(=O)[C@@H](O)Cc1ccc(O)cc1 Amb24736376 [0,1,0,0,0,0|1,0,2]=4 589 B13R1.133 CC(C(=O)C)Cc1ccc(cc1)Br Amb17255483 [0,1,0,0,0,0|2,0,1]=4 590 B13R1.133 CC(C(=O)C)Cc1ccc(cc1)Cl Amb17236509 [0,1,0,0,0,0|2,0,1]=4 591 B13R1.133 CC(C(=O)C)Cc1ccc(cc1)F Amb17233679 [0,1,0,0,0,0|2,0,1]=4 592 B13R1.133 CC(C(=O)Cc1ccc(cc1)F)C Amb17138955 [0,1,0,0,0,0|2,0,1]=4 593 B13R1.133 CC(C(=O)Nc1ccc(cc1)Br)O Amb17410948 [0,1,0,0,0,0|2,0,1]=4 594 B13R1.133 CC(C(=O)Nc1ccc(cc1)Cl)O Amb17402322 [0,1,0,0,0,0|2,0,1]=4 595 B13R1.133 CC(C(=O)Nc1ccc(cc1)F)O Amb17400968 [0,1,0,0,0,0|2,0,1]=4 596 B13R1.133 CC(C(=O)O)Cc1ccc(cc1)Br Amb16185778 [0,1,0,0,0,0|1,0,1]=3 597 B13R1.133 CC(C(=O)O)Oc1ccc(cc1)Br Amb1215354 [0,1,0,0,0,0|2,0,1]=4 598 B13R1.133 CC(C(=O)O)Oc1ccc(cc1)F Amb1215582 [0,1,0,0,0,0|2,0,1]=4 599 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)Br Amb1115989 [0,1,0,0,0,0|2,0,1]=4 600 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)C Amb1653866 [0,1,0,0,0,0|2,0,1]=4 601 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)Cl Amb1545582 [0,1,0,0,0,0|2,0,1]=4 602 B13R1.133 CC(C(=O)O)Sc1ccc(cc1)F Amb1115911 [0,1,0,0,0,0|2,0,1]=4 603 B13R1.133 CC(C)C(=O)Cc1ccc(Br)cc1 Amb25077569 [0,1,0,0,0,0|2,0,1]=4 604 B13R1.133 CC(C)C(=O)Cc1ccc(Cl)cc1 Amb18034025 [0,1,0,0,0,0|2,0,1]=4 605 B13R1.133 CC(CN1C=CC(=O)C=C1)C(O)=O Amb18302709 [0,1,0,0,0,0|2,0,1]=4 606 B13R1.133 CC(Cc1ccc(Br)cc1)C(N)=O Amb24271353 [0,1,0,0,0,0|2,0,1]=4 607 B13R1.133 CC(Cc1ccc(Cl)[n]c1)C(O)=O Amb25685273 [0,1,0,0,0,0|2,0,1]=4 608 B13R1.133 CC(Cc1ccc(I)cc1)C(O)=O Amb25155540 [0,1,0,0,0,0|1,0,1]=3 609 B13R1.133 CC(Cc1ccc(O)c[n]1)C(O)=O Amb25317406 [0,1,0,0,0,0|2,0,1]=4 610 B13R1.133 CC(Cc1ccc(O)cc1)C(O)=O Amb25798442 [0,1,0,0,0,0|1,0,1]=3 611 B13R1.133 CC(Cl)C(=O)Cc1ccc(F)cc1 Amb25751992 [0,1,0,0,0,0|2,0,1]=4 612 B13R1.133 CC(N)C(=O)Cc1ccc(Br)cc1 Amb18727287 [0,1,0,0,0,0|2,0,1]=4 613 B13R1.133 CC(N)C(=O)Cc1ccc(Cl)cc1 Amb18188148 [0,1,0,0,0,0|2,0,1]=4 614 B13R1.133 CC(N)C(=O)Cc1ccc(F)cc1 Amb18193155 [0,1,0,0,0,0|2,0,1]=4 615 B13R1.133 CC(N)C(=O)Cc1ccc(I)cc1 Amb25104635 [0,1,0,0,0,0|2,0,1]=4 616 B13R1.133 CC(N)C(=O)Cc1ccc(O)cc1 Amb25155991 [0,1,0,0,0,0|2,0,1]=4 617 B13R1.133 CC(Nc1ccc(I)cc1)C(O)=O Amb25821772 [0,1,0,0,0,0|2,0,1]=4 618 B13R1.133 CC(Nc1ccc(N)cc1)C(O)=O Amb25850201 [0,1,0,0,0,0|2,0,1]=4 619 B13R1.133 CC(O)C(=O)Cc1ccc(Br)c[n]1 Amb24556257 [0,1,0,0,0,0|2,0,1]=4 620 B13R1.133 CC(O)C(=O)Cc1ccc(F)cc1 Amb25848911 [0,1,0,0,0,0|1,0,1]=3 621 B13R1.133 CC(O)C(=O)Cc1ccc(I)cc1 Amb25066618 [0,1,0,0,0,0|1,0,1]=3 622 B13R1.133 CC(Sc1ccc(N)cc1)C(O)=O Amb18975670 [0,1,0,0,0,0|2,0,1]=4 623 B13R1.133 CC(Sc1ccc(O)cc1)C(O)=O Amb19000448 [0,1,0,0,0,0|2,0,1]=4 624 B13R1.133 CN(C(=O)C)Cc1ccc(cc1)Cl Amb11014188 [0,1,0,0,0,0|3,0,0]=4 625 B13R1.133 CN(C(=O)Cc1ccc(cc1)N)C Amb1131914 [0,1,0,0,0,0|3,0,0]=4 626 B13R1.133 CN(C(=O)Cc1ccc(cc1)O)C Amb10068674 [0,1,0,0,0,0|3,0,0]=4 627 B13R1.133 CN(C(=O)Nc1ccc(cc1)Cl)O Amb2416133 [0,1,0,0,0,0|3,0,0]=4 628 B13R1.133 CN(C)C(=O)Cc1ccc(I)cc1 Amb24676259 [0,1,0,0,0,0|3,0,0]=4 629 B13R1.133 CN(C)C(=O)Cc1ccc(S)cc1 Amb25101701 [0,1,0,0,0,0|3,0,0]=4 630 B13R1.133 CN(Cc1ccc(Br)cc1)C(=O)Cl Amb25081828 [0,1,0,0,0,0|3,0,0]=4 631 B13R1.133 CN(Cc1ccc(Br)cc1)C(N)=O Amb25731768 [0,1,0,0,0,0|3,0,0]=4 632 B13R1.133 CN(Cc1ccc(Cl)cc1)C(N)=O Amb18332178 [0,1,0,0,0,0|3,0,0]=4 633 B13R1.133 CN(Cc1ccc(F)cc1)C(N)=O Amb18187073 [0,1,0,0,0,0|3,0,0]=4 634 B13R1.133 CN(Cc1ccc(O)cc1)C(N)=O Amb18796233 [0,1,0,0,0,0|3,0,0]=4 635 B13R1.133 CN(N)C(=O)Cc1ccc(F)cc1 Amb25267853 [0,1,0,0,0,0|3,0,0]=4 636 B13R1.133 CN(O)C(=O)Cc1ccc(N)c[n]1 Amb25339527 [0,1,0,0,0,0|3,0,0]=4 637 B13R1.133 CN(O)C(=O)Cc1ccc(N)cc1 Amb24654879 [0,1,0,0,0,0|2,0,0]=3 638 B13R1.133 C[C@@H](C(=O)O)Cc1ccc(cc1)C Amb10844190 [0,1,0,0,0,0|1,0,1]=3 639 B13R1.133 C[C@@H](C(=O)O)Cc1ccc(cc1)N Amb10844177 [0,1,0,0,0,0|1,0,1]=3 640 B13R1.133 C[C@@H](Nc1ccc(Cl)cc1)C(O)=O Amb24626586 [0,1,0,0,0,0|2,0,1]=4 641 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(Br)cc1 Amb24371942 [0,1,0,0,0,0|2,0,1]=4 642 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(Cl)cc1 Amb24412863 [0,1,0,0,0,0|2,0,1]=4 643 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(F)cc1 Amb25829779 [0,1,0,0,0,0|2,0,1]=4 644 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(I)cc1 Amb25818032 [0,1,0,0,0,0|2,0,1]=4 645 B13R1.133 C[C@@H](O)C(=O)Nc1ccc(O)cc1 Amb25296984 [0,1,0,0,0,0|2,0,1]=4 646 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(Br)cc1 Amb25749588 [0,1,0,0,0,0|2,0,1]=4 647 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(Cl)cc1 Amb25749589 [0,1,0,0,0,0|2,0,1]=4 648 B13R1.133 C[C@@H](O)C(=O)Oc1ccc(I)cc1 Amb25847716 [0,1,0,0,0,0|2,0,1]=4 649 B13R1.133 C[C@@H](Oc1ccc(Br)cc1)C(O)=O Amb25682170 [0,1,0,0,0,0|2,0,1]=4 650 B13R1.133 C[C@@H](Oc1ccc(I)cc1)C(O)=O Amb25180277 [0,1,0,0,0,0|2,0,1]=4 651 B13R1.133 C[C@H](C(=O)O)Cc1ccc(cc1)Br Amb10844183 [0,1,0,0,0,0|1,0,1]=3 652 B13R1.133 C[C@H](C(=O)O)Cc1ccc(cc1)C Amb10844191 [0,1,0,0,0,0|1,0,1]=3 653 B13R1.133 C[C@H](C(=O)O)Cc1ccc(cc1)Cl Amb10844184 [0,1,0,0,0,0|1,0,1]=3 654 B13R1.133 C[C@H](Nc1ccc(F)cc1)C(O)=O Amb24375534 [0,1,0,0,0,0|2,0,1]=4 655 B13R1.133 C[C@H](Nc1ccc(O)cc1)C(O)=O Amb25111168 [0,1,0,0,0,0|2,0,1]=4 656 B13R1.133 C[C@H](O)C(=O)Nc1ccc(F)cc1 Amb25307302 [0,1,0,0,0,0|2,0,1]=4 657 B13R1.133 C[C@H](O)C(=O)Oc1ccc(Br)cc1 Amb24613750 [0,1,0,0,0,0|2,0,1]=4 658 B13R1.133 C[C@H](O)C(=O)Oc1ccc(Cl)cc1 Amb25032716 [0,1,0,0,0,0|2,0,1]=4 659 B13R1.133 C[C@H](Oc1ccc(Br)cc1)C(O)=O Amb24471254 [0,1,0,0,0,0|2,0,1]=4 660 B13R1.133 C[C@H](Oc1ccc(F)cc1)C(O)=O Amb25059199 [0,1,0,0,0,0|2,0,1]=4 661 B13R1.133 C[C@H](Oc1ccc(I)cc1)C(O)=O Amb24623054 [0,1,0,0,0,0|2,0,1]=4 662 B13R1.133 C[C@H](Sc1ccc(F)cc1)C(O)=O Amb25160934 [0,1,0,0,0,0|2,0,1]=4 663 B13R1.133 C\C(=C/c1ccc(Br)cc1)\C(O)=O Amb25696415 [0,1,0,0,0,0|1,0,1]=3 664 B13R1.133 C\C(=C/c1ccc(F)cc1)\C(C)=O Amb25130578 [0,1,0,0,0,0|2,0,1]=4 665 B13R1.133 C\C(=C/c1ccc(I)cc1)\C(C)=O Amb24595205 [0,1,0,0,0,0|2,0,1]=4 666 B13R1.133 C\C(=C/c1ccc(N)[n]c1)\C(O)=O Amb24635725 [0,1,0,0,0,0|2,0,1]=4 667 B13R1.133 C\C(=C/c1ccc(O)cc1)\C(C)=O Amb24349357 [0,1,0,0,0,0|2,0,1]=4 668 B13R1.133 C\C(=C/c1ccc(O)cc1)\C(O)=O Amb18128066 [0,1,0,0,0,0|1,0,1]=3 669 B13R1.133 C\C(=C\c1ccc(F)cc1)\C(N)=O Amb24371786 [0,1,0,0,0,0|2,0,1]=4 670 B13R1.133 C\C(=C\c1ccc(F)cc1)\C(O)=O Amb25774175 [0,1,0,0,0,0|1,0,1]=3 671 B13R1.133 C\C(=C\c1ccc(S)cc1)\C(O)=O Amb25210469 [0,1,0,0,0,0|1,0,1]=3 672 B13R1.133 C\C(=N/c1ccc(F)cc1)\C(C)=O Amb24612673 [0,1,0,0,0,0|3,0,0]=4 673 B13R1.133 Cc1[n]cc(c[n]1)NC(=O)C(O)=O Amb25173053 [0,1,0,0,0,0|3,0,0]=4 674 B13R1.133 Cc1c[n]c(CC(=O)C(O)=O)cc1 Amb25710761 [0,1,0,0,0,0|1,0,0]=2 675 B13R1.133 Cc1ccc(CC(=C)C(O)=O)cc1 Amb18127720 [0,1,0,0,0,0|1,0,0]=2 676 B13R1.133 Cc1ccc(CC(=O)C(C)N)cc1 Amb18195845 [0,1,0,0,0,0|2,0,1]=4 677 B13R1.133 Cc1ccc(CC(=O)C(F)F)cc1 Amb18322779 [0,1,0,0,0,0|2,0,1]=4 678 B13R1.133 Cc1ccc(CC(Br)C(C)=O)cc1 Amb25190028 [0,1,0,0,0,0|2,0,1]=4 679 B13R1.133 Cc1ccc(CC(Br)C(N)=O)cc1 Amb24707261 [0,1,0,0,0,0|2,0,1]=4 680 B13R1.133 Cc1ccc(CC(Br)C(O)=O)cc1 Amb23320603 [0,1,0,0,0,0|1,0,1]=3 681 B13R1.133 Cc1ccc(CC(C)C(N)=O)cc1 Amb24433862 [0,1,0,0,0,0|2,0,1]=4 682 B13R1.133 Cc1ccc(CC(C)C(O)=O)[n]c1 Amb25335020 [0,1,0,0,0,0|2,0,1]=4 683 B13R1.133 Cc1ccc(CC(F)C(O)=O)[n]c1 Amb25835507 [0,1,0,0,0,0|2,0,1]=4 684 B13R1.133 Cc1ccc(CC(N)C(O)=O)c[n]1 Amb18193897 [0,1,0,0,0,0|2,0,1]=4 685 B13R1.133 Cc1ccc(CC(S)C(O)=O)[n]c1 Amb25704582 [0,1,0,0,0,0|1,1,1]=4 686 B13R1.133 Cc1ccc(CC(S)C(O)=O)c[n]1 Amb25153708 [0,1,0,0,0,0|1,1,1]=4 687 B13R1.133 Cc1ccc(CN(C)C(=O)Cl)cc1 Amb24428310 [0,1,0,0,0,0|3,0,0]=4 688 B13R1.133 Cc1ccc(CN(Cl)C(C)=O)cc1 Amb22479407 [0,1,0,0,0,0|3,0,0]=4 689 B13R1.133 Cc1ccc(C[C@@H](N)C(N)=O)cc1 Amb24488823 [0,1,0,0,0,0|2,0,1]=4 690 B13R1.133 Cc1ccc(C[C@@H](N)C(O)=O)[n]c1 Amb25160624 [0,1,0,0,0,0|2,0,1]=4 691 B13R1.133 Cc1ccc(C[C@@H](N)C(O)=O)c[n]1 Amb25836372 [0,1,0,0,0,0|2,0,1]=4 692 B13R1.133 Cc1ccc(C[C@@H](O)C(O)=O)cc1 Amb25858127 [0,1,0,0,0,0|0,0,2]=3 693 B13R1.133 Cc1ccc(C[C@H](C)C(C)=O)cc1 Amb24492516 [0,1,0,0,0,0|2,0,1]=4 694 B13R1.133 Cc1ccc(C[C@H](Cl)C(O)=O)cc1 Amb25274067 [0,1,0,0,0,0|1,0,1]=3 695 B13R1.133 Cc1ccc(C[C@H](N)C(N)=O)cc1 Amb24489140 [0,1,0,0,0,0|2,0,1]=4 696 B13R1.133 Cc1ccc(\C=C(/C)\C(C)=O)cc1 Amb25792987 [0,1,0,0,0,0|2,0,1]=4 697 B13R1.133 Cc1ccc(\C=C(/F)\C(C)=O)cc1 Amb24553560 [0,1,0,0,0,0|2,0,1]=4 698 B13R1.133 Cc1ccc(\C=C(/F)\C(O)=O)cc1 Amb18128596 [0,1,0,0,0,0|1,0,1]=3 699 B13R1.133 Cc1ccc(\C=C(/S)\C(O)=O)cc1 Amb18130091 [0,1,0,0,0,0|0,1,1]=3 700 B13R1.133 Cc1ccc(\C=C(\C)/C(O)=O)cc1 Amb25096128 [0,1,0,0,0,0|1,0,1]=3 701 B13R1.133 Cc1ccc(\C=C(\Cl)/C(O)=O)cc1 Amb25321952 [0,1,0,0,0,0|1,0,1]=3 702 B13R1.133 Cc1ccc(\C=C(\F)/C(O)=O)c[n]1 Amb25800275 [0,1,0,0,0,0|2,0,1]=4 703 B13R1.133 Cc1ccc(\C=C(\F)/C(O)=O)cc1 Amb24732322 [0,1,0,0,0,0|1,0,1]=3 704 B13R1.133 Cc1ccc(c[n]1)NC(=O)C(N)=O Amb24408086 [0,1,0,0,0,0|3,0,0]=4 705 B13R1.133 Cc1ccc(cc1)NC(=N)C(O)=O Amb25362238 [0,1,0,0,0,0|2,0,0]=3 706 B13R1.133 Cc1ccc(cc1)NC(=N)S(O)=O Amb25771739 [0,1,0,0,0,0|3,0,0]=4 707 B13R1.133 Cc1ccc(cc1)NC(=O)C(=C)C Amb2410051 [0,1,0,0,0,0|3,0,0]=4 708 B13R1.133 Cc1ccc(cc1)NC(=O)C(=C)Cl Amb22460375 [0,1,0,0,0,0|3,0,0]=4 709 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)C Amb17400600 [0,1,0,0,0,0|2,0,0]=3 710 B13R1.133 Cc1ccc(cc1)NC(=O)C(=O)Cl Amb24490127 [0,1,0,0,0,0|2,0,0]=3 711 B13R1.133 Cc1ccc(cc1)NC(=O)[C@H](C)O Amb24490412 [0,1,0,0,0,0|2,0,1]=4 712 B13R1.133 Cc1ccc(cc1)NC(=S)C(C)=O Amb21949011 [0,1,0,0,0,0|2,1,0]=4 713 B13R1.133 Cc1ccc(cc1)NC(=S)C(O)=O Amb25320885 [0,1,0,0,0,0|1,1,0]=3 714 B13R1.133 Cc1ccc(cc1)OC(=O)C(O)=O Amb24652452 [0,1,0,0,0,0|1,0,0]=2 715 B13R1.133 Cc1ccc(cc1)OC(=O)[C@@H](C)O Amb25706037 [0,1,0,0,0,0|2,0,1]=4 716 B13R1.133 Cc1ccc(cc1)O[C@@H](C)C(O)=O Amb24355314 [0,1,0,0,0,0|2,0,1]=4 717 B13R1.133 Cc1ccc(cc1)O[C@H](C)C(O)=O Amb25685384 [0,1,0,0,0,0|2,0,1]=4 718 B13R1.133 Cc1ccc(cc1)SC(Cl)C(O)=O Amb25770525 [0,1,0,0,0,0|2,0,1]=4 719 B13R1.133 Cc1ccc(cc1)SC(F)C(O)=O Amb24713978 [0,1,0,0,0,0|2,0,1]=4 720 B13R1.133 Cc1ccc(cc1)S[C@@H](C)C(O)=O Amb24375761 [0,1,0,0,0,0|2,0,1]=4 721 B13R1.133 Cc1ccc(cc1)\N=C(/C)\C(C)=O Amb24512423 [0,1,0,0,0,0|3,0,0]=4 722 B13R1.133 Cc1ccc(cc1)\N=C(/C)\C(O)=O Amb24739492 [0,1,0,0,0,0|2,0,0]=3 723 B13R1.133 ClC(=O)C(Cc1ccc(cc1)Cl)Cl Amb17204629 [0,1,0,0,0,0|2,0,1]=4 724 B13R1.133 ClC(C(=O)C)Cc1ccc(cc1)Br Amb17204823 [0,1,0,0,0,0|2,0,1]=4 725 B13R1.133 ClC(C(=O)C)Cc1ccc(cc1)F Amb17204390 [0,1,0,0,0,0|2,0,1]=4 726 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)Br Amb17204830 [0,1,0,0,0,0|2,0,1]=4 727 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)C Amb17204373 [0,1,0,0,0,0|2,0,1]=4 728 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)Cl Amb17204475 [0,1,0,0,0,0|2,0,1]=4 729 B13R1.133 ClC(C(=O)N)Cc1ccc(cc1)F Amb17204395 [0,1,0,0,0,0|2,0,1]=4 730 B13R1.133 ClC(C(=O)O)Cc1ccc(cc1)C Amb17204376 [0,1,0,0,0,0|1,0,1]=3 731 B13R1.133 ClC(C(=O)O)Cc1ccc(cc1)Cl Amb17204492 [0,1,0,0,0,0|1,0,1]=3 732 B13R1.133 ClC(C(=O)O)Cc1ccc(cc1)F Amb17204398 [0,1,0,0,0,0|1,0,1]=3 733 B13R1.133 Clc1ccc(cc1)NC(=O)C(=C)Cl Amb2444521 [0,1,0,0,0,0|3,0,0]=4 734 B13R1.133 Clc1ccc(nc1)NC(=O)C(=O)N Amb10972909 [0,1,0,0,0,0|3,0,0]=4 735 B13R1.133 NC(=O)C(=O)Nc1ccc(Br)[n]c1 Amb25822058 [0,1,0,0,0,0|3,0,0]=4 736 B13R1.133 NC(=O)C(=O)Nc1ccc(Br)cc1 Amb25675441 [0,1,0,0,0,0|2,0,0]=3 737 B13R1.133 NC(=O)C(=O)Nc1ccc(Cl)[n]c1 Amb24685957 [0,1,0,0,0,0|3,0,0]=4 738 B13R1.133 NC(=O)C(=O)Nc1ccc(F)c[n]1 Amb24406484 [0,1,0,0,0,0|3,0,0]=4 739 B13R1.133 NC(=O)C(=O)Nc1ccc(N)cc1 Amb25138677 [0,1,0,0,0,0|2,0,0]=3 740 B13R1.133 NC(=O)C(=O)Nc1ccc(O)cc1 Amb18128559 [0,1,0,0,0,0|2,0,0]=3 741 B13R1.133 NC(=O)C(=S)Nc1ccc(F)cc1 Amb24533298 [0,1,0,0,0,0|2,1,0]=4 742 B13R1.133 NC(=O)C(Br)Cc1ccc(Br)cc1 Amb24378735 [0,1,0,0,0,0|2,0,1]=4 743 B13R1.133 NC(=O)C(Br)Cc1ccc(F)cc1 Amb25774251 [0,1,0,0,0,0|2,0,1]=4 744 B13R1.133 NC(=O)C(N)Cc1ccc(Cl)cc1 Amb18130578 [0,1,0,0,0,0|2,0,1]=4 745 B13R1.133 NC(=O)C(N)Cc1ccc(F)cc1 Amb18129023 [0,1,0,0,0,0|2,0,1]=4 746 B13R1.133 NC(=O)C(N)Cc1ccc(O)cc1 Amb18972786 [0,1,0,0,0,0|2,0,1]=4 747 B13R1.133 NC(=O)C(O)Cc1ccc(Cl)cc1 Amb25274037 [0,1,0,0,0,0|1,0,2]=4 748 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb24622174 [0,1,0,0,0,0|2,0,1]=4 749 B13R1.133 NC(=O)[C@@H](N)Cc1ccc(O)cc1 Amb22745198 [0,1,0,0,0,0|2,0,1]=4 750 B13R1.133 NC(=O)[C@H](N)Cc1ccc(O)cc1 Amb22432215 [0,1,0,0,0,0|2,0,1]=4 751 B13R1.133 NC(C(=O)O)Cc1cc[n+](cc1)[O-] Amb17594678 [0,1,0,0,0,0|2,0,1]=4 752 B13R1.133 NC(C(=O)O)Cc1ccc(cc1)Cl Amb1077887 [0,1,0,0,0,0|1,0,1]=3 753 B13R1.133 NC(CC=1C=CC(=O)NC1)C(O)=O Amb24649985 [0,1,0,0,0,0|2,0,1]=4 754 B13R1.133 NC(CN1C=CC(=O)C=C1)C(O)=O Amb24710070 [0,1,0,0,0,0|2,0,1]=4 755 B13R1.133 NC(Cc1ccc(Br)cc1)C(O)=O Amb22490717 [0,1,0,0,0,0|1,0,1]=3 756 B13R1.133 NC(Cc1ccc(Cl)[n]c1)C(O)=O Amb25282233 [0,1,0,0,0,0|2,0,1]=4 757 B13R1.133 NC(Cc1ccc(F)[n]c1)C(O)=O Amb24351607 [0,1,0,0,0,0|2,0,1]=4 758 B13R1.133 NC(Cc1ccc(F)c[n]1)C(O)=O Amb25843769 [0,1,0,0,0,0|2,0,1]=4 759 B13R1.133 NC(Cc1ccc(F)cc1)C(O)=O Amb20246818 [0,1,0,0,0,0|1,0,1]=3 760 B13R1.133 NC(Cc1ccc(O)cc1)C(=O)Cl Amb25054004 [0,1,0,0,0,0|2,0,1]=4 761 B13R1.133 NC(Cc1ccc(O)cc1)C(O)=O Amb22352126 [0,1,0,0,0,0|1,0,1]=3 762 B13R1.133 NC(Cc1ccc(O)cc1)C(O)=O Amb22730237 [0,1,0,0,0,0|1,0,1]=3 763 B13R1.133 NC(Cc1ccc(O)cc1)C([O-])=O Amb23567002 [0,1,0,0,0,0|1,0,2]=4 764 B13R1.133 NC(Cc1ccc(O)cc1)P(O)=O Amb25315232 [0,1,0,0,0,0|2,0,1]=4 765 B13R1.133 NC(Cc1ccc(O)cc1)[13C](O)=O Amb22367400 [0,1,0,0,0,0|1,0,1]=3 766 B13R1.133 NC([13CH2]c1ccc(O)cc1)C(O)=O Amb22338815 [0,1,0,0,0,0|1,0,1]=3 767 B13R1.133 N[13CH](Cc1ccc(O)cc1)C(O)=O Amb22367333 [0,1,0,0,0,0|1,0,1]=3 768 B13R1.133 N[14C@@H]([14CH2][14c]1[14cH][14cH][14c](O)[14cH][14cH]1)[14C](O)=O Amb22350206 [0,1,0,0,0,0|1,0,1]=3 769 B13R1.133 N[C@@H](C(=O)N)Cc1ccc(cc1)O Amb16183978 [0,1,0,0,0,0|2,0,1]=4 770 B13R1.133 N[C@@H](CC=1C=CC(=O)NC1)C(O)=O Amb25109157 [0,1,0,0,0,0|2,0,1]=4 771 B13R1.133 N[C@@H](Cc1cc[13c](O)cc1)C(O)=O Amb22367297 [0,1,0,0,0,0|1,0,1]=3 772 B13R1.133 N[C@@H](Cc1cc[n+]([O-])cc1)C(O)=O Amb24565918 [0,1,0,0,0,0|2,0,1]=4 773 B13R1.133 N[C@@H](Cc1ccc(Br)[n]c1)C(O)=O Amb25154880 [0,1,0,0,0,0|2,0,1]=4 774 B13R1.133 N[C@@H](Cc1ccc(Br)c[n]1)C(O)=O Amb25364955 [0,1,0,0,0,0|2,0,1]=4 775 B13R1.133 N[C@@H](Cc1ccc(Br)cc1)C(O)=O Amb19930758 [0,1,0,0,0,0|1,0,1]=3 776 B13R1.133 N[C@@H](Cc1ccc(Cl)cc1)C(O)=O Amb19930410 [0,1,0,0,0,0|1,0,1]=3 777 B13R1.133 N[C@@H](Cc1ccc(F)[n]c1)C(O)=O Amb25858507 [0,1,0,0,0,0|2,0,1]=4 778 B13R1.133 N[C@@H](Cc1ccc(F)c[n]1)C(O)=O Amb25330341 [0,1,0,0,0,0|2,0,1]=4 779 B13R1.133 N[C@@H](Cc1ccc(I)c[n]1)C(O)=O Amb25238691 [0,1,0,0,0,0|2,0,1]=4 780 B13R1.133 N[C@@H](Cc1ccc(I)cc1)C(O)=O Amb22801217 [0,1,0,0,0,0|1,0,1]=3 781 B13R1.133 N[C@@H](Cc1ccc(O)cc1)C(O)=O Amb22351112 [0,1,0,0,0,0|1,0,1]=3 782 B13R1.133 N[C@@H](Cc1ccc(O)cc1)[13C](O)=O Amb22351670 [0,1,0,0,0,0|1,0,1]=3 783 B13R1.133 N[C@@H](Cc1ccc(S)cc1)C(O)=O Amb24446740 [0,1,0,0,0,0|1,0,1]=3 784 B13R1.133 N[C@@H](Cc1ccc([17OH])cc1)C(O)=O Amb22367468 [0,1,0,0,0,0|1,0,1]=3 785 B13R1.133 N[C@@H](Cc1ccc([18OH])cc1)C(O)=O Amb22353627 [0,1,0,0,0,0|1,0,1]=3 786 B13R1.133 N[C@@H]([13CH2]c1ccc(O)cc1)C(O)=O Amb22336665 [0,1,0,0,0,0|1,0,1]=3 787 B13R1.133 N[C@H](Cc1ccc(Br)c[n]1)C(O)=O Amb25278417 [0,1,0,0,0,0|2,0,1]=4 788 B13R1.133 N[C@H](Cc1ccc(Br)cc1)C(O)=O Amb20241889 [0,1,0,0,0,0|1,0,1]=3 789 B13R1.133 N[C@H](Cc1ccc(F)[n]c1)C(O)=O Amb24680870 [0,1,0,0,0,0|2,0,1]=4 790 B13R1.133 N[C@H](Cc1ccc(I)cc1)C(O)=O Amb20240664 [0,1,0,0,0,0|1,0,1]=3 791 B13R1.133 N[C@H](Cc1ccc(S)cc1)C(O)=O Amb24599881 [0,1,0,0,0,0|1,0,1]=3 792 B13R1.133 Nc1ccc(CC(=O)C(O)=O)cc1 Amb24433983 [0,1,0,0,0,0|0,0,0]=1 793 B13R1.133 Nc1ccc(CC(N)C(O)=O)[n]c1 Amb25187967 [0,1,0,0,0,0|2,0,1]=4 794 B13R1.133 Nc1ccc(CC(N)C(O)=O)c[n]1 Amb24533892 [0,1,0,0,0,0|2,0,1]=4 795 B13R1.133 Nc1ccc(CC(N)C(O)=O)cc1 Amb24079001 [0,1,0,0,0,0|1,0,1]=3 796 B13R1.133 Nc1ccc(CC(O)C(O)=O)cc1 Amb24635658 [0,1,0,0,0,0|0,0,2]=3 797 B13R1.133 Nc1ccc(C[C@@H](N)C(O)=O)c[n]1 Amb25039381 [0,1,0,0,0,0|2,0,1]=4 798 B13R1.133 Nc1ccc(C[C@@H](N)C(O)=O)cc1 Amb19130487 [0,1,0,0,0,0|1,0,1]=3 799 B13R1.133 Nc1ccc(C[C@H](N)C(O)=O)[n]c1 Amb24346938 [0,1,0,0,0,0|2,0,1]=4 800 B13R1.133 Nc1ccc(C[C@H](N)C(O)=O)cc1 Amb20242456 [0,1,0,0,0,0|1,0,1]=3 801 B13R1.133 Nc1ccc(\C=C(/F)\C(O)=O)cc1 Amb25274936 [0,1,0,0,0,0|1,0,1]=3 802 B13R1.133 Nc1ccc(\C=C(\Cl)/C(O)=O)cc1 Amb24408981 [0,1,0,0,0,0|1,0,1]=3 803 B13R1.133 Nc1ccc(cc1)SC(F)C(O)=O Amb25044594 [0,1,0,0,0,0|2,0,1]=4 804 B13R1.133 O=C(C(=C)C)Nc1ccc(cc1)Cl Amb2406800 [0,1,0,0,0,0|3,0,0]=4 805 B13R1.133 O=C(C(=O)C)Nc1ccc(cc1)Br Amb2383840 [0,1,0,0,0,0|2,0,0]=3 806 B13R1.133 O=C(C(=O)C)Nc1ccc(cc1)Cl Amb2421104 [0,1,0,0,0,0|2,0,0]=3 807 B13R1.133 O=C(C(=O)C)Nc1ccc(cc1)F Amb17400856 [0,1,0,0,0,0|2,0,0]=3 808 B13R1.133 O=C(C(=O)N)Nc1ccc(cc1)Cl Amb1831097 [0,1,0,0,0,0|2,0,0]=3 809 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Br Amb1140012 [0,1,0,0,0,0|0,0,0]=1 810 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)C Amb1140634 [0,1,0,0,0,0|0,0,0]=1 811 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)Cl Amb1141688 [0,1,0,0,0,0|0,0,0]=1 812 B13R1.133 O=C(C(=O)O)Cc1ccc(cc1)F Amb1130482 [0,1,0,0,0,0|0,0,0]=1 813 B13R1.133 O=C(C(=O)O)Nc1ccc(cc1)Cl Amb2371148 [0,1,0,0,0,0|1,0,0]=2 814 B13R1.133 O=C(C(=O)O)Nc1ccc(cc1)N Amb1348301 [0,1,0,0,0,0|1,0,0]=2 815 B13R1.133 O=C(C(C)C)Cc1ccc(cc1)C Amb17138782 [0,1,0,0,0,0|2,0,1]=4 816 B13R1.133 O=C(C(O)C)Nc1ccc(cc1)C Amb17400712 [0,1,0,0,0,0|2,0,1]=4 817 B13R1.133 O=C(Cc1ccc(Cl)cc1)C(F)F Amb24394088 [0,1,0,0,0,0|2,0,1]=4 818 B13R1.133 O=C(Cc1ccc(F)cc1)C(F)F Amb19059630 [0,1,0,0,0,0|2,0,1]=4 819 B13R1.133 O=C(Cl)C(=O)Nc1ccc(Cl)cc1 Amb25365147 [0,1,0,0,0,0|2,0,0]=3 820 B13R1.133 O=C(Cl)[C@H](Cl)Cc1ccc(Cl)cc1 Amb24449993 [0,1,0,0,0,0|2,0,1]=4 821 B13R1.133 OC(=O)C(=O)Cc1ccc(Br)c[n]1 Amb25091452 [0,1,0,0,0,0|1,0,0]=2 822 B13R1.133 OC(=O)C(=O)NC1=CNC(=O)C=C1 Amb25343097 [0,1,0,0,0,0|2,0,0]=3 823 B13R1.133 OC(=O)C(=O)NC=1C=CC(=O)NN1 Amb24716485 [0,1,0,0,0,0|3,0,0]=4 824 B13R1.133 OC(=O)C(=O)Nc1c[n]c(Br)c[n]1 Amb24724376 [0,1,0,0,0,0|3,0,0]=4 825 B13R1.133 OC(=O)C(=O)Nc1ccc(Cl)[n]c1 Amb25063135 [0,1,0,0,0,0|2,0,0]=3 826 B13R1.133 OC(=O)C(=S)Cc1ccc(Cl)cc1 Amb25827120 [0,1,0,0,0,0|0,1,0]=2 827 B13R1.133 OC(=O)C(=S)Nc1ccc(Cl)cc1 Amb25366124 [0,1,0,0,0,0|1,1,0]=3 828 B13R1.133 OC(=O)C(Br)Cc1ccc(Br)cc1 Amb23320621 [0,1,0,0,0,0|1,0,1]=3 829 B13R1.133 OC(=O)C(Br)Cc1ccc(Cl)cc1 Amb23320619 [0,1,0,0,0,0|1,0,1]=3 830 B13R1.133 OC(=O)C(Br)Cc1ccc(I)cc1 Amb23320622 [0,1,0,0,0,0|1,0,1]=3 831 B13R1.133 OC(=O)C(Cl)CN1C=CC(=O)C=C1 Amb25786958 [0,1,0,0,0,0|2,0,1]=4 832 B13R1.133 OC(=O)C(F)Cc1ccc(Br)c[n]1 Amb25248529 [0,1,0,0,0,0|2,0,1]=4 833 B13R1.133 OC(=O)C(F)Cc1ccc(Cl)cc1 Amb24450256 [0,1,0,0,0,0|1,0,1]=3 834 B13R1.133 OC(=O)C(F)Oc1ccc(Cl)cc1 Amb25679289 [0,1,0,0,0,0|2,0,1]=4 835 B13R1.133 OC(=O)C(O)Cc1ccc(Br)c[n]1 Amb24410790 [0,1,0,0,0,0|1,0,2]=4 836 B13R1.133 OC(=O)C(O)Cc1ccc(I)cc1 Amb25079589 [0,1,0,0,0,0|0,0,2]=3 837 B13R1.133 OC(=O)C(S)Cc1ccc(Cl)cc1 Amb25326151 [0,1,0,0,0,0|0,1,1]=3 838 B13R1.133 OC(=O)[C@@H](O)Cc1ccc(Cl)cc1 Amb25816136 [0,1,0,0,0,0|0,0,2]=3 839 B13R1.133 OC(=O)[C@H](O)Cc1ccc(Cl)cc1 Amb25731054 [0,1,0,0,0,0|0,0,2]=3 840 B13R1.133 OC(=O)\C(\Cl)=C/c1ccc(F)cc1 Amb24598280 [0,1,0,0,0,0|1,0,1]=3 841 B13R1.133 OC(=O)\C(\Cl)=C\c1ccc(Cl)cc1 Amb18658048 [0,1,0,0,0,0|1,0,1]=3 842 B13R1.133 OC(=O)\C(\F)=C\c1ccc(Cl)cc1 Amb25209028 [0,1,0,0,0,0|1,0,1]=3 843 B13R1.133 OC(=O)\C(\F)=C\c1ccc(F)cc1 Amb25858140 [0,1,0,0,0,0|1,0,1]=3 844 B13R1.133 OC(=O)\C(\F)=C\c1ccc(I)cc1 Amb25678331 [0,1,0,0,0,0|1,0,1]=3 845 B13R1.133 OC(=O)\C(\S)=C\c1ccc(I)cc1 Amb24400252 [0,1,0,0,0,0|0,1,1]=3 846 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)Br Amb17159703 [0,1,0,0,0,0|0,0,2]=3 847 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)C Amb17138950 [0,1,0,0,0,0|0,0,2]=3 848 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)Cl Amb17139824 [0,1,0,0,0,0|0,0,2]=3 849 B13R1.133 OC(C(=O)O)Cc1ccc(cc1)F Amb17139080 [0,1,0,0,0,0|0,0,2]=3 850 B13R1.133 O[C@H](Cc1ccc(F)cc1)C(O)=O Amb17935902 [0,1,0,0,0,0|0,0,2]=3 851 B13R1.133 O\C(=C/c1ccc(F)cc1)\C(O)=O Amb22549399 [0,1,0,0,0,0|0,0,2]=3 852 B13R1.133 O\C(=C/c1ccc(cc1)C)\C(=O)O Amb2398421 [0,1,0,0,0,0|0,0,2]=3 853 B13R1.133 Oc1ccc(CC(Br)C(O)=O)cc1 Amb24685050 [0,1,0,0,0,0|1,0,1]=3 854 B13R1.133 Oc1ccc(CC(Cl)C(O)=O)cc1 Amb25192678 [0,1,0,0,0,0|1,0,1]=3 855 B13R1.133 Oc1ccc(CC(F)C(O)=O)cc1 Amb20621279 [0,1,0,0,0,0|1,0,1]=3 856 B13R1.133 Oc1ccc(CC(S)C(O)=O)cc1 Amb24740732 [0,1,0,0,0,0|0,1,1]=3 857 B13R1.133 Oc1ccc(C[C@@H](O)C(O)=O)cc1 Amb22388639 [0,1,0,0,0,0|0,0,2]=3 858 B13R1.133 Oc1ccc(C[C@H](Cl)C(O)=O)cc1 Amb25277185 [0,1,0,0,0,0|1,0,1]=3 859 B13R1.133 Oc1ccc(\C=C(/Cl)\C(O)=O)cc1 Amb25208063 [0,1,0,0,0,0|1,0,1]=3 860 B13R1.133 Oc1ccc(\C=C(/S)\C(O)=O)cc1 Amb24112867 [0,1,0,0,0,0|0,1,1]=3 861 B13R1.133 Oc1ccc(cc1)CC(=O)C(=O)O Amb1124591 [0,1,0,0,0,0|0,0,0]=1 862 B13R1.133 Oc1ccc(cc1)NC(=O)C(=O)Cl Amb25034550 [0,1,0,0,0,0|2,0,0]=3 863 B13R1.133 SC(C(=O)O)Cc1ccc(cc1)C Amb2499266 [0,1,0,0,0,0|0,1,1]=3 864 B13R1.133 S\C(=C/c1ccc(cc1)Br)\C(=O)O Amb1250113 [0,1,0,0,0,0|0,1,1]=3 865 B13R1.133 S\C(=C/c1ccc(cc1)Cl)\C(=O)O Amb1250111 [0,1,0,0,0,0|0,1,1]=3 866 B13R1.133 S\C(=C/c1ccc(cc1)F)\C(=O)O Amb1250112 [0,1,0,0,0,0|0,1,1]=3 867 B13R1.133 S\C(=C\c1ccc(cc1)Cl)\C(=O)O Amb2550970 [0,1,0,0,0,0|0,1,1]=3 868 B13R1.133 [15NH2]C(Cc1ccc(O)cc1)C(O)=O Amb22336215 [0,1,0,0,0,0|1,0,1]=3 869 B13R1.133 [15NH2][13C@@H]([13CH2][13c]1[13cH][13cH][13c](O)[13cH][13cH]1)[13C](O)=O Amb22338916 [0,1,0,0,0,0|1,0,1]=3 870 B13R1.133 [O-]C(=O)[C@H](Cc1ccc(cc1)[O-])N Amb10072562 [0,1,0,0,0,0|1,0,2]=4 871 B13R1.135 BrCC(=O)N(Cc1ccccc1)C Amb17332398 [0,1,0,0,0,0|3,0,0]=4 872 B13R1.135 C#C[C@H](O)C(=O)Cc1ccccc1 Amb24689580 [0,1,0,0,0,0|1,0,1]=3 873 B13R1.135 C=CC(=O)C(Cc1ccccc1)O Amb10562284 [0,1,0,0,0,0|1,0,2]=4 874 B13R1.135 CC(=C=C)C(=O)Cc1ccccc1 Amb24379010 [0,1,0,0,0,0|2,0,0]=3 875 B13R1.135 CC(C#N)C(=O)Cc1ccccc1 Amb24491388 [0,1,0,0,0,0|2,0,1]=4 876 B13R1.135 CC(Cc1ccccc1)C(=O)C#N Amb24492792 [0,1,0,0,0,0|2,0,1]=4 877 B13R1.135 CC(Cc1ccccc1)C(=O)NN Amb24501376 [0,1,0,0,0,0|2,0,1]=4 878 B13R1.135 CC=C(Br)C(=O)Nc1ccccc1 Amb22460381 [0,1,0,0,0,0|3,0,0]=4 879 B13R1.135 CCC(=C)C(=O)Nc1ccccc1 Amb25207052 [0,1,0,0,0,0|3,0,0]=4 880 B13R1.135 CCC(=O)C(=O)Nc1ccccc1 Amb25770102 [0,1,0,0,0,0|2,0,0]=3 881 B13R1.135 CCC(=O)C(Cc1ccccc1)C Amb17233202 [0,1,0,0,0,0|2,0,1]=4 882 B13R1.135 CCC(=O)\C(=C/c1ccccc1)\C Amb10565329 [0,1,0,0,0,0|2,0,1]=4 883 B13R1.135 CCC(=O)\C(\F)=C\c1ccccc1 Amb25706957 [0,1,0,0,0,0|2,0,1]=4 884 B13R1.135 CN(C=O)C(=O)Nc1ccccc1 Amb25857372 [0,1,0,0,0,0|3,0,0]=4 885 B13R1.135 CN(Cc1ccccc1)C(=O)C=O Amb24490334 [0,1,0,0,0,0|2,0,1]=4 886 B13R1.135 CN(Cc1ccccc1)C(=O)CN Amb21958324 [0,1,0,0,0,0|3,0,0]=4 887 B13R1.135 CN(Cc1ccccc1)C(N)=NO Amb18186378 [0,1,0,0,0,0|3,0,0]=4 888 B13R1.135 CN(OC)C(=O)Cc1ccccc1 Amb20673721 [0,1,0,0,0,0|2,0,0]=3 889 B13R1.135 CN(OC)C(=O)Nc1ccccc1 Amb22369280 [0,1,0,0,0,0|3,0,0]=4 890 B13R1.135 CNC(=O)C(=O)Cc1ccccc1 Amb17400596 [0,1,0,0,0,0|1,0,0]=2 891 B13R1.135 CNC(=O)C(=O)Nc1ccccc1 Amb1798389 [0,1,0,0,0,0|2,0,0]=3 892 B13R1.135 CNC(=O)C(Cl)Cc1ccccc1 Amb19083267 [0,1,0,0,0,0|2,0,1]=4 893 B13R1.135 CNC(=O)C(F)Cc1ccccc1 Amb24343289 [0,1,0,0,0,0|2,0,1]=4 894 B13R1.135 CNC(=O)C(N)Cc1ccccc1 Amb21958546 [0,1,0,0,0,0|2,0,1]=4 895 B13R1.135 CNC(=O)[C@@H](C)Cc1ccccc1 Amb25271724 [0,1,0,0,0,0|2,0,1]=4 896 B13R1.135 CNC(=O)[C@@H](Cc1ccccc1)N Amb10608885 [0,1,0,0,0,0|2,0,1]=4 897 B13R1.135 CNC(=O)[C@@H](Cl)Cc1ccccc1 Amb25774522 [0,1,0,0,0,0|2,0,1]=4 898 B13R1.135 CNC(=O)[C@@H](O)Cc1ccccc1 Amb25212856 [0,1,0,0,0,0|1,0,2]=4 899 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb10878601 [0,1,0,0,0,0|2,0,1]=4 900 B13R1.135 CNC(=O)[C@H](Cc1ccccc1)N Amb15740701 [0,1,0,0,0,0|2,0,1]=4 901 B13R1.135 CNC(=O)\C(\S)=C/c1ccccc1 Amb24341194 [0,1,0,0,0,0|1,1,1]=4 902 B13R1.135 CNC(=S)C(=O)Nc1ccccc1 Amb24759766 [0,1,0,0,0,0|2,1,0]=4 903 B13R1.135 COC(=C)C(=O)Nc1ccccc1 Amb25752695 [0,1,0,0,0,0|2,0,0]=3 904 B13R1.135 COC(=O)C(=O)Cc1ccccc1 Amb17138843 [0,1,0,0,0,0|0,0,0]=1 905 B13R1.135 COC(=O)C(=O)Cc1ccccn1 Amb17138896 [0,1,0,0,0,0|1,0,0]=2 906 B13R1.135 COC(=O)C(=O)Cc1cccnc1 Amb17138897 [0,1,0,0,0,0|1,0,0]=2 907 B13R1.135 COC(=O)C(=O)Cc1ccncc1 Amb17138898 [0,1,0,0,0,0|1,0,0]=2 908 B13R1.135 COC(=O)C(=O)Nc1[n]ccc[n]1 Amb25247767 [0,1,0,0,0,0|3,0,0]=4 909 B13R1.135 COC(=O)C(=O)Nc1c[n]c[n]c1 Amb24590051 [0,1,0,0,0,0|3,0,0]=4 910 B13R1.135 COC(=O)C(=O)Nc1c[n]cc[n]1 Amb25121192 [0,1,0,0,0,0|3,0,0]=4 911 B13R1.135 COC(=O)C(=O)Nc1c[n]ccc1 Amb24427786 [0,1,0,0,0,0|2,0,0]=3 912 B13R1.135 COC(=O)C(=O)Nc1ccccc1 Amb24529368 [0,1,0,0,0,0|1,0,0]=2 913 B13R1.135 COC(=O)C(Cc1ccccc1)Cl Amb17204377 [0,1,0,0,0,0|1,0,1]=3 914 B13R1.135 COC(=O)C(Cc1ccccc1)N Amb1779248 [0,1,0,0,0,0|1,0,1]=3 915 B13R1.135 COC(=O)C(Cc1ccccc1)O Amb17138951 [0,1,0,0,0,0|0,0,2]=3 916 B13R1.135 COC(=O)C(Cc1ccccn1)O Amb17138998 [0,1,0,0,0,0|1,0,2]=4 917 B13R1.135 COC(=O)C(Cc1cccnc1)O Amb17138999 [0,1,0,0,0,0|1,0,2]=4 918 B13R1.135 COC(=O)C(Cc1ccncc1)O Amb17139000 [0,1,0,0,0,0|1,0,2]=4 919 B13R1.135 COC(=O)C(N)Cc1ccccc1 Amb22489492 [0,1,0,0,0,0|1,0,1]=3 920 B13R1.135 COC(=O)[C@@H](Cc1cccnc1)N Amb15691971 [0,1,0,0,0,0|2,0,1]=4 921 B13R1.135 COC(=O)[C@@H](N)Cc1ccc[n]c1 Amb22756662 [0,1,0,0,0,0|2,0,1]=4 922 B13R1.135 COC(=O)[C@@H](N)Cc1cccc[n]1 Amb22745828 [0,1,0,0,0,0|2,0,1]=4 923 B13R1.135 COC(=O)[C@H](C)Nc1ccccc1 Amb25732039 [0,1,0,0,0,0|2,0,1]=4 924 B13R1.135 COC(=O)\C(\Br)=C\c1ccccc1 Amb24331619 [0,1,0,0,0,0|1,0,1]=3 925 B13R1.135 COC(=O)\C(\F)=C\c1ccccc1 Amb25706644 [0,1,0,0,0,0|1,0,1]=3 926 B13R1.135 COC(C)C(=O)Nc1ccccc1 Amb24399219 [0,1,0,0,0,0|2,0,1]=4 927 B13R1.135 CON(Cl)C(=O)Nc1ccccc1 Amb24658395 [0,1,0,0,0,0|3,0,0]=4 928 B13R1.135 CO[C@@H](C)C(=O)Nc1ccccc1 Amb24490481 [0,1,0,0,0,0|2,0,1]=4 929 B13R1.135 CO[C@H](C)C(=O)Nc1ccccc1 Amb24728406 [0,1,0,0,0,0|2,0,1]=4 930 B13R1.135 C[C@@H](Cc1ccccc1)C(=O)NO Amb24408073 [0,1,0,0,0,0|1,0,1]=3 931 B13R1.135 C[C@H](Cc1ccccc1)C(=O)C#C Amb24379008 [0,1,0,0,0,0|2,0,1]=4 932 B13R1.135 C[C@H](Cc1ccccc1)C(=O)NO Amb25370073 [0,1,0,0,0,0|1,0,1]=3 933 B13R1.135 C\C(=C/C)\C(=O)Cc1ccccc1 Amb24721728 [0,1,0,0,0,0|2,0,0]=3 934 B13R1.135 C\C(=C/C)\C(=O)Nc1ccccc1 Amb25366214 [0,1,0,0,0,0|3,0,0]=4 935 B13R1.135 C\C(=C/c1ccccc1)\C(=N)NO Amb25827693 [0,1,0,0,0,0|2,0,1]=4 936 B13R1.135 C\C(=C/c1ccccc1)\C(=O)C#C Amb25190525 [0,1,0,0,0,0|2,0,1]=4 937 B13R1.135 C\C(=C/c1ccccc1)\C(=O)CF Amb25134087 [0,1,0,0,0,0|2,0,1]=4 938 B13R1.135 C\C(=C\C)\C(=O)Cc1ccccc1 Amb25245373 [0,1,0,0,0,0|2,0,0]=3 939 B13R1.135 C\C(=C\c1ccccc1)\C(=N)NO Amb24540269 [0,1,0,0,0,0|2,0,1]=4 940 B13R1.135 C\C(=C\c1ccccc1)\C(=O)CF Amb25179639 [0,1,0,0,0,0|2,0,1]=4 941 B13R1.135 C\C(=N/O)\C(=O)Cc1ccccc1 Amb24378518 [0,1,0,0,0,0|1,0,0]=2 942 B13R1.135 C\C(=N\C)\C(=O)Nc1ccccc1 Amb25714546 [0,1,0,0,0,0|3,0,0]=4 943 B13R1.135 C\C(=N\O)\C(=O)Nc1ccccc1 Amb25277221 [0,1,0,0,0,0|2,0,0]=3 944 B13R1.135 C\C(=N\O)\C(Cl)Cc1ccccc1 Amb25101542 [0,1,0,0,0,0|2,0,1]=4 945 B13R1.135 C\C(\C=O)=C(\Cl)/Cc1ccccc1 Amb18130159 [0,1,0,0,0,0|2,0,0]=3 946 B13R1.135 C\C(\CCl)=C(\Cl)/Cc1ccccc1 Amb25202038 [0,1,0,0,0,0|3,0,0]=4 947 B13R1.135 C\C(\Nc1ccccc1)=C(\C)/C=O Amb24617260 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.135 C\C(\Sc1ccccc1)=C(/F)\C=O Amb25116536 [0,1,0,0,0,0|3,0,0]=4 949 B13R1.135 C\C=C(\Br)/C(=O)Nc1ccccc1 Amb22460386 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.135 C\C=C(\Cl)/C(=O)Nc1ccccc1 Amb24462846 [0,1,0,0,0,0|3,0,0]=4 951 B13R1.135 ClCC(=O)C(=O)Nc1ccccc1 Amb1039065 [0,1,0,0,0,0|2,0,0]=3 952 B13R1.135 ClCC(=O)N(Cc1ccccc1)C Amb1204773 [0,1,0,0,0,0|3,0,0]=4 953 B13R1.135 N=C(NO)C(=O)Cc1ccccc1 Amb25059413 [0,1,0,0,0,0|1,0,0]=2 954 B13R1.135 NC(Cc1ccccc1)C(=O)NO Amb22349822 [0,1,0,0,0,0|1,0,1]=3 955 B13R1.135 NNC(=O)C(=O)Nc1ccccc1 Amb2420650 [0,1,0,0,0,0|2,0,0]=3 956 B13R1.135 NNC(=O)C(=O)Nc1ccccn1 Amb10562782 [0,1,0,0,0,0|3,0,0]=4 957 B13R1.135 NNC(=O)C(=S)Nc1ccccc1 Amb25046199 [0,1,0,0,0,0|2,1,0]=4 958 B13R1.135 NNC(=O)C(Cc1ccccc1)N Amb16231875 [0,1,0,0,0,0|2,0,1]=4 959 B13R1.135 NNC(=O)C(O)Cc1ccccc1 Amb25129792 [0,1,0,0,0,0|1,0,2]=4 960 B13R1.135 NNC(=O)C(S)Cc1ccccc1 Amb24501331 [0,1,0,0,0,0|1,1,1]=4 961 B13R1.135 NNC(=O)[C@@H](N)Cc1ccccc1 Amb22800040 [0,1,0,0,0,0|2,0,1]=4 962 B13R1.135 NNC(=S)C(=O)Nc1ccccc1 Amb1085564 [0,1,0,0,0,0|2,1,0]=4 963 B13R1.135 N[C@@H](Cc1ccccc1)C(=O)NO Amb25268143 [0,1,0,0,0,0|1,0,1]=3 964 B13R1.135 N[C@H](Cc1ccccc1)C(=O)CCl Amb20243107 [0,1,0,0,0,0|2,0,1]=4 965 B13R1.135 N\C(=N/O)\C(N)Cc1ccccc1 Amb24519141 [0,1,0,0,0,0|2,0,1]=4 966 B13R1.135 N\C(=N\O)\C(=O)Nc1cccc[n]1 Amb25718687 [0,1,0,0,0,0|3,0,0]=4 967 B13R1.135 N\C(=N\O)\C(=O)Nc1ccccc1 Amb19664169 [0,1,0,0,0,0|2,0,0]=3 968 B13R1.135 O=C(CCl)\C(\F)=C/c1ccccc1 Amb24677586 [0,1,0,0,0,0|2,0,1]=4 969 B13R1.135 O=C(CCl)\C(\F)=C\c1ccccc1 Amb25697164 [0,1,0,0,0,0|2,0,1]=4 970 B13R1.135 O=C(Nc1ccccc1)C(=O)CBr Amb25732064 [0,1,0,0,0,0|2,0,0]=3 971 B13R1.135 O=C(Nc1ccccc1)C(Cl)C=O Amb25765651 [0,1,0,0,0,0|2,0,1]=4 972 B13R1.135 O=C(Nc1ccccc1)\C(\Br)=C\Br Amb22433166 [0,1,0,0,0,0|3,0,0]=4 973 B13R1.135 O=C(Nc1ccccc1)\C(\F)=C/F Amb25190427 [0,1,0,0,0,0|3,0,0]=4 974 B13R1.135 OCC(O)C(=O)Nc1ccccc1 Amb25195876 [0,1,0,0,0,0|1,0,2]=4 975 B13R1.135 ON(Cc1ccccc1)C(=O)CCl Amb25053857 [0,1,0,0,0,0|2,0,1]=4 976 B13R1.135 ONC(=O)C(O)Cc1ccccc1 Amb25752983 [0,1,0,0,0,0|0,0,2]=3 977 B13R1.135 O\C=C(\Cl)/C(=O)Oc1ccccc1 Amb24412896 [0,1,0,0,0,0|2,0,0]=3 978 B13R1.148 Brc1cccc(c1)CC(=O)C(=O)O Amb1137720 [0,1,0,0,0,0|0,0,0]=1 979 B13R1.148 Brc1cccc(c1)NC(=O)C(=O)C Amb17410540 [0,1,0,0,0,0|2,0,0]=3 980 B13R1.148 C=C(Cl)C(=O)Nc1cc(Cl)ccc1 Amb22460396 [0,1,0,0,0,0|3,0,0]=4 981 B13R1.148 C=C(Cl)C(=O)Nc1cccc(F)c1 Amb25352790 [0,1,0,0,0,0|3,0,0]=4 982 B13R1.148 CC(=C)C(=O)Cc1c[n]cc(Br)c1 Amb25366888 [0,1,0,0,0,0|3,0,0]=4 983 B13R1.148 CC(=C)C(=O)Nc1cccc(Cl)c1 Amb22461310 [0,1,0,0,0,0|3,0,0]=4 984 B13R1.148 CC(=C)C(=O)Nc1cccc(F)c1 Amb25216149 [0,1,0,0,0,0|3,0,0]=4 985 B13R1.148 CC(=C)C(=O)Nc1cccc(O)c1 Amb24434891 [0,1,0,0,0,0|3,0,0]=4 986 B13R1.148 CC(=C)C(=O)Oc1cccc(Br)c1 Amb25802008 [0,1,0,0,0,0|3,0,0]=4 987 B13R1.148 CC(=C)C(=O)Oc1cccc(Cl)c1 Amb25159034 [0,1,0,0,0,0|3,0,0]=4 988 B13R1.148 CC(=C)C(=O)Oc1cccc(O)c1 Amb25838787 [0,1,0,0,0,0|3,0,0]=4 989 B13R1.148 CC(=O)C(=O)Cc1cc(C)ccc1 Amb23603621 [0,1,0,0,0,0|1,0,0]=2 990 B13R1.148 CC(=O)C(=O)Cc1cccc(Br)c1 Amb23603630 [0,1,0,0,0,0|1,0,0]=2 991 B13R1.148 CC(=O)C(=O)Cc1cccc(Cl)c1 Amb23603628 [0,1,0,0,0,0|1,0,0]=2 992 B13R1.148 CC(=O)C(=O)Cc1cccc(F)c1 Amb23603623 [0,1,0,0,0,0|1,0,0]=2 993 B13R1.148 CC(=O)C(Br)Cc1cc(Br)ccc1 Amb18601677 [0,1,0,0,0,0|2,0,1]=4 994 B13R1.148 CC(=O)C(Br)Cc1cccc(Cl)c1 Amb18589745 [0,1,0,0,0,0|2,0,1]=4 995 B13R1.148 CC(=O)C(Br)Cc1cccc(I)c1 Amb24466596 [0,1,0,0,0,0|2,0,1]=4 996 B13R1.148 CC(=O)C(Br)Cc1cccc(O)c1 Amb25158741 [0,1,0,0,0,0|2,0,1]=4 997 B13R1.148 CC(=O)C(C)Cc1cccc(F)c1 Amb18796243 [0,1,0,0,0,0|2,0,1]=4 998 B13R1.148 CC(=O)C(Cc1cccc(c1)Br)C Amb17255482 [0,1,0,0,0,0|2,0,1]=4 999 B13R1.148 CC(=O)C(Cc1cccc(c1)Br)Cl Amb17204825 [0,1,0,0,0,0|2,0,1]=4 1000 B13R1.148 CC(=O)C(Cc1cccc(c1)C)Br Amb17507803 [0,1,0,0,0,0|2,0,1]=4 1001 B13R1.148 CC(=O)C(Cc1cccc(c1)C)C Amb17233204 [0,1,0,0,0,0|2,0,1]=4 1002 B13R1.148 CC(=O)C(Cc1cccc(c1)C)Cl Amb17204369 [0,1,0,0,0,0|2,0,1]=4 1003 B13R1.148 CC(=O)C(Cc1cccc(c1)Cl)C Amb17236508 [0,1,0,0,0,0|2,0,1]=4 1004 B13R1.148 CC(=O)C(Cc1cccc(c1)F)Cl Amb17204391 [0,1,0,0,0,0|2,0,1]=4 1005 B13R1.148 CC(=O)C(Cl)Cc1cccc(O)c1 Amb25331957 [0,1,0,0,0,0|2,0,1]=4 1006 B13R1.148 CC(=O)C(N)Cc1cccc(Br)c1 Amb18156180 [0,1,0,0,0,0|2,0,1]=4 1007 B13R1.148 CC(=O)N(C)Cc1cccc(F)c1 Amb24072193 [0,1,0,0,0,0|3,0,0]=4 1008 B13R1.148 CC(=O)N(C)Cc1cccc(O)c1 Amb25318056 [0,1,0,0,0,0|3,0,0]=4 1009 B13R1.148 CC(C)C(=O)Cc1cccc(N)c1 Amb24618101 [0,1,0,0,0,0|2,0,1]=4 1010 B13R1.148 CC(Cc1c[n]cc(Br)c1)C(O)=O Amb25821532 [0,1,0,0,0,0|2,0,1]=4 1011 B13R1.148 CC(Cc1c[n]cc(F)c1)C(O)=O Amb25782318 [0,1,0,0,0,0|2,0,1]=4 1012 B13R1.148 CC(Cc1cccc(Br)c1)C(=O)Cl Amb25828945 [0,1,0,0,0,0|2,0,1]=4 1013 B13R1.148 CC(Cc1cccc(N)c1)C(O)=O Amb24693893 [0,1,0,0,0,0|1,0,1]=3 1014 B13R1.148 CC(Cl)C(=O)Cc1cc(Cl)ccc1 Amb24534615 [0,1,0,0,0,0|2,0,1]=4 1015 B13R1.148 CC(N)C(=O)Cc1cccc(Br)c1 Amb18727292 [0,1,0,0,0,0|2,0,1]=4 1016 B13R1.148 CC(N)C(=O)Cc1cccc(Cl)c1 Amb18188149 [0,1,0,0,0,0|2,0,1]=4 1017 B13R1.148 CC(N)C(=O)Cc1cccc(F)c1 Amb18193154 [0,1,0,0,0,0|2,0,1]=4 1018 B13R1.148 CC(N)C(=O)Cc1cccc(O)c1 Amb24673789 [0,1,0,0,0,0|2,0,1]=4 1019 B13R1.148 CC(Nc1cc(O)ccc1)C(O)=O Amb25035392 [0,1,0,0,0,0|2,0,1]=4 1020 B13R1.148 CC(Nc1cccc(I)c1)C(O)=O Amb24455393 [0,1,0,0,0,0|2,0,1]=4 1021 B13R1.148 CC(O)C(=O)Cc1cc[n]c(N)c1 Amb24411921 [0,1,0,0,0,0|2,0,1]=4 1022 B13R1.148 CC(O)C(=O)Cc1cccc(Br)c1 Amb24454281 [0,1,0,0,0,0|1,0,1]=3 1023 B13R1.148 CC(O)C(=O)Cc1cccc(Cl)c1 Amb25226019 [0,1,0,0,0,0|1,0,1]=3 1024 B13R1.148 CC(O)C(=O)Oc1cccc(Br)c1 Amb24397770 [0,1,0,0,0,0|2,0,1]=4 1025 B13R1.148 CC(O)C(=O)Oc1cccc(Cl)c1 Amb25686755 [0,1,0,0,0,0|2,0,1]=4 1026 B13R1.148 CC(Oc1cc(O)ccc1)C(O)=O Amb18192781 [0,1,0,0,0,0|2,0,1]=4 1027 B13R1.148 CN(C)C(=O)Cc1cccc(Br)c1 Amb23111039 [0,1,0,0,0,0|3,0,0]=4 1028 B13R1.148 CN(C)C(=O)Cc1cccc(Cl)c1 Amb23089205 [0,1,0,0,0,0|3,0,0]=4 1029 B13R1.148 CN(C)C(=O)Cc1cccc(I)c1 Amb22491389 [0,1,0,0,0,0|3,0,0]=4 1030 B13R1.148 CN(C)C(=O)Cc1cccc(O)c1 Amb18178663 [0,1,0,0,0,0|3,0,0]=4 1031 B13R1.148 CN(Cc1cccc(Cl)c1)C(N)=O Amb18332180 [0,1,0,0,0,0|3,0,0]=4 1032 B13R1.148 CN(Cc1cccc(F)c1)C(=O)Cl Amb25785989 [0,1,0,0,0,0|3,0,0]=4 1033 B13R1.148 CN(Cc1cccc(O)c1)C(N)=O Amb25717390 [0,1,0,0,0,0|3,0,0]=4 1034 B13R1.148 CN(O)C(=O)Nc1cc(O)ccc1 Amb24444879 [0,1,0,0,0,0|3,0,0]=4 1035 B13R1.148 CN(O)C(=O)Nc1cccc(F)c1 Amb25119171 [0,1,0,0,0,0|3,0,0]=4 1036 B13R1.148 C[C@@H](O)C(=O)Nc1cc(O)ccc1 Amb24475768 [0,1,0,0,0,0|2,0,1]=4 1037 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(Br)c1 Amb25749571 [0,1,0,0,0,0|2,0,1]=4 1038 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(Cl)c1 Amb25734303 [0,1,0,0,0,0|2,0,1]=4 1039 B13R1.148 C[C@@H](O)C(=O)Nc1cccc(I)c1 Amb25829784 [0,1,0,0,0,0|2,0,1]=4 1040 B13R1.148 C[C@@H](O)C(=O)Oc1cccc(Cl)c1 Amb25052790 [0,1,0,0,0,0|2,0,1]=4 1041 B13R1.148 C[C@@H](O)C(=O)Oc1cccc(I)c1 Amb25712605 [0,1,0,0,0,0|2,0,1]=4 1042 B13R1.148 C[C@@H](Oc1cccc(Br)c1)C(O)=O Amb25720694 [0,1,0,0,0,0|2,0,1]=4 1043 B13R1.148 C[C@H](Nc1cccc(F)c1)C(O)=O Amb24495647 [0,1,0,0,0,0|2,0,1]=4 1044 B13R1.148 C[C@H](O)C(=O)Nc1cc(O)ccc1 Amb24474118 [0,1,0,0,0,0|2,0,1]=4 1045 B13R1.148 C[C@H](O)C(=O)Nc1cccc(Br)c1 Amb24721254 [0,1,0,0,0,0|2,0,1]=4 1046 B13R1.148 C[C@H](O)C(=O)Nc1cccc(Cl)c1 Amb24676341 [0,1,0,0,0,0|2,0,1]=4 1047 B13R1.148 C[C@H](O)C(=O)Nc1cccc(F)c1 Amb24577644 [0,1,0,0,0,0|2,0,1]=4 1048 B13R1.148 C[C@H](O)C(=O)Nc1cccc(I)c1 Amb25837599 [0,1,0,0,0,0|2,0,1]=4 1049 B13R1.148 C[C@H](O)C(=O)Oc1cccc(F)c1 Amb25847674 [0,1,0,0,0,0|2,0,1]=4 1050 B13R1.148 C[C@H](O)C(=O)Oc1cccc(I)c1 Amb24347608 [0,1,0,0,0,0|2,0,1]=4 1051 B13R1.148 C[C@H](Oc1cccc(Cl)c1)C(O)=O Amb24490477 [0,1,0,0,0,0|2,0,1]=4 1052 B13R1.148 C[C@H](Oc1cccc(I)c1)C(O)=O Amb24405462 [0,1,0,0,0,0|2,0,1]=4 1053 B13R1.148 C\C(=C/c1cc[n]c(Br)c1)\C(O)=O Amb25670093 [0,1,0,0,0,0|2,0,1]=4 1054 B13R1.148 C\C(=C/c1cccc(Br)[n]1)\C(O)=O Amb25155174 [0,1,0,0,0,0|2,0,1]=4 1055 B13R1.148 C\C(=C/c1cccc(Br)c1)\C(O)=O Amb22339395 [0,1,0,0,0,0|1,0,1]=3 1056 B13R1.148 C\C(=C/c1cccc(C)[n]1)\C(O)=O Amb25340360 [0,1,0,0,0,0|2,0,1]=4 1057 B13R1.148 C\C(=C/c1cccc(F)c1)\C(O)=O Amb24745620 [0,1,0,0,0,0|1,0,1]=3 1058 B13R1.148 C\C(=C/c1cccc(O)c1)\C(C)=O Amb25819845 [0,1,0,0,0,0|2,0,1]=4 1059 B13R1.148 C\C(=C\c1c[n]cc(Br)c1)\C(O)=O Amb25234888 [0,1,0,0,0,0|2,0,1]=4 1060 B13R1.148 C\C(=C\c1cc(O)ccc1)\C(O)=O Amb24437242 [0,1,0,0,0,0|1,0,1]=3 1061 B13R1.148 C\C(=C\c1cccc(Br)[n]1)\C(O)=O Amb25703778 [0,1,0,0,0,0|2,0,1]=4 1062 B13R1.148 C\C(=C\c1cccc(Cl)c1)\C(O)=O Amb25085710 [0,1,0,0,0,0|1,0,1]=3 1063 B13R1.148 C\C(=C\c1cccc(F)c1)\C(O)=O Amb25255814 [0,1,0,0,0,0|1,0,1]=3 1064 B13R1.148 C\C(=C\c1cccc(N)c1)\C(O)=O Amb25039479 [0,1,0,0,0,0|1,0,1]=3 1065 B13R1.148 Cc1c[n+](CC(=O)C(O)=O)ccc1 Amb24668931 [0,1,0,0,0,0|1,0,0]=2 1066 B13R1.148 Cc1c[n]cc(c1)NC(=O)C(N)=O Amb25706703 [0,1,0,0,0,0|3,0,0]=4 1067 B13R1.148 Cc1c[n]cc(c1)NC(=O)C(O)=O Amb25046080 [0,1,0,0,0,0|2,0,0]=3 1068 B13R1.148 Cc1cc(CC(=O)C(C)=C)ccc1 Amb24489752 [0,1,0,0,0,0|2,0,0]=3 1069 B13R1.148 Cc1cc(CC(=O)C(C)N)ccc1 Amb24377295 [0,1,0,0,0,0|2,0,1]=4 1070 B13R1.148 Cc1cc(CC(=O)C(F)F)ccc1 Amb18326240 [0,1,0,0,0,0|2,0,1]=4 1071 B13R1.148 Cc1cc(CC(Br)C(N)=O)ccc1 Amb25723490 [0,1,0,0,0,0|2,0,1]=4 1072 B13R1.148 Cc1cc(CC(Br)C(O)=O)ccc1 Amb23320585 [0,1,0,0,0,0|1,0,1]=3 1073 B13R1.148 Cc1cc(CC(N)C(N)=O)ccc1 Amb25122272 [0,1,0,0,0,0|2,0,1]=4 1074 B13R1.148 Cc1cc(CC(N)C(O)=O)[n]cc1 Amb18193874 [0,1,0,0,0,0|2,0,1]=4 1075 B13R1.148 Cc1cc(CC(N)C(O)=O)c[n]c1 Amb18193896 [0,1,0,0,0,0|2,0,1]=4 1076 B13R1.148 Cc1cc(CC(N)C(O)=O)cc[n]1 Amb18824521 [0,1,0,0,0,0|2,0,1]=4 1077 B13R1.148 Cc1cc(CN(C)C(N)=O)ccc1 Amb18796022 [0,1,0,0,0,0|3,0,0]=4 1078 B13R1.148 Cc1cc(C[C@@H](N)C(O)=O)cc[n]1 Amb24409497 [0,1,0,0,0,0|2,0,1]=4 1079 B13R1.148 Cc1cc(C[C@@H](O)C(O)=O)ccc1 Amb25829025 [0,1,0,0,0,0|0,0,2]=3 1080 B13R1.148 Cc1cc(C[C@H](N)C(O)=O)[n]cc1 Amb24346939 [0,1,0,0,0,0|2,0,1]=4 1081 B13R1.148 Cc1cc(C[C@H](O)C(O)=O)ccc1 Amb25295495 [0,1,0,0,0,0|0,0,2]=3 1082 B13R1.148 Cc1cc(\C=C(/C)\C(C)=O)ccc1 Amb24492365 [0,1,0,0,0,0|2,0,1]=4 1083 B13R1.148 Cc1cc(\C=C(\F)/C(O)=O)ccc1 Amb25273987 [0,1,0,0,0,0|1,0,1]=3 1084 B13R1.148 Cc1cc(\C=C(\N)/C(O)=O)cc[n]1 Amb25231390 [0,1,0,0,0,0|2,0,1]=4 1085 B13R1.148 Cc1cc(cc[n]1)NC(=O)C(O)=O Amb25695682 [0,1,0,0,0,0|2,0,0]=3 1086 B13R1.148 Cc1cc(ccc1)NC(=O)C(=C)Cl Amb24622872 [0,1,0,0,0,0|3,0,0]=4 1087 B13R1.148 Cc1cc(ccc1)NC(=O)C(C)=C Amb25785229 [0,1,0,0,0,0|3,0,0]=4 1088 B13R1.148 Cc1cc(ccc1)NC(=O)[C@@H](C)O Amb25234661 [0,1,0,0,0,0|2,0,1]=4 1089 B13R1.148 Cc1cc(ccc1)OC(=C)C(O)=O Amb24711260 [0,1,0,0,0,0|2,0,0]=3 1090 B13R1.148 Cc1cc(ccc1)OC(=O)C(N)=O Amb24602388 [0,1,0,0,0,0|2,0,0]=3 1091 B13R1.148 Cc1cc(ccc1)OC(=O)[C@@H](C)O Amb25086184 [0,1,0,0,0,0|2,0,1]=4 1092 B13R1.148 Cc1cc(ccc1)OC(=O)[C@H](C)O Amb25032717 [0,1,0,0,0,0|2,0,1]=4 1093 B13R1.148 Cc1cc(ccc1)O[C@@H](C)C(O)=O Amb24310391 [0,1,0,0,0,0|2,0,1]=4 1094 B13R1.148 Cc1cccc(CC(C)C(O)=O)[n]1 Amb25761364 [0,1,0,0,0,0|2,0,1]=4 1095 B13R1.148 Cc1cccc(CC(N)C(C)=O)c1 Amb18195910 [0,1,0,0,0,0|2,0,1]=4 1096 B13R1.148 Cc1cccc(CC(O)C(O)=O)[n]1 Amb24740737 [0,1,0,0,0,0|1,0,2]=4 1097 B13R1.148 Cc1cccc(C[C@@H](N)C(O)=O)[n]1 Amb25117997 [0,1,0,0,0,0|2,0,1]=4 1098 B13R1.148 Cc1cccc(C[C@H](C)C(C)=O)c1 Amb25839299 [0,1,0,0,0,0|2,0,1]=4 1099 B13R1.148 Cc1cccc(c1)CC(=O)C(=O)O Amb1131949 [0,1,0,0,0,0|0,0,0]=1 1100 B13R1.148 Cc1cccc(c1)CC(=O)N(C)C Amb2106657 [0,1,0,0,0,0|3,0,0]=4 1101 B13R1.148 Cc1cccc(c1)NC(=O)C(=O)C Amb17400599 [0,1,0,0,0,0|2,0,0]=3 1102 B13R1.148 Cc1cccc(n1)NC(=O)C(=O)N Amb10973146 [0,1,0,0,0,0|3,0,0]=4 1103 B13R1.148 Clc1cccc(c1)CC(=O)C(=O)O Amb1135307 [0,1,0,0,0,0|0,0,0]=1 1104 B13R1.148 Clc1cccc(c1)NC(=O)C(=O)C Amb17402223 [0,1,0,0,0,0|2,0,0]=3 1105 B13R1.148 Clc1cccc(c1)NC(=O)N(O)C Amb1789968 [0,1,0,0,0,0|3,0,0]=4 1106 B13R1.148 Fc1cccc(c1)CC(=O)C(=O)O Amb1126816 [0,1,0,0,0,0|0,0,0]=1 1107 B13R1.148 Fc1cccc(c1)CC(=O)N(C)C Amb15739660 [0,1,0,0,0,0|3,0,0]=4 1108 B13R1.148 Fc1cccc(c1)NC(=O)C(=O)C Amb17400857 [0,1,0,0,0,0|2,0,0]=3 1109 B13R1.148 NC(=O)C(=O)Nc1c[n]cc(F)c1 Amb24370923 [0,1,0,0,0,0|3,0,0]=4 1110 B13R1.148 NC(=O)C(=O)Nc1cc(N)ccc1 Amb25129171 [0,1,0,0,0,0|2,0,0]=3 1111 B13R1.148 NC(=O)C(=O)Nc1cccc(Br)c1 Amb24347649 [0,1,0,0,0,0|2,0,0]=3 1112 B13R1.148 NC(=O)C(=O)Nc1cccc(Cl)[n]1 Amb25852416 [0,1,0,0,0,0|3,0,0]=4 1113 B13R1.148 NC(=O)C(=O)Nc1cccc(Cl)c1 Amb25374063 [0,1,0,0,0,0|2,0,0]=3 1114 B13R1.148 NC(=O)C(=O)Oc1cccc(Cl)c1 Amb25762869 [0,1,0,0,0,0|2,0,0]=3 1115 B13R1.148 NC(=O)C(=S)Nc1cccc(Cl)c1 Amb25089521 [0,1,0,0,0,0|2,1,0]=4 1116 B13R1.148 NC(=O)C(Br)Cc1cc(Br)ccc1 Amb25156077 [0,1,0,0,0,0|2,0,1]=4 1117 B13R1.148 NC(=O)C(Br)Cc1cccc(F)c1 Amb25129096 [0,1,0,0,0,0|2,0,1]=4 1118 B13R1.148 NC(=O)C(Cc1cccc(c1)Br)Cl Amb17204832 [0,1,0,0,0,0|2,0,1]=4 1119 B13R1.148 NC(=O)C(Cc1cccc(c1)C)Cl Amb17204372 [0,1,0,0,0,0|2,0,1]=4 1120 B13R1.148 NC(=O)C(Cc1cccc(c1)Cl)Cl Amb17204474 [0,1,0,0,0,0|2,0,1]=4 1121 B13R1.148 NC(=O)C(Cc1cccc(c1)F)Cl Amb17204396 [0,1,0,0,0,0|2,0,1]=4 1122 B13R1.148 NC(=O)C(N)Cc1cccc(Br)c1 Amb18136032 [0,1,0,0,0,0|2,0,1]=4 1123 B13R1.148 NC(=O)C(N)Cc1cccc(O)c1 Amb24660581 [0,1,0,0,0,0|2,0,1]=4 1124 B13R1.148 NC(=O)N(O)Cc1cccc(Cl)c1 Amb22433917 [0,1,0,0,0,0|2,0,1]=4 1125 B13R1.148 NC(=O)[C@@H](N)Cc1cccc(Cl)c1 Amb25375986 [0,1,0,0,0,0|2,0,1]=4 1126 B13R1.148 NC(=O)[C@@H](N)Cc1cccc(F)c1 Amb25367595 [0,1,0,0,0,0|2,0,1]=4 1127 B13R1.148 NC(=O)[C@@H](N)Cc1cccc(O)c1 Amb24452434 [0,1,0,0,0,0|2,0,1]=4 1128 B13R1.148 NC(CC1=CC(=O)NC=C1)C(O)=O Amb25127065 [0,1,0,0,0,0|2,0,1]=4 1129 B13R1.148 NC(Cc1cc(Cl)cc[n]1)C(O)=O Amb25764479 [0,1,0,0,0,0|2,0,1]=4 1130 B13R1.148 NC(Cc1cc(O)c[n]c1)C(O)=O Amb24377085 [0,1,0,0,0,0|2,0,1]=4 1131 B13R1.148 NC(Cc1cc[n]c(Br)c1)C(O)=O Amb25068866 [0,1,0,0,0,0|2,0,1]=4 1132 B13R1.148 NC(Cc1cc[n]c(Cl)c1)C(O)=O Amb25301408 [0,1,0,0,0,0|2,0,1]=4 1133 B13R1.148 NC(Cc1cc[n]c(F)c1)C(O)=O Amb24453250 [0,1,0,0,0,0|2,0,1]=4 1134 B13R1.148 NC(Cc1cccc(Cl)[n]1)C(O)=O Amb24342291 [0,1,0,0,0,0|2,0,1]=4 1135 B13R1.148 NC(Cc1cccc(Cl)c1)C(O)=O Amb20622650 [0,1,0,0,0,0|1,0,1]=3 1136 B13R1.148 NC(Cc1cccc(F)[n]1)C(O)=O Amb25371997 [0,1,0,0,0,0|2,0,1]=4 1137 B13R1.148 NC(Cc1cccc(O)[n]1)C(O)=O Amb24730470 [0,1,0,0,0,0|2,0,1]=4 1138 B13R1.148 N[C@@H](Cc1c[n]cc(Br)c1)C(O)=O Amb24418099 [0,1,0,0,0,0|2,0,1]=4 1139 B13R1.148 N[C@@H](Cc1cccc(I)c1)C(O)=O Amb22229331 [0,1,0,0,0,0|1,0,1]=3 1140 B13R1.148 N[C@@H](Cc1cccc(O)[n]1)C(O)=O Amb24346926 [0,1,0,0,0,0|2,0,1]=4 1141 B13R1.148 N[C@H](Cc1c[n]cc(F)c1)C(O)=O Amb25679683 [0,1,0,0,0,0|2,0,1]=4 1142 B13R1.148 N[C@H](Cc1cc(Br)cc[n]1)C(O)=O Amb25123413 [0,1,0,0,0,0|2,0,1]=4 1143 B13R1.148 N[C@H](Cc1cc[n]c(Br)c1)C(O)=O Amb24367239 [0,1,0,0,0,0|2,0,1]=4 1144 B13R1.148 N[C@H](Cc1cccc(I)c1)C(O)=O Amb22229329 [0,1,0,0,0,0|1,0,1]=3 1145 B13R1.148 N[C@H](Cc1cccc(S)c1)C(O)=O Amb24489876 [0,1,0,0,0,0|1,0,1]=3 1146 B13R1.148 N\C(=C\C1=CC=CC(=O)N1)\C(O)=O Amb25788285 [0,1,0,0,0,0|2,0,1]=4 1147 B13R1.148 N\C(=C\c1c[n]cc(F)c1)\C(O)=O Amb25206061 [0,1,0,0,0,0|2,0,1]=4 1148 B13R1.148 N\C(=C\c1cccc(F)c1)\C(O)=O Amb25794832 [0,1,0,0,0,0|1,0,1]=3 1149 B13R1.148 Nc1cc(CC(N)C(O)=O)ccc1 Amb21864824 [0,1,0,0,0,0|1,0,1]=3 1150 B13R1.148 Nc1cc(C[C@@H](N)C(O)=O)ccc1 Amb22229180 [0,1,0,0,0,0|1,0,1]=3 1151 B13R1.148 Nc1cc(C[C@H](N)C(O)=O)cc[n]1 Amb24374979 [0,1,0,0,0,0|2,0,1]=4 1152 B13R1.148 Nc1cc(C[C@H](N)C(O)=O)ccc1 Amb22229182 [0,1,0,0,0,0|1,0,1]=3 1153 B13R1.148 Nc1cc[n]c(C[C@@H](N)C(O)=O)c1 Amb24715726 [0,1,0,0,0,0|2,0,1]=4 1154 B13R1.148 Nc1cccc(C[C@@H](N)C(O)=O)[n]1 Amb24526602 [0,1,0,0,0,0|2,0,1]=4 1155 B13R1.148 O=C(C(C)C)Cc1cccc(c1)C Amb17138795 [0,1,0,0,0,0|2,0,1]=4 1156 B13R1.148 O=C(C(C)C)Cc1cccc(c1)Cl Amb17139626 [0,1,0,0,0,0|2,0,1]=4 1157 B13R1.148 O=C(C(C)C)Cc1cccc(c1)F Amb17138961 [0,1,0,0,0,0|2,0,1]=4 1158 B13R1.148 O=C(C(O)C)Nc1cccc(c1)Br Amb17410950 [0,1,0,0,0,0|2,0,1]=4 1159 B13R1.148 O=C(C(O)C)Nc1cccc(c1)C Amb17400711 [0,1,0,0,0,0|2,0,1]=4 1160 B13R1.148 O=C(C(O)C)Nc1cccc(c1)Cl Amb17402321 [0,1,0,0,0,0|2,0,1]=4 1161 B13R1.148 O=C(C(O)C)Nc1cccc(c1)F Amb17400969 [0,1,0,0,0,0|2,0,1]=4 1162 B13R1.148 O=C(Cc1cc(F)ccc1)C(F)F Amb18324054 [0,1,0,0,0,0|2,0,1]=4 1163 B13R1.148 OC(=O)C(=O)Nc1c[n]cc(F)c1 Amb25066694 [0,1,0,0,0,0|2,0,0]=3 1164 B13R1.148 OC(=O)C(=O)Nc1cc(O)ccc1 Amb25322073 [0,1,0,0,0,0|1,0,0]=2 1165 B13R1.148 OC(=O)C(Br)Cc1cc(Br)ccc1 Amb23320620 [0,1,0,0,0,0|1,0,1]=3 1166 B13R1.148 OC(=O)C(Br)Cc1cccc(Cl)c1 Amb22339430 [0,1,0,0,0,0|1,0,1]=3 1167 B13R1.148 OC(=O)C(Br)Cc1cccc(Cl)c1 Amb23320616 [0,1,0,0,0,0|1,0,1]=3 1168 B13R1.148 OC(=O)C(C[n+]1cccc(c1)C)Br Amb1030019 [0,1,0,0,0,0|2,0,1]=4 1169 B13R1.148 OC(=O)C(Cc1cccc(c1)Br)Cl Amb17204844 [0,1,0,0,0,0|1,0,1]=3 1170 B13R1.148 OC(=O)C(Cc1cccc(c1)Br)O Amb17159702 [0,1,0,0,0,0|0,0,2]=3 1171 B13R1.148 OC(=O)C(Cc1cccc(c1)C)Cl Amb17204375 [0,1,0,0,0,0|1,0,1]=3 1172 B13R1.148 OC(=O)C(Cc1cccc(c1)C)O Amb17138949 [0,1,0,0,0,0|0,0,2]=3 1173 B13R1.148 OC(=O)C(Cc1cccc(c1)C)S Amb2480724 [0,1,0,0,0,0|0,1,1]=3 1174 B13R1.148 OC(=O)C(Cc1cccc(c1)Cl)Cl Amb17204491 [0,1,0,0,0,0|1,0,1]=3 1175 B13R1.148 OC(=O)C(Cc1cccc(c1)Cl)O Amb17139823 [0,1,0,0,0,0|0,0,2]=3 1176 B13R1.148 OC(=O)C(Cc1cccc(c1)F)C Amb13951302 [0,1,0,0,0,0|1,0,1]=3 1177 B13R1.148 OC(=O)C(Cc1cccc(c1)F)Cl Amb17204399 [0,1,0,0,0,0|1,0,1]=3 1178 B13R1.148 OC(=O)C(Cc1cccc(c1)O)C Amb10844220 [0,1,0,0,0,0|1,0,1]=3 1179 B13R1.148 OC(=O)C(F)Cc1cc(F)ccc1 Amb24674554 [0,1,0,0,0,0|1,0,1]=3 1180 B13R1.148 OC(=O)C(F)Cc1cccc(Br)c1 Amb25200828 [0,1,0,0,0,0|1,0,1]=3 1181 B13R1.148 OC(=O)C(F)Oc1cccc(Cl)c1 Amb25076043 [0,1,0,0,0,0|2,0,1]=4 1182 B13R1.148 OC(=O)C(F)Sc1cc(F)ccc1 Amb24753369 [0,1,0,0,0,0|2,0,1]=4 1183 B13R1.148 OC(=O)C(F)Sc1cccc(Br)c1 Amb24701849 [0,1,0,0,0,0|2,0,1]=4 1184 B13R1.148 OC(=O)C(O)Cc1c[n]cc(Br)c1 Amb24535360 [0,1,0,0,0,0|1,0,2]=4 1185 B13R1.148 OC(=O)C(Oc1cccc(c1)Br)C Amb2556137 [0,1,0,0,0,0|2,0,1]=4 1186 B13R1.148 OC(=O)C(Oc1cccc(c1)Cl)C Amb1212286 [0,1,0,0,0,0|2,0,1]=4 1187 B13R1.148 OC(=O)C(Oc1cccc(c1)F)C Amb1116562 [0,1,0,0,0,0|2,0,1]=4 1188 B13R1.148 OC(=O)[C@@H](Cc1cccc(c1)Cl)C Amb10844155 [0,1,0,0,0,0|1,0,1]=3 1189 B13R1.148 OC(=O)[C@@H](Nc1cccc(c1)C)C Amb16231733 [0,1,0,0,0,0|2,0,1]=4 1190 B13R1.148 OC(=O)[C@@H](O)Cc1cccc(F)c1 Amb24725523 [0,1,0,0,0,0|0,0,2]=3 1191 B13R1.148 OC(=O)[C@H](Cc1cccc(c1)C)C Amb10844169 [0,1,0,0,0,0|1,0,1]=3 1192 B13R1.148 OC(=O)[C@H](Cc1cccc(c1)Cl)C Amb10844156 [0,1,0,0,0,0|1,0,1]=3 1193 B13R1.148 OC(=O)\C(\Cl)=C\c1cc(Cl)ccc1 Amb25261768 [0,1,0,0,0,0|1,0,1]=3 1194 B13R1.148 OC(=O)\C(\F)=C\c1cccc(Br)c1 Amb24520960 [0,1,0,0,0,0|1,0,1]=3 1195 B13R1.148 OC(=O)\C(\F)=C\c1cccc(Cl)c1 Amb25085473 [0,1,0,0,0,0|1,0,1]=3 1196 B13R1.148 OC(=O)\C(\F)=C\c1cccc(I)c1 Amb25277060 [0,1,0,0,0,0|1,0,1]=3 1197 B13R1.148 OC(=O)\C(\S)=C\c1cccc(F)c1 Amb25177621 [0,1,0,0,0,0|0,1,1]=3 1198 B13R1.148 Oc1cc(CC(=O)C(F)F)ccc1 Amb25333794 [0,1,0,0,0,0|2,0,1]=4 1199 B13R1.148 Oc1cc(\C=C(/S)\C(O)=O)ccc1 Amb24115515 [0,1,0,0,0,0|0,1,1]=3 1200 B13R1.148 Oc1cccc(CC(Br)C(O)=O)c1 Amb25280092 [0,1,0,0,0,0|1,0,1]=3 1201 B13R1.148 Oc1cccc(CC(S)C(O)=O)c1 Amb25210444 [0,1,0,0,0,0|0,1,1]=3 1202 B13R1.148 Oc1cccc(C[C@@H](O)C(O)=O)c1 Amb25219734 [0,1,0,0,0,0|0,0,2]=3 1203 B13R1.148 Oc1cccc(C[C@H](O)C(O)=O)c1 Amb25342679 [0,1,0,0,0,0|0,0,2]=3 1204 B13R1.148 Oc1cccc(c1)CC(=O)C(=O)O Amb1141341 [0,1,0,0,0,0|0,0,0]=1 1205 B13R1.148 Oc1cccc(c1)NC(=O)C(=O)N Amb13781379 [0,1,0,0,0,0|2,0,0]=3 1206 B13R1.148 Oc1cccc(c1)SC(F)C(O)=O Amb25804345 [0,1,0,0,0,0|2,0,1]=4 1207 B13R1.152 BrC(C(C(=O)O)O)c1ccccc1 Amb17596766 [0,1,0,0,0,0|0,0,2]=3 1208 B13R1.152 C=C(C(Cl)C(O)=O)c1ccccc1 Amb25227445 [0,1,0,0,0,0|1,0,2]=4 1209 B13R1.152 C=C(C(N)C(O)=O)c1ccccc1 Amb18127911 [0,1,0,0,0,0|1,0,2]=4 1210 B13R1.152 C=C(C(O)C(O)=O)c1ccccc1 Amb25273986 [0,1,0,0,0,0|0,0,3]=4 1211 B13R1.152 C=C(C(O)c1ccc[n]c1)C(N)=O Amb25180922 [0,1,0,0,0,0|3,0,0]=4 1212 B13R1.152 C=C(C(O)c1cccc[n]1)C(O)=O Amb25760297 [0,1,0,0,0,0|2,0,0]=3 1213 B13R1.152 C=C(C(O)c1ccccc1)C(N)=O Amb24692881 [0,1,0,0,0,0|2,0,0]=3 1214 B13R1.152 C=C([C@H](N)c1ccccc1)C(O)=O Amb25697157 [0,1,0,0,0,0|1,0,0]=2 1215 B13R1.152 CC(=C)C(=C)C(O)c1ccccc1 Amb25781853 [0,1,0,0,0,0|3,0,0]=4 1216 B13R1.152 CC(=C)C(=O)C(N)c1ccccc1 Amb25153483 [0,1,0,0,0,0|2,0,0]=3 1217 B13R1.152 CC(=C)C(=O)C(O)c1ccccc1 Amb25807562 [0,1,0,0,0,0|2,0,0]=3 1218 B13R1.152 CC(=C)C(=O)[C@H](N)c1ccccc1 Amb25155665 [0,1,0,0,0,0|2,0,0]=3 1219 B13R1.152 CC(=O)C(=C)C(O)c1cccc[n]1 Amb24544624 [0,1,0,0,0,0|3,0,0]=4 1220 B13R1.152 CC(=O)C(=C)[C@@H](O)c1ccccc1 Amb24370174 [0,1,0,0,0,0|2,0,0]=3 1221 B13R1.152 CC(=O)C(=O)C(=O)c1ccccc1 Amb25092958 [0,1,0,0,0,0|1,0,1]=3 1222 B13R1.152 CC(=O)C(=O)C(C)c1ccccc1 Amb24492525 [0,1,0,0,0,0|1,0,0]=2 1223 B13R1.152 CC(=O)C(C)C(C)c1ccccc1 Amb25087204 [0,1,0,0,0,0|2,0,1]=4 1224 B13R1.152 CC(=O)C(C)C(N)c1ccccc1 Amb25041504 [0,1,0,0,0,0|2,0,1]=4 1225 B13R1.152 CC(=O)C(Cl)C(N)c1ccccc1 Amb25300345 [0,1,0,0,0,0|2,0,1]=4 1226 B13R1.152 CC(=O)C(N)C(O)c1ccccc1 Amb25066908 [0,1,0,0,0,0|2,0,1]=4 1227 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 Amb25731265 [0,1,0,0,0,0|3,0,0]=4 1228 B13R1.152 CC(=O)N(C)C(Cl)c1ccccc1 Amb25772765 [0,1,0,0,0,0|3,0,0]=4 1229 B13R1.152 CC(=O)[C@@H](C)[C@@H](C)c1ccccc1 Amb25086639 [0,1,0,0,0,0|2,0,1]=4 1230 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24467544 [0,1,0,0,0,0|2,0,1]=4 1231 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb25290208 [0,1,0,0,0,0|2,0,1]=4 1232 B13R1.152 CC(=O)[C@@H](O)[C@@H](O)c1ccccc1 Amb24704823 [0,1,0,0,0,0|1,0,2]=4 1233 B13R1.152 CC(=O)[C@H](C)[C@H](O)c1ccccc1 Amb24492637 [0,1,0,0,0,0|2,0,1]=4 1234 B13R1.152 CC(=O)[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb24574713 [0,1,0,0,0,0|2,0,1]=4 1235 B13R1.152 CC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb24652637 [0,1,0,0,0,0|2,0,1]=4 1236 B13R1.152 CC(=O)[C@H](O)[C@H](O)c1ccccc1 Amb24752230 [0,1,0,0,0,0|1,0,2]=4 1237 B13R1.152 CC(=O)\C(\Br)=C(\N)/c1ccccc1 Amb25680603 [0,1,0,0,0,0|2,0,1]=4 1238 B13R1.152 CC(C(=C)C(O)=O)c1ccccc1 Amb24634053 [0,1,0,0,0,0|1,0,0]=2 1239 B13R1.152 CC(C(=C)c1ccccc1)C(O)=O Amb18127713 [0,1,0,0,0,0|1,0,2]=4 1240 B13R1.152 CC(C(=O)N(c1ccccc1)C)O Amb17400713 [0,1,0,0,0,0|2,0,1]=4 1241 B13R1.152 CC(C(Br)C(O)=O)c1ccccc1 Amb24396296 [0,1,0,0,0,0|1,0,1]=3 1242 B13R1.152 CC(C(C(=O)O)N)c1ccccc1 Amb10072242 [0,1,0,0,0,0|1,0,1]=3 1243 B13R1.152 CC(C(C(=O)O)O)c1ccccc1 Amb10549583 [0,1,0,0,0,0|0,0,2]=3 1244 B13R1.152 CC(C(C)c1cccc[n]1)C(O)=O Amb18824717 [0,1,0,0,0,0|2,0,1]=4 1245 B13R1.152 CC(C(C)c1ccccc1)C(=O)Cl Amb25197974 [0,1,0,0,0,0|2,0,1]=4 1246 B13R1.152 CC(C(Cl)C(N)=O)c1ccccc1 Amb18330991 [0,1,0,0,0,0|2,0,1]=4 1247 B13R1.152 CC(C(Cl)C(O)=O)c1ccccc1 Amb25773999 [0,1,0,0,0,0|1,0,1]=3 1248 B13R1.152 CC(C(Cl)c1ccccc1)C(=O)Cl Amb24418080 [0,1,0,0,0,0|2,0,1]=4 1249 B13R1.152 CC(C(Cl)c1ccccc1)C(O)=O Amb18130574 [0,1,0,0,0,0|1,0,1]=3 1250 B13R1.152 CC(C(F)C(O)=O)c1cc[n]cc1 Amb25119011 [0,1,0,0,0,0|2,0,1]=4 1251 B13R1.152 CC(C(F)C(O)=O)c1ccc[n]c1 Amb24583873 [0,1,0,0,0,0|2,0,1]=4 1252 B13R1.152 CC(C(F)C(O)=O)c1ccccc1 Amb24674555 [0,1,0,0,0,0|1,0,1]=3 1253 B13R1.152 CC(C(N)C(N)=O)c1ccccc1 Amb18975500 [0,1,0,0,0,0|2,0,1]=4 1254 B13R1.152 CC(C(N)c1ccccc1)C(O)=O Amb19375481 [0,1,0,0,0,0|1,0,1]=3 1255 B13R1.152 CC(C(O)=O)C(=O)c1ccccc1 Amb18128110 [0,1,0,0,0,0|1,0,2]=4 1256 B13R1.152 CC(C(O)=O)S(=O)c1ccccc1 Amb18292847 [0,1,0,0,0,0|2,0,1]=4 1257 B13R1.152 CC(C(O)C(N)=O)c1ccccc1 Amb18809180 [0,1,0,0,0,0|1,0,2]=4 1258 B13R1.152 CC(C)=C(C)C(O)c1ccccc1 Amb24495409 [0,1,0,0,0,0|3,0,0]=4 1259 B13R1.152 CC(C)C(=O)C(C)c1ccccc1 Amb24400185 [0,1,0,0,0,0|2,0,1]=4 1260 B13R1.152 CC(C)C(=O)[C@@H](C)c1ccccc1 Amb24408301 [0,1,0,0,0,0|2,0,1]=4 1261 B13R1.152 CC(C)C(=O)[C@H](N)c1ccccc1 Amb25155664 [0,1,0,0,0,0|2,0,1]=4 1262 B13R1.152 CC(C)C(=O)[C@H](O)c1ccccc1 Amb24690697 [0,1,0,0,0,0|2,0,1]=4 1263 B13R1.152 CC([C@@H](N)C(O)=O)c1ccccc1 Amb24107545 [0,1,0,0,0,0|1,0,1]=3 1264 B13R1.152 CC([C@H](O)c1ccccc1)C(O)=O Amb25258355 [0,1,0,0,0,0|1,0,1]=3 1265 B13R1.152 CC(c1ccccc1)C(=O)C(O)=O Amb18648106 [0,1,0,0,0,0|0,0,0]=1 1266 B13R1.152 CC(c1ccccc1)N(O)C(N)=O Amb25321876 [0,1,0,0,0,0|2,0,1]=4 1267 B13R1.152 CN(C(=O)C(=O)C)c1ccccc1 Amb2424343 [0,1,0,0,0,0|2,0,0]=3 1268 B13R1.152 CN(C(=O)N(C)O)c1ccccc1 Amb25354711 [0,1,0,0,0,0|3,0,0]=4 1269 B13R1.152 CN(C(=O)[C@H](C)O)c1ccccc1 Amb25853363 [0,1,0,0,0,0|2,0,1]=4 1270 B13R1.152 CN(C)C(=O)[C@@H](C)c1ccccc1 Amb25370071 [0,1,0,0,0,0|3,0,0]=4 1271 B13R1.152 CN(C)C(=O)[C@@H](N)c1ccccc1 Amb24056498 [0,1,0,0,0,0|3,0,0]=4 1272 B13R1.152 CN(C)C(=O)[C@@H](O)c1ccccc1 Amb25795435 [0,1,0,0,0,0|3,0,0]=4 1273 B13R1.152 CN(C)C(=O)[C@H](C)c1ccccc1 Amb25093411 [0,1,0,0,0,0|3,0,0]=4 1274 B13R1.152 CN(C)C(=O)[C@H](N)c1ccccc1 Amb25291302 [0,1,0,0,0,0|3,0,0]=4 1275 B13R1.152 CN([C@@H](C)C(O)=O)c1ccccc1 Amb24424138 [0,1,0,0,0,0|2,0,1]=4 1276 B13R1.152 C[C@@H](C(=O)[C@H](C)N)c1ccccc1 Amb24561937 [0,1,0,0,0,0|2,0,1]=4 1277 B13R1.152 C[C@@H](C(O)=O)S(=O)c1ccccc1 Amb25761325 [0,1,0,0,0,0|2,0,1]=4 1278 B13R1.152 C[C@@H]([C@@H](C)c1ccccc1)C(N)=O Amb25765701 [0,1,0,0,0,0|2,0,1]=4 1279 B13R1.152 C[C@@H]([C@@H](N)C(O)=O)c1ccccc1 Amb22801136 [0,1,0,0,0,0|1,0,1]=3 1280 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(N)=O Amb24590220 [0,1,0,0,0,0|2,0,1]=4 1281 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(O)=O Amb19929625 [0,1,0,0,0,0|1,0,1]=3 1282 B13R1.152 C[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25697174 [0,1,0,0,0,0|0,0,2]=3 1283 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)C(O)=O Amb24429060 [0,1,0,0,0,0|1,0,1]=3 1284 B13R1.152 C[C@@H]([C@H](N)c1ccccc1)C(O)=O Amb19929623 [0,1,0,0,0,0|1,0,1]=3 1285 B13R1.152 C[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb25708376 [0,1,0,0,0,0|0,0,2]=3 1286 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)C(O)=O Amb25689703 [0,1,0,0,0,0|1,0,1]=3 1287 B13R1.152 C[C@@H](c1ccccc1)N(O)C(N)=O Amb25040134 [0,1,0,0,0,0|2,0,1]=4 1288 B13R1.152 C[C@H]([C@@H](C(=O)O)C)c1ccccc1 Amb10844123 [0,1,0,0,0,0|1,0,1]=3 1289 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb19890909 [0,1,0,0,0,0|1,0,1]=3 1290 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb25101600 [0,1,0,0,0,0|1,0,1]=3 1291 B13R1.152 C[C@H]([C@@H](N)c1ccccc1)C(O)=O Amb25111224 [0,1,0,0,0,0|1,0,1]=3 1292 B13R1.152 C[C@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25363181 [0,1,0,0,0,0|0,0,2]=3 1293 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)C(N)=O Amb25708390 [0,1,0,0,0,0|2,0,1]=4 1294 B13R1.152 C[C@H]([C@H](N)c1ccccc1)C(O)=O Amb24552403 [0,1,0,0,0,0|1,0,1]=3 1295 B13R1.152 C\C(=C(\F)/C(O)=O)\c1cc[n]cc1 Amb25206464 [0,1,0,0,0,0|2,0,1]=4 1296 B13R1.152 C\C(=C(\F)/C(O)=O)\c1ccccc1 Amb18128594 [0,1,0,0,0,0|1,0,1]=3 1297 B13R1.152 C\C(=C(\N)/c1ccccc1)\C(C)=O Amb25360965 [0,1,0,0,0,0|2,0,1]=4 1298 B13R1.152 C\C(\C(=O)c1ccccc1)=C(/C)\O Amb25128952 [0,1,0,0,0,0|2,0,1]=4 1299 B13R1.152 C\C(\C(=O)c1ccccc1)=C(\C)/O Amb24378973 [0,1,0,0,0,0|2,0,1]=4 1300 B13R1.152 C\C(\C(C)=O)=C(\C)/c1ccccc1 Amb25730281 [0,1,0,0,0,0|2,0,1]=4 1301 B13R1.152 C\C(\C(O)=O)=C(\C)/c1ccc[n]c1 Amb25788477 [0,1,0,0,0,0|2,0,1]=4 1302 B13R1.152 C\C(\C(O)=O)=C(\C)/c1ccccc1 Amb18127724 [0,1,0,0,0,0|1,0,1]=3 1303 B13R1.152 C\C(\F)=C(\F)/C(O)c1ccccc1 Amb25847030 [0,1,0,0,0,0|3,0,0]=4 1304 B13R1.152 ClC(C(=O)N(C)C)c1ccccc1 Amb1106097 [0,1,0,0,0,0|3,0,0]=4 1305 B13R1.152 ClC(C(C(=O)O)O)c1ccccc1 Amb17595327 [0,1,0,0,0,0|0,0,2]=3 1306 B13R1.152 ClC(Cl)=C(Cl)C(Cl)c1ccccc1 Amb22366611 [0,1,0,0,0,0|3,0,0]=4 1307 B13R1.152 NC(=O)C(=O)C(=O)c1ccccc1 Amb24602358 [0,1,0,0,0,0|1,0,1]=3 1308 B13R1.152 NC(=O)C(Cl)C(O)c1ccccc1 Amb25772867 [0,1,0,0,0,0|2,0,1]=4 1309 B13R1.152 NC(=O)C(N)C(F)c1ccccc1 Amb25322105 [0,1,0,0,0,0|2,0,1]=4 1310 B13R1.152 NC(=O)C(O)C(F)c1ccccc1 Amb24400168 [0,1,0,0,0,0|1,0,2]=4 1311 B13R1.152 NC(=O)[C@@H](N)[C@@H](O)c1ccccc1 Amb25138644 [0,1,0,0,0,0|2,0,1]=4 1312 B13R1.152 NC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb24426182 [0,1,0,0,0,0|1,0,2]=4 1313 B13R1.152 NC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb25363147 [0,1,0,0,0,0|2,0,1]=4 1314 B13R1.152 NC(=O)[C@H](F)[C@@H](O)c1ccccc1 Amb24429111 [0,1,0,0,0,0|2,0,1]=4 1315 B13R1.152 NC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb24552423 [0,1,0,0,0,0|1,0,2]=4 1316 B13R1.152 NC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb24741670 [0,1,0,0,0,0|1,0,2]=4 1317 B13R1.152 NC(C(=O)N(C)C)c1ccccc1 Amb10609379 [0,1,0,0,0,0|3,0,0]=4 1318 B13R1.152 NC(C(C(=O)O)C)c1ccccc1 Amb17470593 [0,1,0,0,0,0|1,0,1]=3 1319 B13R1.152 NC(C(C(=O)O)C)c1ccncc1 Amb17470632 [0,1,0,0,0,0|2,0,1]=4 1320 B13R1.152 NC(C(N)c1ccccc1)C(O)=O Amb18128694 [0,1,0,0,0,0|1,0,1]=3 1321 B13R1.152 NC(C(O)C(O)=O)c1cccc[n]1 Amb25288335 [0,1,0,0,0,0|1,0,2]=4 1322 B13R1.152 NC(C(O)C(O)=O)c1ccccc1 Amb22552502 [0,1,0,0,0,0|0,0,2]=3 1323 B13R1.152 NC(C(O)c1cc[n]cc1)C(O)=O Amb18192714 [0,1,0,0,0,0|2,0,1]=4 1324 B13R1.152 NC(C(O)c1cccc[n]1)C(O)=O Amb18192715 [0,1,0,0,0,0|2,0,1]=4 1325 B13R1.152 NC([C@H](O)c1ccccc1)C(O)=O Amb25848582 [0,1,0,0,0,0|1,0,1]=3 1326 B13R1.152 NC(c1ccccc1)C(=O)C(O)=O Amb24693899 [0,1,0,0,0,0|0,0,0]=1 1327 B13R1.152 N[C@@H](C(Cl)c1ccccc1)C(O)=O Amb25765693 [0,1,0,0,0,0|1,0,1]=3 1328 B13R1.152 N[C@@H](C(O)C(O)=O)c1ccccc1 Amb24677811 [0,1,0,0,0,0|0,0,2]=3 1329 B13R1.152 N[C@@H]([C@@H](C(=O)O)O)c1ccccc1 Amb17619345 [0,1,0,0,0,0|0,0,2]=3 1330 B13R1.152 N[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb17779638 [0,1,0,0,0,0|0,0,2]=3 1331 B13R1.152 N[C@@H]([C@@H](S)c1ccccc1)C(O)=O Amb24677701 [0,1,0,0,0,0|1,0,1]=3 1332 B13R1.152 N[C@@H]([C@H](C(=O)O)O)c1ccccc1 Amb17619344 [0,1,0,0,0,0|0,0,2]=3 1333 B13R1.152 N[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb22745018 [0,1,0,0,0,0|0,0,2]=3 1334 B13R1.152 N[C@H](C(=O)N(C)C)c1ccccc1 Amb17233442 [0,1,0,0,0,0|3,0,0]=4 1335 B13R1.152 N[C@H]([C@@H](S)c1ccccc1)C(O)=O Amb24346854 [0,1,0,0,0,0|1,0,1]=3 1336 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb10601661 [0,1,0,0,0,0|0,0,2]=3 1337 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb16231605 [0,1,0,0,0,0|0,0,2]=3 1338 B13R1.152 N[C@H]([C@H](N)c1ccccc1)C(O)=O Amb24442986 [0,1,0,0,0,0|1,0,1]=3 1339 B13R1.152 N[C@H]([C@H](O)C(O)=O)c1ccc[n]c1 Amb24737746 [0,1,0,0,0,0|1,0,2]=4 1340 B13R1.152 O=C(C(=C)C(=O)C)c1ccccc1 Amb17594383 [0,1,0,0,0,0|2,0,1]=4 1341 B13R1.152 O=C(Cl)C(Br)C(Br)c1ccccc1 Amb22366166 [0,1,0,0,0,0|2,0,1]=4 1342 B13R1.152 OC(=O)C(=O)C(Br)c1ccccc1 Amb18135901 [0,1,0,0,0,0|0,0,0]=1 1343 B13R1.152 OC(=O)C(=O)C(Cl)c1ccccc1 Amb25292830 [0,1,0,0,0,0|0,0,0]=1 1344 B13R1.152 OC(=O)C(C(c1ccccn1)N)C Amb17470626 [0,1,0,0,0,0|2,0,1]=4 1345 B13R1.152 OC(=O)C(C(c1cccnc1)N)C Amb17470629 [0,1,0,0,0,0|2,0,1]=4 1346 B13R1.152 OC(=O)C(Cl)C(Cl)c1ccccc1 Amb18132697 [0,1,0,0,0,0|1,0,1]=3 1347 B13R1.152 OC(=O)C(Cl)C(O)c1ccccc1 Amb25366171 [0,1,0,0,0,0|1,0,1]=3 1348 B13R1.152 OC(=O)C(Cl)S(=O)c1ccccc1 Amb25195918 [0,1,0,0,0,0|2,0,1]=4 1349 B13R1.152 OC(=O)[C@H](Cl)[C@H](O)c1ccccc1 Amb24640317 [0,1,0,0,0,0|1,0,1]=3 1350 B13R1.152 OC(=O)\C(\Cl)=C(\Cl)/c1ccccc1 Amb18658046 [0,1,0,0,0,0|1,0,1]=3 1351 B13R1.152 OC(=O)\C(\F)=C(/F)\c1ccccc1 Amb18129295 [0,1,0,0,0,0|1,0,1]=3 1352 B13R1.152 OC(=O)\C(\F)=C(\F)/c1ccccc1 Amb25173140 [0,1,0,0,0,0|1,0,1]=3 1353 B13R1.152 OC(=O)\C(\I)=C(/I)\c1ccccc1 Amb22438965 [0,1,0,0,0,0|1,0,1]=3 1354 B13R1.152 OC(C(=O)N(C)C)c1ccccc1 Amb17400708 [0,1,0,0,0,0|3,0,0]=4 1355 B13R1.152 OC(C(C(=O)C)C)c1ccccc1 Amb17594547 [0,1,0,0,0,0|2,0,1]=4 1356 B13R1.152 OC(C(C(=O)O)N)c1ccccc1 Amb2228459 [0,1,0,0,0,0|1,0,1]=3 1357 B13R1.152 OC(C(C(=O)[O-])N)c1ccccc1 Amb15772286 [0,1,0,0,0,0|1,0,2]=4 1358 B13R1.152 OC(c1ccccc1)C(F)=C(F)F Amb25136292 [0,1,0,0,0,0|3,0,0]=4 1359 B13R1.152 ON(C(=O)C(O)O)c1ccccc1 Amb25234828 [0,1,0,0,0,0|1,0,2]=4 1360 B13R1.152 O[C@@H](c1ccccc1)C(F)=C(F)F Amb24448013 [0,1,0,0,0,0|3,0,0]=4 1361 B13R1.152 O[C@H]([C@H](C(=O)O)C)c1ccccc1 Amb10844122 [0,1,0,0,0,0|1,0,1]=3 1362 B13R1.152 O[C@H](c1ccccc1)C(F)=C(F)F Amb24533373 [0,1,0,0,0,0|3,0,0]=4 1363 B13R1.152 O\C(=C(/C(=O)C)\C)\c1ccccc1 Amb17594481 [0,1,0,0,0,0|2,0,1]=4 1364 B13R1.152 SC(C(C(=O)O)N)c1ccccc1 Amb17595234 [0,1,0,0,0,0|1,0,1]=3 1365 B13R1.202 C=C(CN1C=CC=CC1=O)C(O)=O Amb25367283 [0,1,0,0,0,0|2,0,0]=3 1366 B13R1.202 C=C(CN1C=CN=CC1=O)C(O)=O Amb24700079 [0,1,0,0,0,0|3,0,0]=4 1367 B13R1.202 C=C(CN1N=CC=CC1=O)C(O)=O Amb25694350 [0,1,0,0,0,0|3,0,0]=4 1368 B13R1.202 C=C(Cc1ccccc1Cl)C(O)=O Amb24426262 [0,1,0,0,0,0|1,0,0]=2 1369 B13R1.202 C=C(Cc1ccccc1O)C(O)=O Amb18128088 [0,1,0,0,0,0|1,0,0]=2 1370 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1Br Amb24630627 [0,1,0,0,0,0|3,0,0]=4 1371 B13R1.202 C=C(Cl)C(=O)Nc1ccccc1Cl Amb22460395 [0,1,0,0,0,0|3,0,0]=4 1372 B13R1.202 C=C(Oc1ccccc1O)C(N)=O Amb18648219 [0,1,0,0,0,0|3,0,0]=4 1373 B13R1.202 C=C(Oc1ccccc1O)C(O)=O Amb18128536 [0,1,0,0,0,0|2,0,0]=3 1374 B13R1.202 CC(=C)C(=O)Cc1c[n]ccc1N Amb24376845 [0,1,0,0,0,0|3,0,0]=4 1375 B13R1.202 CC(=C)C(=O)Cc1ccccc1Cl Amb25180911 [0,1,0,0,0,0|2,0,0]=3 1376 B13R1.202 CC(=C)C(=O)Nc1ccccc1O Amb18127847 [0,1,0,0,0,0|3,0,0]=4 1377 B13R1.202 CC(=C)C(=O)Oc1ccccc1Cl Amb25159245 [0,1,0,0,0,0|3,0,0]=4 1378 B13R1.202 CC(=C)C(=O)Oc1ccccc1F Amb25192592 [0,1,0,0,0,0|3,0,0]=4 1379 B13R1.202 CC(=C)C(=O)Oc1ccccc1I Amb24368864 [0,1,0,0,0,0|3,0,0]=4 1380 B13R1.202 CC(=C)C(=O)Oc1ccccc1O Amb18128071 [0,1,0,0,0,0|3,0,0]=4 1381 B13R1.202 CC(=O)C(=O)CN1C=CC=NC1=N Amb25354581 [0,1,0,0,0,0|3,0,0]=4 1382 B13R1.202 CC(=O)C(=O)Cc1ccccc1C Amb25158383 [0,1,0,0,0,0|1,0,0]=2 1383 B13R1.202 CC(=O)C(=O)Cc1ccccc1F Amb23603624 [0,1,0,0,0,0|1,0,0]=2 1384 B13R1.202 CC(=O)C(=O)Nc1ccccc1Br Amb17410539 [0,1,0,0,0,0|2,0,0]=3 1385 B13R1.202 CC(=O)C(=O)Nc1ccccc1C Amb17400598 [0,1,0,0,0,0|2,0,0]=3 1386 B13R1.202 CC(=O)C(=O)Nc1ccccc1Cl Amb17402222 [0,1,0,0,0,0|2,0,0]=3 1387 B13R1.202 CC(=O)C(=O)Nc1ccccc1F Amb17400855 [0,1,0,0,0,0|2,0,0]=3 1388 B13R1.202 CC(=O)C(Br)Cc1ccccc1Br Amb18601676 [0,1,0,0,0,0|2,0,1]=4 1389 B13R1.202 CC(=O)C(Br)Cc1ccccc1Cl Amb18589744 [0,1,0,0,0,0|2,0,1]=4 1390 B13R1.202 CC(=O)C(Br)Cc1ccccc1F Amb25142912 [0,1,0,0,0,0|2,0,1]=4 1391 B13R1.202 CC(=O)C(C)Cc1ccccc1Br Amb25857289 [0,1,0,0,0,0|2,0,1]=4 1392 B13R1.202 CC(=O)C(Cc1ccccc1Br)Cl Amb17204824 [0,1,0,0,0,0|2,0,1]=4 1393 B13R1.202 CC(=O)C(Cc1ccccc1C)C Amb17233203 [0,1,0,0,0,0|2,0,1]=4 1394 B13R1.202 CC(=O)C(Cc1ccccc1C)Cl Amb17204368 [0,1,0,0,0,0|2,0,1]=4 1395 B13R1.202 CC(=O)C(Cc1ccccc1Cl)C Amb17236507 [0,1,0,0,0,0|2,0,1]=4 1396 B13R1.202 CC(=O)C(Cc1ccccc1F)C Amb17233678 [0,1,0,0,0,0|2,0,1]=4 1397 B13R1.202 CC(=O)C(Cc1ccccc1F)Cl Amb17204389 [0,1,0,0,0,0|2,0,1]=4 1398 B13R1.202 CC(=O)C(Cc1ccccc1O)Br Amb17507801 [0,1,0,0,0,0|2,0,1]=4 1399 B13R1.202 CC(=O)C(N)Cc1ccccc1Br Amb18726733 [0,1,0,0,0,0|2,0,1]=4 1400 B13R1.202 CC(=O)C(N)Cc1ccccc1F Amb25079181 [0,1,0,0,0,0|2,0,1]=4 1401 B13R1.202 CC(=O)N(C)Cc1ccccc1Br Amb25733182 [0,1,0,0,0,0|3,0,0]=4 1402 B13R1.202 CC(=O)N(C)Cc1ccccc1Cl Amb25734688 [0,1,0,0,0,0|3,0,0]=4 1403 B13R1.202 CC(=O)N(O)Cc1ccccc1Cl Amb24450252 [0,1,0,0,0,0|2,0,1]=4 1404 B13R1.202 CC(=O)[C@@H](C)Cc1ccccc1Cl Amb24733929 [0,1,0,0,0,0|2,0,1]=4 1405 B13R1.202 CC(C)=C(C)Cc1ccccc1O Amb24492398 [0,1,0,0,0,0|3,0,0]=4 1406 B13R1.202 CC(C)C(=O)Cc1ccccc1Br Amb19374406 [0,1,0,0,0,0|2,0,1]=4 1407 B13R1.202 CC(C)C(=O)Cc1ccccc1O Amb18128196 [0,1,0,0,0,0|2,0,1]=4 1408 B13R1.202 CC(CN1C=CC=CC1=O)C(O)=O Amb19001379 [0,1,0,0,0,0|2,0,1]=4 1409 B13R1.202 CC(Cc1[n]cccc1Br)C(O)=O Amb24428877 [0,1,0,0,0,0|2,0,1]=4 1410 B13R1.202 CC(Cc1cc[n]cc1F)C(O)=O Amb25039005 [0,1,0,0,0,0|2,0,1]=4 1411 B13R1.202 CC(Cc1ccccc1Br)C(=O)Cl Amb24664137 [0,1,0,0,0,0|2,0,1]=4 1412 B13R1.202 CC(Cc1ccccc1F)C(N)=O Amb24362533 [0,1,0,0,0,0|2,0,1]=4 1413 B13R1.202 CC(N)C(=O)Cc1ccccc1Br Amb18156000 [0,1,0,0,0,0|2,0,1]=4 1414 B13R1.202 CC(N)C(=O)Cc1ccccc1Cl Amb18812029 [0,1,0,0,0,0|2,0,1]=4 1415 B13R1.202 CC(N)C(=O)Cc1ccccc1F Amb18193152 [0,1,0,0,0,0|2,0,1]=4 1416 B13R1.202 CC(O)C(=O)Cc1[n]cccc1Br Amb24760982 [0,1,0,0,0,0|2,0,1]=4 1417 B13R1.202 CC(O)C(=O)Cc1c[n]ccc1N Amb25801552 [0,1,0,0,0,0|2,0,1]=4 1418 B13R1.202 CC(O)C(=O)Cc1cc[n]cc1Cl Amb25140619 [0,1,0,0,0,0|2,0,1]=4 1419 B13R1.202 CC(O)C(=O)Cc1ccc[n]c1N Amb25037173 [0,1,0,0,0,0|2,0,1]=4 1420 B13R1.202 CC(O)C(=O)Cc1ccccc1Cl Amb25180425 [0,1,0,0,0,0|1,0,1]=3 1421 B13R1.202 CC(O)C(=O)Cc1ccccc1F Amb24496472 [0,1,0,0,0,0|1,0,1]=3 1422 B13R1.202 CC(O)C(=O)Nc1ccccc1O Amb24455783 [0,1,0,0,0,0|2,0,1]=4 1423 B13R1.202 CC(O)C(=O)Oc1ccccc1Br Amb24703827 [0,1,0,0,0,0|2,0,1]=4 1424 B13R1.202 CC(O)C(=O)Oc1ccccc1I Amb25167397 [0,1,0,0,0,0|2,0,1]=4 1425 B13R1.202 CC(Sc1ccccc1O)C(O)=O Amb18984793 [0,1,0,0,0,0|2,0,1]=4 1426 B13R1.202 CN(C)C(=O)Cc1ccccc1Br Amb22001119 [0,1,0,0,0,0|3,0,0]=4 1427 B13R1.202 CN(Cc1ccccc1Br)C(=O)Cl Amb24641133 [0,1,0,0,0,0|3,0,0]=4 1428 B13R1.202 CN(Cc1ccccc1Br)C(N)=O Amb25785330 [0,1,0,0,0,0|3,0,0]=4 1429 B13R1.202 CN(Cc1ccccc1Cl)C(=O)Cl Amb25857704 [0,1,0,0,0,0|3,0,0]=4 1430 B13R1.202 CN(Cc1ccccc1Cl)C(N)=O Amb18332179 [0,1,0,0,0,0|3,0,0]=4 1431 B13R1.202 CN(Cc1ccccc1F)C(N)=O Amb18187071 [0,1,0,0,0,0|3,0,0]=4 1432 B13R1.202 CN(Cc1ccccc1O)C(N)=O Amb24387696 [0,1,0,0,0,0|3,0,0]=4 1433 B13R1.202 CN(O)C(=O)Cc1ccccc1Cl Amb22434674 [0,1,0,0,0,0|2,0,0]=3 1434 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1Cl Amb25818034 [0,1,0,0,0,0|2,0,1]=4 1435 B13R1.202 C[C@@H](O)C(=O)Nc1ccccc1I Amb25092525 [0,1,0,0,0,0|2,0,1]=4 1436 B13R1.202 C[C@@H](O)C(=O)Oc1ccccc1Br Amb25093332 [0,1,0,0,0,0|2,0,1]=4 1437 B13R1.202 C[C@@H](O)C(=O)Oc1ccccc1I Amb24347460 [0,1,0,0,0,0|2,0,1]=4 1438 B13R1.202 C[C@@H](Oc1ccccc1Br)C(O)=O Amb25156999 [0,1,0,0,0,0|2,0,1]=4 1439 B13R1.202 C[C@@H](Oc1ccccc1I)C(O)=O Amb22746581 [0,1,0,0,0,0|2,0,1]=4 1440 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1F Amb25749604 [0,1,0,0,0,0|2,0,1]=4 1441 B13R1.202 C[C@H](O)C(=O)Nc1ccccc1I Amb25797067 [0,1,0,0,0,0|2,0,1]=4 1442 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1Cl Amb25032718 [0,1,0,0,0,0|2,0,1]=4 1443 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1F Amb25145260 [0,1,0,0,0,0|2,0,1]=4 1444 B13R1.202 C[C@H](O)C(=O)Oc1ccccc1I Amb25829837 [0,1,0,0,0,0|2,0,1]=4 1445 B13R1.202 C[C@H](Oc1ccccc1Br)C(O)=O Amb25775704 [0,1,0,0,0,0|2,0,1]=4 1446 B13R1.202 C[C@H](Oc1ccccc1Cl)C(O)=O Amb24434851 [0,1,0,0,0,0|2,0,1]=4 1447 B13R1.202 C[C@H](Oc1ccccc1I)C(O)=O Amb25783514 [0,1,0,0,0,0|2,0,1]=4 1448 B13R1.202 C\C(=C/c1c[n]ccc1N)\C(O)=O Amb25762504 [0,1,0,0,0,0|2,0,1]=4 1449 B13R1.202 C\C(=C/c1ccccc1Br)\C(C)=O Amb25365894 [0,1,0,0,0,0|2,0,1]=4 1450 B13R1.202 C\C(=C/c1ccccc1C)\C(C)=O Amb25034275 [0,1,0,0,0,0|2,0,1]=4 1451 B13R1.202 C\C(=C/c1ccccc1Cl)\C(C)=O Amb25764101 [0,1,0,0,0,0|2,0,1]=4 1452 B13R1.202 C\C(=C/c1ccccc1F)\C(C)=O Amb25212780 [0,1,0,0,0,0|2,0,1]=4 1453 B13R1.202 C\C(=C/c1ccccc1I)\C(O)=O Amb25755911 [0,1,0,0,0,0|1,0,1]=3 1454 B13R1.202 C\C(=C/c1ccccc1N)\C(C)=O Amb24678150 [0,1,0,0,0,0|2,0,1]=4 1455 B13R1.202 C\C(=C/c1ccccc1O)\C(C)=O Amb24449768 [0,1,0,0,0,0|2,0,1]=4 1456 B13R1.202 C\C(=C\c1c[n]ccc1N)\C(O)=O Amb25349470 [0,1,0,0,0,0|2,0,1]=4 1457 B13R1.202 C\C(=C\c1ccccc1Cl)\C(O)=O Amb25696241 [0,1,0,0,0,0|1,0,1]=3 1458 B13R1.202 C\C(=C\c1ccccc1O)\C(O)=O Amb24710649 [0,1,0,0,0,0|1,0,1]=3 1459 B13R1.202 C\C(=N/c1ccccc1O)\C(C)=O Amb24614739 [0,1,0,0,0,0|3,0,0]=4 1460 B13R1.202 C\C(=N\c1ccccc1C)\C(O)=O Amb24567996 [0,1,0,0,0,0|2,0,0]=3 1461 B13R1.202 Cc1[n]cccc1CC(C)C(O)=O Amb25773491 [0,1,0,0,0,0|2,0,1]=4 1462 B13R1.202 Cc1c[n]ccc1C[C@@H](N)C(O)=O Amb25063835 [0,1,0,0,0,0|2,0,1]=4 1463 B13R1.202 Cc1c[n]ccc1C[C@H](N)C(O)=O Amb24390165 [0,1,0,0,0,0|2,0,1]=4 1464 B13R1.202 Cc1c[n]ccc1NC(=O)C(O)=O Amb24376542 [0,1,0,0,0,0|2,0,0]=3 1465 B13R1.202 Cc1c[n]ccc1\C=C(\C)/C(O)=O Amb24583338 [0,1,0,0,0,0|2,0,1]=4 1466 B13R1.202 Cc1c[n]ccc1\C=C(\F)/C(O)=O Amb24570665 [0,1,0,0,0,0|2,0,1]=4 1467 B13R1.202 Cc1cc[n]cc1CC(C)C(O)=O Amb25696863 [0,1,0,0,0,0|2,0,1]=4 1468 B13R1.202 Cc1cc[n]cc1CC(F)C(O)=O Amb25691783 [0,1,0,0,0,0|2,0,1]=4 1469 B13R1.202 Cc1cc[n]cc1C[C@@H](N)C(O)=O Amb25160627 [0,1,0,0,0,0|2,0,1]=4 1470 B13R1.202 Cc1cc[n]cc1C[C@H](N)C(O)=O Amb25791119 [0,1,0,0,0,0|2,0,1]=4 1471 B13R1.202 Cc1cc[n]cc1NC(=O)C(N)=O Amb25032916 [0,1,0,0,0,0|3,0,0]=4 1472 B13R1.202 Cc1cc[n]cc1\C=C(\F)/C(O)=O Amb25083878 [0,1,0,0,0,0|2,0,1]=4 1473 B13R1.202 Cc1ccc[n]c1C[C@@H](N)C(O)=O Amb19149167 [0,1,0,0,0,0|2,0,1]=4 1474 B13R1.202 Cc1ccc[n]c1C[C@H](N)C(O)=O Amb24727924 [0,1,0,0,0,0|2,0,1]=4 1475 B13R1.202 Cc1ccccc1CC(=O)C(C)O Amb25821919 [0,1,0,0,0,0|1,0,1]=3 1476 B13R1.202 Cc1ccccc1CC(=O)C(F)F Amb19057398 [0,1,0,0,0,0|2,0,1]=4 1477 B13R1.202 Cc1ccccc1CC(Br)C(C)=O Amb25154824 [0,1,0,0,0,0|2,0,1]=4 1478 B13R1.202 Cc1ccccc1CC(Br)C(N)=O Amb25807893 [0,1,0,0,0,0|2,0,1]=4 1479 B13R1.202 Cc1ccccc1CC(Br)C(O)=O Amb23320597 [0,1,0,0,0,0|1,0,1]=3 1480 B13R1.202 Cc1ccccc1CC(C)C(N)=O Amb25363287 [0,1,0,0,0,0|2,0,1]=4 1481 B13R1.202 Cc1ccccc1CC(F)C(O)=O Amb24371582 [0,1,0,0,0,0|1,0,1]=3 1482 B13R1.202 Cc1ccccc1CC(S)C(O)=O Amb18968267 [0,1,0,0,0,0|0,1,1]=3 1483 B13R1.202 Cc1ccccc1CN(C)C(N)=O Amb18186203 [0,1,0,0,0,0|3,0,0]=4 1484 B13R1.202 Cc1ccccc1C[C@@H](N)C(O)=O Amb22745584 [0,1,0,0,0,0|1,0,1]=3 1485 B13R1.202 Cc1ccccc1C[C@@H](O)C(O)=O Amb24355345 [0,1,0,0,0,0|0,0,2]=3 1486 B13R1.202 Cc1ccccc1C[C@H](N)C(O)=O Amb22262944 [0,1,0,0,0,0|1,0,1]=3 1487 B13R1.202 Cc1ccccc1C[C@H](O)C(O)=O Amb24726327 [0,1,0,0,0,0|0,0,2]=3 1488 B13R1.202 Cc1ccccc1NC(=N)C(O)=O Amb25210557 [0,1,0,0,0,0|2,0,0]=3 1489 B13R1.202 Cc1ccccc1NC(=O)C(=O)Cl Amb25785231 [0,1,0,0,0,0|2,0,0]=3 1490 B13R1.202 Cc1ccccc1NC(=O)C(C)=C Amb25123849 [0,1,0,0,0,0|3,0,0]=4 1491 B13R1.202 Cc1ccccc1NC(=O)[C@@H](C)O Amb25145202 [0,1,0,0,0,0|2,0,1]=4 1492 B13R1.202 Cc1ccccc1NC(=S)C(N)=O Amb25336075 [0,1,0,0,0,0|2,1,0]=4 1493 B13R1.202 Cc1ccccc1OC(=O)C(N)=O Amb24526596 [0,1,0,0,0,0|2,0,0]=3 1494 B13R1.202 Cc1ccccc1O[C@H](C)C(O)=O Amb25189815 [0,1,0,0,0,0|2,0,1]=4 1495 B13R1.202 Cc1ccccc1\C=C(/S)\C(O)=O Amb24115487 [0,1,0,0,0,0|0,1,1]=3 1496 B13R1.202 NC(=O)C(=O)Nc1ccccc1Cl Amb1014777 [0,1,0,0,0,0|2,0,0]=3 1497 B13R1.202 NC(=O)C(=O)Nc1ccccc1O Amb24390881 [0,1,0,0,0,0|2,0,0]=3 1498 B13R1.202 NC(=O)C(=S)Nc1ccccc1Br Amb24705581 [0,1,0,0,0,0|2,1,0]=4 1499 B13R1.202 NC(=O)C(=S)Nc1ccccc1Cl Amb25350427 [0,1,0,0,0,0|2,1,0]=4 1500 B13R1.202 NC(=O)C(=S)Nc1ccccc1F Amb25158341 [0,1,0,0,0,0|2,1,0]=4 1501 B13R1.202 NC(=O)C(Br)Cc1ccccc1Br Amb24736819 [0,1,0,0,0,0|2,0,1]=4 1502 B13R1.202 NC(=O)C(Br)Cc1ccccc1Cl Amb25233847 [0,1,0,0,0,0|2,0,1]=4 1503 B13R1.202 NC(=O)C(Br)Cc1ccccc1F Amb24665254 [0,1,0,0,0,0|2,0,1]=4 1504 B13R1.202 NC(=O)C(Br)Cc1ccccc1I Amb25156078 [0,1,0,0,0,0|2,0,1]=4 1505 B13R1.202 NC(=O)C(Cc1ccccc1Br)Cl Amb17204831 [0,1,0,0,0,0|2,0,1]=4 1506 B13R1.202 NC(=O)C(Cc1ccccc1C)Cl Amb17204371 [0,1,0,0,0,0|2,0,1]=4 1507 B13R1.202 NC(=O)C(Cc1ccccc1Cl)Cl Amb17204473 [0,1,0,0,0,0|2,0,1]=4 1508 B13R1.202 NC(=O)C(Cc1ccccc1F)Cl Amb17204394 [0,1,0,0,0,0|2,0,1]=4 1509 B13R1.202 NC(=O)C(N)Cc1ccccc1Cl Amb25239223 [0,1,0,0,0,0|2,0,1]=4 1510 B13R1.202 NC(=O)C(O)Cc1ccccc1Cl Amb24425547 [0,1,0,0,0,0|1,0,2]=4 1511 B13R1.202 NC(=S)C(=O)Nc1ccccc1C Amb1105756 [0,1,0,0,0,0|2,1,0]=4 1512 B13R1.202 NC(Cc1[n]cccc1Br)C(O)=O Amb25732428 [0,1,0,0,0,0|2,0,1]=4 1513 B13R1.202 NC(Cc1[n]cccc1Cl)C(O)=O Amb25778279 [0,1,0,0,0,0|2,0,1]=4 1514 B13R1.202 NC(Cc1[n]cccc1F)C(O)=O Amb24700457 [0,1,0,0,0,0|2,0,1]=4 1515 B13R1.202 NC(Cc1c[n]ccc1Br)C(O)=O Amb24697543 [0,1,0,0,0,0|2,0,1]=4 1516 B13R1.202 NC(Cc1cc[n]cc1O)C(O)=O Amb25703073 [0,1,0,0,0,0|2,0,1]=4 1517 B13R1.202 NC(Cc1ccccc1Cl)C(O)=O Amb22723318 [0,1,0,0,0,0|1,0,1]=3 1518 B13R1.202 N[C@@H](Cc1c[n]ccc1Br)C(O)=O Amb24342447 [0,1,0,0,0,0|2,0,1]=4 1519 B13R1.202 N[C@@H](Cc1cc[n]cc1Cl)C(O)=O Amb24655759 [0,1,0,0,0,0|2,0,1]=4 1520 B13R1.202 N[C@@H](Cc1cc[n]cc1F)C(O)=O Amb25836888 [0,1,0,0,0,0|2,0,1]=4 1521 B13R1.202 N[C@@H](Cc1cc[n]cc1O)C(O)=O Amb25789561 [0,1,0,0,0,0|2,0,1]=4 1522 B13R1.202 N[C@@H](Cc1ccc[n]c1Br)C(O)=O Amb24669163 [0,1,0,0,0,0|2,0,1]=4 1523 B13R1.202 N[C@@H](Cc1ccc[n]c1Cl)C(O)=O Amb25691465 [0,1,0,0,0,0|2,0,1]=4 1524 B13R1.202 N[C@@H](Cc1ccc[n]c1F)C(O)=O Amb25843771 [0,1,0,0,0,0|2,0,1]=4 1525 B13R1.202 N[C@@H](Cc1ccccc1Cl)C(O)=O Amb19930753 [0,1,0,0,0,0|1,0,1]=3 1526 B13R1.202 N[C@@H](Cc1ccccc1F)C(O)=O Amb22747108 [0,1,0,0,0,0|1,0,1]=3 1527 B13R1.202 N[C@@H](Cc1ccccc1I)C(O)=O Amb22228856 [0,1,0,0,0,0|1,0,1]=3 1528 B13R1.202 N[C@@H](Cc1ccccc1O)C(O)=O Amb23440357 [0,1,0,0,0,0|1,0,1]=3 1529 B13R1.202 N[C@@H](Cc1ccccc1S)C(O)=O Amb24535355 [0,1,0,0,0,0|1,0,1]=3 1530 B13R1.202 N[C@H](Cc1[n]cccc1F)C(O)=O Amb24670299 [0,1,0,0,0,0|2,0,1]=4 1531 B13R1.202 N[C@H](Cc1ccc[n]c1S)C(O)=O Amb24657292 [0,1,0,0,0,0|2,0,1]=4 1532 B13R1.202 N[C@H](Cc1ccccc1Cl)C(O)=O Amb19930752 [0,1,0,0,0,0|1,0,1]=3 1533 B13R1.202 N[C@H](Cc1ccccc1I)C(O)=O Amb22228855 [0,1,0,0,0,0|1,0,1]=3 1534 B13R1.202 N\C(=C\c1cc[n]cc1F)\C(O)=O Amb24644675 [0,1,0,0,0,0|2,0,1]=4 1535 B13R1.202 N\C(=C\c1ccccc1F)\C(O)=O Amb24353633 [0,1,0,0,0,0|1,0,1]=3 1536 B13R1.202 Nc1[n]cccc1CC(O)C(O)=O Amb25346691 [0,1,0,0,0,0|1,0,2]=4 1537 B13R1.202 Nc1[n]cccc1C[C@H](N)C(O)=O Amb24700456 [0,1,0,0,0,0|2,0,1]=4 1538 B13R1.202 Nc1c[n]ccc1CC(N)C(O)=O Amb25789484 [0,1,0,0,0,0|2,0,1]=4 1539 B13R1.202 Nc1cc[n]cc1CC(N)C(O)=O Amb24460737 [0,1,0,0,0,0|2,0,1]=4 1540 B13R1.202 Nc1cc[n]cc1C[C@H](N)C(O)=O Amb25744618 [0,1,0,0,0,0|2,0,1]=4 1541 B13R1.202 Nc1ccc[n]c1CC(N)C(O)=O Amb25128056 [0,1,0,0,0,0|2,0,1]=4 1542 B13R1.202 Nc1ccc[n]c1C[C@H](N)C(O)=O Amb24399638 [0,1,0,0,0,0|2,0,1]=4 1543 B13R1.202 Nc1ccccc1CC(N)C(O)=O Amb22002697 [0,1,0,0,0,0|1,0,1]=3 1544 B13R1.202 Nc1ccccc1C[C@@H](N)C(O)=O Amb22228579 [0,1,0,0,0,0|1,0,1]=3 1545 B13R1.202 Nc1ccccc1C[C@@H](N)C(O)=O Amb22757212 [0,1,0,0,0,0|1,0,1]=3 1546 B13R1.202 Nc1ccccc1C[C@H](N)C(O)=O Amb22228581 [0,1,0,0,0,0|1,0,1]=3 1547 B13R1.202 Nc1ccccc1NC(=O)C(O)=O Amb18954495 [0,1,0,0,0,0|1,0,0]=2 1548 B13R1.202 Nc1ccccc1SC(F)C(O)=O Amb25699447 [0,1,0,0,0,0|2,0,1]=4 1549 B13R1.202 O=C(C(C)C)Cc1ccccc1C Amb17138793 [0,1,0,0,0,0|2,0,1]=4 1550 B13R1.202 O=C(C(C)C)Cc1ccccc1Cl Amb17139624 [0,1,0,0,0,0|2,0,1]=4 1551 B13R1.202 O=C(C(C)C)Cc1ccccc1F Amb17138959 [0,1,0,0,0,0|2,0,1]=4 1552 B13R1.202 O=C(C(O)C)Nc1ccccc1Br Amb17410949 [0,1,0,0,0,0|2,0,1]=4 1553 B13R1.202 O=C(C(O)C)Nc1ccccc1C Amb17400710 [0,1,0,0,0,0|2,0,1]=4 1554 B13R1.202 O=C(C(O)C)Nc1ccccc1Cl Amb17402320 [0,1,0,0,0,0|2,0,1]=4 1555 B13R1.202 O=C(C(O)C)Nc1ccccc1F Amb17400967 [0,1,0,0,0,0|2,0,1]=4 1556 B13R1.202 O=C(Cc1ccccc1Br)C(F)F Amb24342540 [0,1,0,0,0,0|2,0,1]=4 1557 B13R1.202 O=C(Cc1ccccc1Cl)C(F)F Amb25068603 [0,1,0,0,0,0|2,0,1]=4 1558 B13R1.202 O=C(Cc1ccccc1F)C(F)F Amb18324055 [0,1,0,0,0,0|2,0,1]=4 1559 B13R1.202 O=C(N(C)C)Cc1ccccc1C Amb2106656 [0,1,0,0,0,0|3,0,0]=4 1560 B13R1.202 O=C(N(C)C)Cc1ccccc1Cl Amb15739661 [0,1,0,0,0,0|3,0,0]=4 1561 B13R1.202 O=C(N(C)C)Cc1ccccc1N Amb1137686 [0,1,0,0,0,0|3,0,0]=4 1562 B13R1.202 O=C(N(O)C)Nc1ccccc1F Amb2422572 [0,1,0,0,0,0|3,0,0]=4 1563 B13R1.202 OC(=O)C(=O)Cc1[n]cccc1Br Amb24547998 [0,1,0,0,0,0|1,0,0]=2 1564 B13R1.202 OC(=O)C(=O)Cc1ccccc1C Amb1125804 [0,1,0,0,0,0|0,0,0]=1 1565 B13R1.202 OC(=O)C(=O)Cc1ccccc1Cl Amb1135873 [0,1,0,0,0,0|0,0,0]=1 1566 B13R1.202 OC(=O)C(=O)Nc1[n]cccc1Cl Amb25797108 [0,1,0,0,0,0|2,0,0]=3 1567 B13R1.202 OC(=O)C(=O)Nc1cc[n]cc1F Amb25157420 [0,1,0,0,0,0|2,0,0]=3 1568 B13R1.202 OC(=O)C(=O)Nc1ccccc1O Amb18128783 [0,1,0,0,0,0|1,0,0]=2 1569 B13R1.202 OC(=O)C(Br)Cc1ccccc1Br Amb22549389 [0,1,0,0,0,0|1,0,1]=3 1570 B13R1.202 OC(=O)C(Br)Cc1ccccc1F Amb22049841 [0,1,0,0,0,0|1,0,1]=3 1571 B13R1.202 OC(=O)C(Cc1ccccc1Br)C Amb17605816 [0,1,0,0,0,0|1,0,1]=3 1572 B13R1.202 OC(=O)C(Cc1ccccc1Br)Cl Amb17204843 [0,1,0,0,0,0|1,0,1]=3 1573 B13R1.202 OC(=O)C(Cc1ccccc1C)Cl Amb17204374 [0,1,0,0,0,0|1,0,1]=3 1574 B13R1.202 OC(=O)C(Cc1ccccc1C)O Amb17138948 [0,1,0,0,0,0|0,0,2]=3 1575 B13R1.202 OC(=O)C(Cc1ccccc1Cl)Br Amb2228490 [0,1,0,0,0,0|1,0,1]=3 1576 B13R1.202 OC(=O)C(Cc1ccccc1Cl)Cl Amb17204490 [0,1,0,0,0,0|1,0,1]=3 1577 B13R1.202 OC(=O)C(Cc1ccccc1Cl)O Amb17139822 [0,1,0,0,0,0|0,0,2]=3 1578 B13R1.202 OC(=O)C(Cc1ccccc1F)Cl Amb17204397 [0,1,0,0,0,0|1,0,1]=3 1579 B13R1.202 OC(=O)C(Cc1ccccc1F)O Amb17139079 [0,1,0,0,0,0|0,0,2]=3 1580 B13R1.202 OC(=O)C(Cc1ccccc1O)C Amb10844200 [0,1,0,0,0,0|1,0,1]=3 1581 B13R1.202 OC(=O)C(Cl)CN1C=CC=CC1=O Amb25156207 [0,1,0,0,0,0|2,0,1]=4 1582 B13R1.202 OC(=O)C(F)Oc1ccccc1Br Amb25694498 [0,1,0,0,0,0|2,0,1]=4 1583 B13R1.202 OC(=O)C(F)Oc1ccccc1I Amb25137575 [0,1,0,0,0,0|2,0,1]=4 1584 B13R1.202 OC(=O)C(F)Sc1ccccc1Br Amb24685422 [0,1,0,0,0,0|2,0,1]=4 1585 B13R1.202 OC(=O)C(F)Sc1ccccc1F Amb24759857 [0,1,0,0,0,0|2,0,1]=4 1586 B13R1.202 OC(=O)C(O)Cc1[n]cccc1Br Amb24669896 [0,1,0,0,0,0|1,0,2]=4 1587 B13R1.202 OC(=O)C(O)Cc1cc[n]cc1Cl Amb25718576 [0,1,0,0,0,0|1,0,2]=4 1588 B13R1.202 OC(=O)C(O)Cc1ccc[n]c1F Amb25266041 [0,1,0,0,0,0|1,0,2]=4 1589 B13R1.202 OC(=O)C(Oc1ccccc1F)C Amb1115526 [0,1,0,0,0,0|2,0,1]=4 1590 B13R1.202 OC(=O)C(Oc1ccccc1N)C Amb17110011 [0,1,0,0,0,0|2,0,1]=4 1591 B13R1.202 OC(=O)C(S)Cc1ccccc1Cl Amb25790557 [0,1,0,0,0,0|0,1,1]=3 1592 B13R1.202 OC(=O)C(Sc1ccccc1Br)C Amb1115761 [0,1,0,0,0,0|2,0,1]=4 1593 B13R1.202 OC(=O)C(Sc1ccccc1Cl)C Amb1126189 [0,1,0,0,0,0|2,0,1]=4 1594 B13R1.202 OC(=O)C(Sc1ccccc1F)C Amb1112319 [0,1,0,0,0,0|2,0,1]=4 1595 B13R1.202 OC(=O)C(Sc1ccccc1N)C Amb17305614 [0,1,0,0,0,0|2,0,1]=4 1596 B13R1.202 OC(=O)C([SeH])Cc1ccccc1Cl Amb24192807 [0,1,0,0,0,0|0,1,1]=3 1597 B13R1.202 OC(=O)[C@@H](Cc1ccccc1C)C Amb10844135 [0,1,0,0,0,0|1,0,1]=3 1598 B13R1.202 OC(=O)[C@@H](Cc1ccccc1Cl)C Amb10844130 [0,1,0,0,0,0|1,0,1]=3 1599 B13R1.202 OC(=O)[C@@H](Nc1ccccc1C)C Amb16231747 [0,1,0,0,0,0|2,0,1]=4 1600 B13R1.202 OC(=O)[C@@H](O)Cc1ccccc1Cl Amb24469361 [0,1,0,0,0,0|0,0,2]=3 1601 B13R1.202 OC(=O)[C@@H](O)Cc1ccccc1F Amb25708392 [0,1,0,0,0,0|0,0,2]=3 1602 B13R1.202 OC(=O)[C@H](Cc1ccccc1C)C Amb10844136 [0,1,0,0,0,0|1,0,1]=3 1603 B13R1.202 OC(=O)[C@H](Cc1ccccc1Cl)C Amb10844213 [0,1,0,0,0,0|1,0,1]=3 1604 B13R1.202 OC(=O)\C(=C/c1ccccc1Cl)\S Amb2550971 [0,1,0,0,0,0|0,1,1]=3 1605 B13R1.202 OC(=O)\C(\Cl)=C\c1ccccc1Cl Amb25063158 [0,1,0,0,0,0|1,0,1]=3 1606 B13R1.202 OC(=O)\C(\F)=C\c1ccccc1Cl Amb25256125 [0,1,0,0,0,0|1,0,1]=3 1607 B13R1.202 OC(=O)\C(\S)=C\c1ccccc1Cl Amb18657758 [0,1,0,0,0,0|0,1,1]=3 1608 B13R1.202 OC(=O)\C(\S)=C\c1ccccc1F Amb24495340 [0,1,0,0,0,0|0,1,1]=3 1609 B13R1.202 OS(=O)C(=N)Nc1ccccc1O Amb17595301 [0,1,0,0,0,0|3,0,0]=4 1610 B13R1.202 Oc1ccccc1CC(Cl)C(O)=O Amb25819837 [0,1,0,0,0,0|1,0,1]=3 1611 B13R1.202 Oc1ccccc1CC(F)C(O)=O Amb24518926 [0,1,0,0,0,0|1,0,1]=3 1612 B13R1.202 Oc1ccccc1CC(O)C(O)=O Amb24692674 [0,1,0,0,0,0|0,0,2]=3 1613 B13R1.202 Oc1ccccc1CC(S)C(O)=O Amb25805650 [0,1,0,0,0,0|0,1,1]=3 1614 B13R1.202 Oc1ccccc1C[C@H](O)C(O)=O Amb25065347 [0,1,0,0,0,0|0,0,2]=3 1615 B13R1.202 Oc1ccccc1\C=C(/Cl)\C(O)=O Amb25701738 [0,1,0,0,0,0|1,0,1]=3 1616 B13R1.353 C=C(Cc1ccccc1)S(O)(=O)=O Amb22364611 [0,1,0,0,0,0|2,0,0]=3 1617 B13R1.353 C=C(Cc1ccccc1)S([O-])(=O)=O Amb22364583 [0,1,0,0,0,0|2,0,1]=4 1618 B13R1.353 CC(C)(F)C(=O)Cc1ccccc1 Amb25303744 [0,1,0,0,0,0|2,0,1]=4 1619 B13R1.353 CC(C)(N)C(=O)Cc1ccccc1 Amb18195906 [0,1,0,0,0,0|2,0,1]=4 1620 B13R1.353 CC(C)(O)C(=O)Cc1cc[n]cc1 Amb25761787 [0,1,0,0,0,0|2,0,1]=4 1621 B13R1.353 CC(C)(O)C(=O)Cc1ccc[n]c1 Amb24496208 [0,1,0,0,0,0|2,0,1]=4 1622 B13R1.353 CC(F)(F)C(=O)Cc1ccccc1 Amb24715115 [0,1,0,0,0,0|2,0,1]=4 1623 B13R1.353 CC(O)(O)C(=O)Nc1ccccc1 Amb24490411 [0,1,0,0,0,0|1,0,2]=4 1624 B13R1.353 CP(O)(=O)C(N)Cc1ccccc1 Amb22450960 [0,1,0,0,0,0|2,0,1]=4 1625 B13R1.353 NC(Cc1ccccc1)S(O)(=O)=O Amb25103708 [0,1,0,0,0,0|2,0,1]=4 1626 B13R1.353 N[C@@H](P(=O)(O)O)Cc1ccccc1 Amb10069963 [0,1,0,0,0,0|2,0,1]=4 1627 B13R1.353 N[C@H](P(=O)(O)O)Cc1ccccc1 Amb10069962 [0,1,0,0,0,0|2,0,1]=4 1628 B13R1.353 N\C(=N/c1ccccc1)\S(O)(=O)=O Amb24399284 [0,1,0,0,0,0|3,0,0]=4 1629 B13R1.353 O=C(C(O)(C)C)Cc1ccccc1 Amb10562690 [0,1,0,0,0,0|1,0,1]=3 1630 B13R1.353 O=C(C(O)(C)C)Nc1ccccc1 Amb10566125 [0,1,0,0,0,0|2,0,1]=4 1631 B13R1.353 O=C(Cc1ccccc1)C(F)(F)Br Amb25725768 [0,1,0,0,0,0|2,0,1]=4 1632 B13R1.353 O=C(Cc1ccccc1)[B-](F)(F)F Amb25665052 [0,1,0,0,0,0|3,0,0]=4 1633 B13R1.353 O=C([Si](C)(C)C)Cc1ccccc1 Amb10564106 [0,1,0,0,0,0|2,1,0]=4 1634 B13R1.353 OS(=O)(=O)\C(\Cl)=C\c1ccccc1 Amb22364621 [0,1,0,0,0,0|2,0,1]=4 1635 B13R1.353 OS(=O)(=O)\C(\Cl)=C\c1ccccc1 Amb25339745 [0,1,0,0,0,0|2,0,1]=4 1636 B13R1.418 C=CC(Nc1ccccc1)C(O)=O Amb24361245 [0,1,0,0,0,0|2,0,1]=4 1637 B13R1.418 C=C\C(=C/c1ccccc1)\C(O)=O Amb18127222 [0,1,0,0,0,0|1,0,1]=3 1638 B13R1.418 CC(=O)C(=[N+]=[N-])Cc1ccccc1 Amb17594403 [0,1,0,0,0,0|2,0,0]=3 1639 B13R1.418 CC(=O)C(Cc1ccccc1)=CN Amb17777847 [0,1,0,0,0,0|2,0,0]=3 1640 B13R1.418 CC(=O)C(Cc1ccccc1)C#N Amb24492583 [0,1,0,0,0,0|2,0,1]=4 1641 B13R1.418 CC(=O)\C(=C/C)\Oc1ccccc1 Amb25179538 [0,1,0,0,0,0|3,0,0]=4 1642 B13R1.418 CC(=O)\C(=C/c1ccccc1)\OC Amb24588864 [0,1,0,0,0,0|1,0,2]=4 1643 B13R1.418 CC(=O)\C(=C\C)\Nc1ccccc1 Amb24653578 [0,1,0,0,0,0|3,0,0]=4 1644 B13R1.418 CC(=O)\C(=C\O)\Sc1ccccc1 Amb25796355 [0,1,0,0,0,0|2,0,1]=4 1645 B13R1.418 CC(=O)\C(\C=C)=C\c1ccccc1 Amb25713046 [0,1,0,0,0,0|2,0,1]=4 1646 B13R1.418 CC(=O)\C(\CC)=C/c1ccccc1 Amb25034468 [0,1,0,0,0,0|2,0,1]=4 1647 B13R1.418 CC(=O)\C(\CC)=C\c1ccccc1 Amb25285770 [0,1,0,0,0,0|2,0,1]=4 1648 B13R1.418 CC(=O)\C(\CC)=N/c1ccccc1 Amb24614688 [0,1,0,0,0,0|3,0,0]=4 1649 B13R1.418 CC(=O)\C(\CC)=N\c1ccccc1 Amb24559130 [0,1,0,0,0,0|3,0,0]=4 1650 B13R1.418 CC(=O)\C(\CO)=C\c1ccccc1 Amb24469181 [0,1,0,0,0,0|1,0,2]=4 1651 B13R1.418 CC(=O)\C(\Cc1c[n]ccc1)=N/O Amb24492640 [0,1,0,0,0,0|2,0,1]=4 1652 B13R1.418 CC(=O)\C(\Cc1c[n]ccc1)=N\O Amb24600996 [0,1,0,0,0,0|2,0,1]=4 1653 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C/[O-] Amb21947890 [0,1,0,0,0,0|1,0,1]=3 1654 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C/[O-] Amb21947891 [0,1,0,0,0,0|1,0,1]=3 1655 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\C Amb24364205 [0,1,0,0,0,0|2,0,0]=3 1656 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\N Amb25273959 [0,1,0,0,0,0|2,0,0]=3 1657 B13R1.418 CC(=O)\C(\Cc1ccccc1)=C\O Amb24752497 [0,1,0,0,0,0|1,0,1]=3 1658 B13R1.418 CC(=O)\C(\Cc1ccccc1)=N\O Amb24620100 [0,1,0,0,0,0|1,0,1]=3 1659 B13R1.418 CC(=O)\C(\Nc1ccccc1)=N\O Amb24540818 [0,1,0,0,0,0|2,0,1]=4 1660 B13R1.418 CC(C)=C(C=O)Sc1ccccc1 Amb18651322 [0,1,0,0,0,0|3,0,0]=4 1661 B13R1.418 CC(C)=C(Cc1ccccc1)C=O Amb24419788 [0,1,0,0,0,0|2,0,0]=3 1662 B13R1.418 CC(O)C(Cc1ccccc1)=C=C Amb24495404 [0,1,0,0,0,0|2,0,1]=4 1663 B13R1.418 CC(O)\C(\C=O)=C/c1ccccc1 Amb25767847 [0,1,0,0,0,0|1,0,2]=4 1664 B13R1.418 CC(O)\C(\C=O)=C\c1ccccc1 Amb25264847 [0,1,0,0,0,0|1,0,2]=4 1665 B13R1.418 CCC(C(=O)C)Cc1ccccc1 Amb17233201 [0,1,0,0,0,0|2,0,1]=4 1666 B13R1.418 CCN(C(=O)Cl)Cc1ccccc1 Amb17563084 [0,1,0,0,0,0|3,0,0]=4 1667 B13R1.418 CC\C(=C/c1ccccc1)\C(N)=O Amb24634133 [0,1,0,0,0,0|2,0,1]=4 1668 B13R1.418 CC\C(=C\c1ccccc1)\C(O)=O Amb24702993 [0,1,0,0,0,0|1,0,1]=3 1669 B13R1.418 CN[C@@H](C(=O)O)Cc1ccccc1 Amb16183857 [0,1,0,0,0,0|1,0,1]=3 1670 B13R1.418 CN[C@@H](Cc1ccccc1)C(O)=O Amb22744994 [0,1,0,0,0,0|1,0,1]=3 1671 B13R1.418 CN[C@H](C(=O)O)Cc1ccccc1 Amb10604038 [0,1,0,0,0,0|1,0,1]=3 1672 B13R1.418 COC(Cc1ccccc1)C(O)=O Amb18128650 [0,1,0,0,0,0|0,0,2]=3 1673 B13R1.418 CON(Cc1ccccc1)C(=O)Cl Amb24564167 [0,1,0,0,0,0|2,0,1]=4 1674 B13R1.418 CON(Cc1ccccc1)C(N)=O Amb24529724 [0,1,0,0,0,0|2,0,1]=4 1675 B13R1.418 CO[C@@H](Cc1ccccc1)C(O)=O Amb22747352 [0,1,0,0,0,0|0,0,2]=3 1676 B13R1.418 CO\C(=C/c1ccccc1)\C(=O)O Amb1945718 [0,1,0,0,0,0|0,0,2]=3 1677 B13R1.418 CS\C(=C/c1ccccn1)\C(=O)O Amb1761007 [0,1,0,0,0,0|1,1,1]=4 1678 B13R1.418 CS\C(=C/c1cccnc1)\C(=O)O Amb1761008 [0,1,0,0,0,0|1,1,1]=4 1679 B13R1.418 CS\C(=C/c1ccncc1)\C(=O)O Amb1761006 [0,1,0,0,0,0|1,1,1]=4 1680 B13R1.418 CS\C(=C\c1c[n]ccc1)\C(O)=O Amb22455522 [0,1,0,0,0,0|1,1,1]=4 1681 B13R1.418 CS\C(=C\c1ccccc1)\C(O)=O Amb18130097 [0,1,0,0,0,0|0,1,1]=3 1682 B13R1.418 C[C@H](O)C(Cc1ccccc1)=C=C Amb25236568 [0,1,0,0,0,0|2,0,1]=4 1683 B13R1.418 C\C(\Cl)=C(\Cc1ccccc1)/C=O Amb25759081 [0,1,0,0,0,0|2,0,0]=3 1684 B13R1.418 C\C(\N)=C(\Cc1ccccc1)/C#N Amb25264958 [0,1,0,0,0,0|3,0,0]=4 1685 B13R1.418 C\C=C(/Sc1ccccc1)\C(O)=O Amb18651957 [0,1,0,0,0,0|2,0,0]=3 1686 B13R1.418 C\C=C(\Cc1ccccc1)/C(N)=O Amb25268913 [0,1,0,0,0,0|2,0,0]=3 1687 B13R1.418 C\C=C(\Cc1ccccc1)/C(O)=O Amb24711241 [0,1,0,0,0,0|1,0,0]=2 1688 B13R1.418 C\C=C(\Cc1ccccc1)/[N+]([O-])=O Amb25198565 [0,1,0,0,0,0|2,0,1]=4 1689 B13R1.418 N#CC(=Cc1ccccc1)C(=O)Cl Amb17143094 [0,1,0,0,0,0|2,0,1]=4 1690 B13R1.418 N#CC(=Cc1ccccc1)C(=O)O Amb17224284 [0,1,0,0,0,0|1,0,1]=3 1691 B13R1.418 N#CC(C(=O)O)Cc1ccccn1 Amb17090107 [0,1,0,0,0,0|2,0,1]=4 1692 B13R1.418 N#CC(C(=O)O)Cc1cccnc1 Amb17090108 [0,1,0,0,0,0|2,0,1]=4 1693 B13R1.418 N#CC(C(=O)O)Cc1ccncc1 Amb17090109 [0,1,0,0,0,0|2,0,1]=4 1694 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)Cl Amb24108099 [0,1,0,0,0,0|2,0,1]=4 1695 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)N Amb2222555 [0,1,0,0,0,0|2,0,1]=4 1696 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)O Amb1207396 [0,1,0,0,0,0|1,0,1]=3 1697 B13R1.418 N#C\C(=C/c1ccccc1)\C(=O)O Amb16205839 [0,1,0,0,0,0|1,0,1]=3 1698 B13R1.418 N#C\C(=C/c1cccnc1)\C(=O)O Amb1133348 [0,1,0,0,0,0|2,0,1]=4 1699 B13R1.418 N#C\C(=C/c1ccncc1)\C(=O)O Amb1125727 [0,1,0,0,0,0|2,0,1]=4 1700 B13R1.418 N#C\C(=C\c1cccnc1)\C(=O)O Amb10068989 [0,1,0,0,0,0|2,0,1]=4 1701 B13R1.418 NC(=O)C(Cc1ccccc1)C#N Amb18795265 [0,1,0,0,0,0|2,0,1]=4 1702 B13R1.418 NC(=O)N(Cc1ccccc1)N=O Amb24710298 [0,1,0,0,0,0|2,0,0]=3 1703 B13R1.418 NC(=O)\C(=C\Cl)\Sc1ccccc1 Amb24562909 [0,1,0,0,0,0|3,0,0]=4 1704 B13R1.418 NC(=O)\C(=N\O)\Sc1ccccc1 Amb25100934 [0,1,0,0,0,0|2,0,1]=4 1705 B13R1.418 NC(=O)\C(\Cc1ccccc1)=C\Cl Amb25300288 [0,1,0,0,0,0|2,0,0]=3 1706 B13R1.418 NC(=O)\C(\Nc1ccccc1)=N\O Amb25320278 [0,1,0,0,0,0|2,0,1]=4 1707 B13R1.418 NCC(Cc1c[n]ccc1)C(O)=O Amb19373762 [0,1,0,0,0,0|2,0,1]=4 1708 B13R1.418 NCC(Cc1cccc[n]1)C(O)=O Amb19343541 [0,1,0,0,0,0|2,0,1]=4 1709 B13R1.418 NCC(Cc1ccccc1)=C(F)F Amb25696506 [0,1,0,0,0,0|3,0,0]=4 1710 B13R1.418 NCC(Cc1ccccc1)C(O)=O Amb19148058 [0,1,0,0,0,0|1,0,1]=3 1711 B13R1.418 NCC(Nc1ccccc1)C(O)=O Amb25698485 [0,1,0,0,0,0|2,0,1]=4 1712 B13R1.418 NC[C@@H](Cc1ccccc1)C(O)=O Amb22745974 [0,1,0,0,0,0|1,0,1]=3 1713 B13R1.418 NC[C@@H](Cc1ccccc1)C(O)=O Amb22745975 [0,1,0,0,0,0|1,0,1]=3 1714 B13R1.418 NC\C(=C/c1ccccc1)\C(O)=O Amb24526933 [0,1,0,0,0,0|1,0,1]=3 1715 B13R1.418 NC\C(=C\c1cc[n]cc1)\C(O)=O Amb25322106 [0,1,0,0,0,0|2,0,1]=4 1716 B13R1.418 NO[C@@H](C(=O)O)Cc1ccccc1 Amb10070584 [0,1,0,0,0,0|0,0,2]=3 1717 B13R1.418 NO[C@H](C(=O)O)Cc1ccccc1 Amb10070583 [0,1,0,0,0,0|0,0,2]=3 1718 B13R1.418 OC(=O)C(CO)Nc1ccccc1 Amb25684833 [0,1,0,0,0,0|1,0,2]=4 1719 B13R1.418 OC(=O)\C(=C\Cl)\Oc1ccccc1 Amb24627055 [0,1,0,0,0,0|2,0,0]=3 1720 B13R1.418 OC(=O)\C(\CBr)=C\c1ccccc1 Amb22360134 [0,1,0,0,0,0|1,0,1]=3 1721 B13R1.418 OC(=O)\C(\CCl)=C\c1ccccc1 Amb24635754 [0,1,0,0,0,0|1,0,1]=3 1722 B13R1.418 OC(=O)\C(\CO)=C/c1ccccc1 Amb20671516 [0,1,0,0,0,0|0,0,2]=3 1723 B13R1.418 OC(=O)\C(\Cc1[n]ccc[n]1)=N/O Amb24429109 [0,1,0,0,0,0|2,0,1]=4 1724 B13R1.418 OC(=O)\C(\Cc1cc[n]c[n]1)=N/O Amb25060760 [0,1,0,0,0,0|2,0,1]=4 1725 B13R1.418 OC(=O)\C(\Cc1cc[n]cc1)=N/O Amb23603652 [0,1,0,0,0,0|1,0,1]=3 1726 B13R1.418 OC(=O)\C(\Cc1ccc[n]c1)=N/O Amb23603650 [0,1,0,0,0,0|1,0,1]=3 1727 B13R1.418 OC(=O)\C(\Cc1cccc[n]1)=N/O Amb23603651 [0,1,0,0,0,0|1,0,1]=3 1728 B13R1.418 OCC(Cc1ccccc1)=C(F)F Amb25792403 [0,1,0,0,0,0|2,0,1]=4 1729 B13R1.418 [NH3+]OC(Cc1ccccc1)C(O)=O Amb22471708 [0,1,0,0,0,0|0,0,2]=3 1730 B13R1.1073 CC(=O)C(C)(O)Cc1ccccc1 Amb22641853 [0,1,0,0,0,0|1,0,2]=4 1731 B13R1.1073 CC(=O)[C@](C)(N)Cc1ccccc1 Amb25732573 [0,1,0,0,0,0|2,0,1]=4 1732 B13R1.1073 CC(C)(C[n+]1ccccc1)C(O)=O Amb25326073 [0,1,0,0,0,0|2,0,1]=4 1733 B13R1.1073 CC(C)(Cc1cc[n]cc1)C(O)=O Amb18065826 [0,1,0,0,0,0|2,0,1]=4 1734 B13R1.1073 CC(C)(Cc1ccc[n]c1)C(O)=O Amb18065825 [0,1,0,0,0,0|2,0,1]=4 1735 B13R1.1073 CC(C)(Cc1cccc[n]1)C(O)=O Amb18065824 [0,1,0,0,0,0|2,0,1]=4 1736 B13R1.1073 CC(Cl)(Oc1ccccc1)C(O)=O Amb25289059 [0,1,0,0,0,0|2,0,1]=4 1737 B13R1.1073 CC(N)(Cc1ccccc1)C(N)=O Amb19001791 [0,1,0,0,0,0|2,0,1]=4 1738 B13R1.1073 CC(O)(Cc1ccccc1)C(N)=O Amb18791028 [0,1,0,0,0,0|1,0,2]=4 1739 B13R1.1073 CC(O)(Oc1ccccc1)C(O)=O Amb24563350 [0,1,0,0,0,0|1,0,2]=4 1740 B13R1.1073 CC(S)(Cc1ccccc1)C(O)=O Amb24739779 [0,1,0,0,0,0|0,1,1]=3 1741 B13R1.1073 C[C@@](O)(Cc1ccccc1)C(N)=O Amb24727083 [0,1,0,0,0,0|1,0,2]=4 1742 B13R1.1073 C[C@@](S)(Cc1ccccc1)C(O)=O Amb25697193 [0,1,0,0,0,0|0,1,1]=3 1743 B13R1.1073 C[C@](N)(Cc1ccccc1)C(N)=O Amb25108507 [0,1,0,0,0,0|2,0,1]=4 1744 B13R1.1073 NC(=O)C(Cc1ccccc1)(C)C Amb16939814 [0,1,0,0,0,0|2,0,1]=4 1745 B13R1.1073 NC(=O)C(Cl)(Cl)Cc1ccccc1 Amb25084603 [0,1,0,0,0,0|2,0,1]=4 1746 B13R1.1073 NC(=O)C(F)(F)Cc1ccccc1 Amb24440135 [0,1,0,0,0,0|2,0,1]=4 1747 B13R1.1073 NC(N)(Cc1ccccc1)C(O)=O Amb25779175 [0,1,0,0,0,0|1,0,1]=3 1748 B13R1.1073 O=C(Cl)C(F)(F)Cc1ccccc1 Amb25071235 [0,1,0,0,0,0|2,0,1]=4 1749 B13R1.1073 OC(=O)C(Cc1ccccc1)(O)C Amb10067052 [0,1,0,0,0,0|0,0,2]=3 1750 B13R1.1073 OC(=O)C(Cc1ccccn1)(N)C Amb17400758 [0,1,0,0,0,0|2,0,1]=4 1751 B13R1.1073 OC(=O)C(Cc1cccnc1)(N)C Amb17233667 [0,1,0,0,0,0|2,0,1]=4 1752 B13R1.1073 OC(=O)C(Cc1ccncc1)(N)C Amb17400763 [0,1,0,0,0,0|2,0,1]=4 1753 B13R1.1073 OC(=O)C(F)(F)Cc1cc[n]cc1 Amb24586446 [0,1,0,0,0,0|2,0,1]=4 1754 B13R1.1073 OC(=O)C(O)(O)Cc1ccccc1 Amb25100992 [0,1,0,0,0,0|0,0,2]=3 1755 B13R1.1073 OC(=O)C(S)(S)Cc1cccc[n]1 Amb25289205 [0,1,0,0,0,0|1,1,1]=4 1756 B13R1.1073 OC(=O)C(S)(S)Cc1ccccc1 Amb24087878 [0,1,0,0,0,0|0,1,1]=3 1757 B13R1.1073 OC(=O)[C@@](Cc1ccccc1)(O)C Amb10067053 [0,1,0,0,0,0|0,0,2]=3 1758 B13R2.27 O=C/1C=C\C1=C/c2ccccc2 Amb24544610 [0,0,0,1,0,0|2,0,1]=4 1759 B13R2.27 O=C/1C=C\C1=C\c2ccccc2 Amb25142591 [0,0,0,1,0,0|2,0,1]=4 1760 B13R2.27 O=C/1CC\C1=C/c2ccccc2 Amb25366584 [0,0,0,1,0,0|2,0,1]=4 1761 B13R2.27 O=C/1CS\C1=C/c2ccccc2 Amb24450518 [0,0,0,1,0,0|1,1,1]=4 1762 B13R2.27 O=C/1CS\C1=C\c2ccccc2 Amb17594489 [0,0,0,1,0,0|1,1,1]=4 1763 B13R2.27 O=C/1NC\C1=C/c2ccccc2 Amb24547036 [0,0,0,1,0,0|2,0,1]=4 1764 B13R2.27 O=C1CCN1Cc2ccccc2 Amb25117461 [0,0,0,1,0,0|3,0,0]=4 1765 B13R2.27 O=C1CC[C@@H]1Cc2ccccc2 Amb25792997 [0,0,0,1,0,0|2,0,1]=4 1766 B13R2.27 O=C1NC[C@@H]1Cc2ccccc2 Amb24711591 [0,0,0,1,0,0|2,0,1]=4 1767 B13R2.359 CC1(C)C(=O)Cc2ccccc12 Amb25751377 [0,0,0,1,0,0|2,0,1]=4 1768 B13R2.359 CC1(O)C(=O)Nc2ccccc12 Amb22059446 [0,0,0,1,0,0|2,0,1]=4 1769 B13R2.359 C[C@@]1(O)C(=O)Cc2ccccc12 Amb24341855 [0,0,0,1,0,0|1,0,1]=3 1770 B13R2.359 C[C@]1(O)C(=O)Cc2ccccc12 Amb24432232 [0,0,0,1,0,0|1,0,1]=3 1771 B13R2.359 NC1(O)C(=O)Nc2ccccc12 Amb24429071 [0,0,0,1,0,0|2,0,1]=4 1772 B13R2.359 O=C1Nc2ccccc2S1(=O)=O Amb22049660 [0,0,0,1,0,0|2,0,1]=4 1773 B13R2.359 OC1(O)C(=O)Nc2ccccc12 Amb24561080 [0,0,0,1,0,0|1,0,2]=4 1774 B13R2.369 Brc1cc2ccccc2nc1O Amb10608236 [0,0,0,1,0,0|2,0,1]=4 1775 B13R2.369 C=C1Cc2ccccc2NC1=O Amb25263953 [0,0,0,1,0,0|2,0,0]=3 1776 B13R2.369 CC1=Cc2ccccc2NC1=O Amb19115338 [0,0,0,1,0,0|2,0,1]=4 1777 B13R2.369 CC1=Cc2ccccc2OC1=O Amb20247474 [0,0,0,1,0,0|1,0,1]=3 1778 B13R2.369 CC1=Nc2ccccc2NC1=O Amb18368610 [0,0,0,1,0,0|3,0,0]=4 1779 B13R2.369 CC1Cc2ccccc2OC1=O Amb24484179 [0,0,0,1,0,0|1,0,1]=3 1780 B13R2.369 CC1Oc2ccccc2CC1=O Amb24583554 [0,0,0,1,0,0|1,0,1]=3 1781 B13R2.369 CN1Cc2ccccc2CC1=O Amb22388960 [0,0,0,1,0,0|3,0,0]=4 1782 B13R2.369 C[C@@H]1Cc2ccccc2NC1=O Amb25795819 [0,0,0,1,0,0|2,0,1]=4 1783 B13R2.369 C[C@H]1Cc2ccccc2NC1=O Amb25707457 [0,0,0,1,0,0|2,0,1]=4 1784 B13R2.369 C[C@H]1Nc2ccccc2OC1=O Amb25152544 [0,0,0,1,0,0|2,0,1]=4 1785 B13R2.369 Cc1cc2ccccc2cc1O Amb22262990 [0,0,0,1,0,0|2,0,1]=4 1786 B13R2.369 N=C1Nc2ccccc2NC1=O Amb19804517 [0,0,0,1,0,0|3,0,0]=4 1787 B13R2.369 N=C1Nc2ccccc2OC1=O Amb20053203 [0,0,0,1,0,0|2,0,0]=3 1788 B13R2.369 NC1=Cc2ccccc2NC1=O Amb18563072 [0,0,0,1,0,0|2,0,1]=4 1789 B13R2.369 NC1=Cc2ccccc2OC1=O Amb18511494 [0,0,0,1,0,0|1,0,1]=3 1790 B13R2.369 NC1=Nc2ccccc2OC1=N Amb25373848 [0,0,0,1,0,0|3,0,0]=4 1791 B13R2.369 NC1=Nc2ccccc2OC1=O Amb18645599 [0,0,0,1,0,0|2,0,0]=3 1792 B13R2.369 NC1=Nc2ccccc2SC1=O Amb25150924 [0,0,0,1,0,0|2,1,0]=4 1793 B13R2.369 NC1Cc2ccccc2OC1=O Amb18645811 [0,0,0,1,0,0|1,0,1]=3 1794 B13R2.369 NN1Cc2ccccc2CC1=O Amb18645670 [0,0,0,1,0,0|3,0,0]=4 1795 B13R2.369 N[C@H]1Cc2ccccc2NC1=O Amb25212947 [0,0,0,1,0,0|2,0,1]=4 1796 B13R2.369 Nc1cc2ccccc2[n]c1O Amb18645300 [0,0,0,1,0,0|2,0,1]=4 1797 B13R2.369 Nc1nc2ccccc2nc1O Amb1086511 [0,0,0,1,0,0|3,0,0]=4 1798 B13R2.369 O=C1Nc2c[n]ccc2NC1=O Amb18043122 [0,0,0,1,0,0|3,0,0]=4 1799 B13R2.369 O=C1Nc2ccc[n]c2NC1=O Amb19813203 [0,0,0,1,0,0|3,0,0]=4 1800 B13R2.369 O=C1Nc2ccccc2C=C1Br Amb20247010 [0,0,0,1,0,0|2,0,1]=4 1801 B13R2.369 O=C1Nc2ccccc2C=C1Cl Amb21857147 [0,0,0,1,0,0|2,0,1]=4 1802 B13R2.369 O=C1Nc2ccccc2C=C1F Amb22547229 [0,0,0,1,0,0|2,0,1]=4 1803 B13R2.369 O=C1Nc2ccccc2C=C1I Amb22263260 [0,0,0,1,0,0|2,0,1]=4 1804 B13R2.369 O=C1Nc2ccccc2CC1=O Amb24497058 [0,0,0,1,0,0|1,0,0]=2 1805 B13R2.369 O=C1Nc2ccccc2CC1Br Amb10601380 [0,0,0,1,0,0|2,0,1]=4 1806 B13R2.369 O=C1Nc2ccccc2CC1C Amb10604462 [0,0,0,1,0,0|2,0,1]=4 1807 B13R2.369 O=C1Nc2ccccc2CC1Cl Amb22739973 [0,0,0,1,0,0|2,0,1]=4 1808 B13R2.369 O=C1Nc2ccccc2CC1N Amb10975380 [0,0,0,1,0,0|2,0,1]=4 1809 B13R2.369 O=C1Nc2ccccc2CC1N Amb2196732 [0,0,0,1,0,0|2,0,1]=4 1810 B13R2.369 O=C1Nc2ccccc2N=C1Cl Amb20258737 [0,0,0,1,0,0|3,0,0]=4 1811 B13R2.369 O=C1Nc2ccccc2NC1=O Amb18545062 [0,0,0,1,0,0|2,0,0]=3 1812 B13R2.369 O=C1Nc2ccccc2NC1=S Amb19654259 [0,0,0,1,0,0|2,1,0]=4 1813 B13R2.369 O=C1Nc2ccccc2NC1=S Amb22283802 [0,0,0,1,0,0|2,1,0]=4 1814 B13R2.369 O=C1Nc2ccccc2OC1C Amb2568450 [0,0,0,1,0,0|2,0,1]=4 1815 B13R2.369 O=C1Oc2ccccc2C=C1Br Amb19655979 [0,0,0,1,0,0|1,0,1]=3 1816 B13R2.369 O=C1Oc2ccccc2C=C1Cl Amb19517278 [0,0,0,1,0,0|1,0,1]=3 1817 B13R2.369 O=C1Oc2ccccc2C=C1F Amb22547186 [0,0,0,1,0,0|1,0,1]=3 1818 B13R2.369 O=C1Oc2ccccc2CC1=O Amb22755081 [0,0,0,1,0,0|0,0,0]=1 1819 B13R2.369 O=C1Oc2ccccc2N=C1Cl Amb21858712 [0,0,0,1,0,0|2,0,0]=3 1820 B13R2.369 O=C1Oc2ccccc2NC1=O Amb19650977 [0,0,0,1,0,0|1,0,0]=2 1821 B13R2.369 O=C1Oc2ccccc2NC1C Amb17217247 [0,0,0,1,0,0|2,0,1]=4 1822 B13R2.369 O=C1Oc2ccccc2OC1=O Amb20663468 [0,0,0,1,0,0|1,0,0]=2 1823 B13R2.369 O=C1Sc2ccccc2C=C1Br Amb19886583 [0,0,0,1,0,0|1,1,1]=4 1824 B13R2.369 O=C1Sc2ccccc2C=C1Cl Amb22347336 [0,0,0,1,0,0|1,1,1]=4 1825 B13R2.369 O=C1Sc2ccccc2C=C1F Amb22641706 [0,0,0,1,0,0|1,1,1]=4 1826 B13R2.369 O=C1Sc2ccccc2CC1=O Amb24497321 [0,0,0,1,0,0|0,1,0]=2 1827 B13R2.369 O=c1[nH]c2ccccc2[nH]c1=O Amb1675756 [0,0,0,1,0,0|2,0,0]=3 1828 B13R2.369 O=c1[nH]c2ncccc2[nH]c1=O Amb1040622 [0,0,0,1,0,0|3,0,0]=4 1829 B13R2.369 O=c1[nH]c2ncccc2cc1O Amb15692187 [0,0,0,1,0,0|3,0,0]=4 1830 B13R2.369 O=c1oc2ccccc2cc1N Amb1967145 [0,0,0,1,0,0|1,0,1]=3 1831 B13R2.369 OC1=Cc2[n]cccc2NC1=O Amb24417104 [0,0,0,1,0,0|3,0,0]=4 1832 B13R2.369 OC1=Cc2c[n]ccc2NC1=O Amb25034645 [0,0,0,1,0,0|3,0,0]=4 1833 B13R2.369 OC1=Cc2ccccc2NC1=O Amb20619410 [0,0,0,1,0,0|2,0,0]=3 1834 B13R2.369 OC1=Cc2ccccc2NC1=S Amb25119288 [0,0,0,1,0,0|2,1,0]=4 1835 B13R2.369 OC1=Cc2ccccc2OC1=O Amb18511465 [0,0,0,1,0,0|0,0,2]=3 1836 B13R2.369 OC1=Nc2ccccc2OC1=O Amb22494623 [0,0,0,1,0,0|1,0,1]=3 1837 B13R2.369 OC1Cc2ccccc2NC1=O Amb22899290 [0,0,0,1,0,0|1,0,2]=4 1838 B13R2.369 OC1Cc2ccccc2OC1=O Amb25158158 [0,0,0,1,0,0|0,0,2]=3 1839 B13R2.369 O[C@@H]1Cc2ccccc2NC1=O Amb25097865 [0,0,0,1,0,0|1,0,2]=4 1840 B13R2.369 Oc1[n]c2ccccc2[n]c1Br Amb25127755 [0,0,0,1,0,0|3,0,0]=4 1841 B13R2.369 Oc1[n]c2ccccc2[n]c1Cl Amb22497412 [0,0,0,1,0,0|3,0,0]=4 1842 B13R2.369 Oc1cc2ccccc2[n]c1Br Amb18134374 [0,0,0,1,0,0|3,0,0]=4 1843 B13R2.369 Oc1cc2ccccc2[n]c1Cl Amb21963885 [0,0,0,1,0,0|3,0,0]=4 1844 B13R2.369 Oc1cc2ccccc2cc1Br Amb17596080 [0,0,0,1,0,0|2,0,1]=4 1845 B13R2.369 Oc1cc2ccccc2cc1I Amb25148790 [0,0,0,1,0,0|2,0,1]=4 1846 B13R2.369 Oc1cc2ccccc2cc1S Amb24497217 [0,0,0,1,0,0|1,1,1]=4 1847 B13R2.369 Oc1nc2ccccc2nc1F Amb2425841 [0,0,0,1,0,0|3,0,0]=4 1848 B13R2.373 C=C1C(NC1=O)c2ccccc2 Amb25770081 [0,0,0,1,0,0|2,0,0]=3 1849 B13R2.373 C=C1[C@H](NC1=O)c2ccccc2 Amb25159312 [0,0,0,1,0,0|2,0,0]=3 1850 B13R2.373 CC1C(CC1=O)c2ccccc2 Amb20668234 [0,0,0,1,0,0|2,0,1]=4 1851 B13R2.373 CC1C(NC1=O)c2ccccc2 Amb19149073 [0,0,0,1,0,0|2,0,1]=4 1852 B13R2.373 C[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25206665 [0,0,0,1,0,0|2,0,1]=4 1853 B13R2.373 C[C@H]1[C@@H](CC1=O)c2ccccc2 Amb25263638 [0,0,0,1,0,0|2,0,1]=4 1854 B13R2.373 NC1C(NC1=O)c2ccccc2 Amb18829732 [0,0,0,1,0,0|2,0,1]=4 1855 B13R2.373 NC=1C(=O)OC1c2ccccc2 Amb25360814 [0,0,0,1,0,0|1,0,1]=3 1856 B13R2.373 N[C@@H]1[C@H](NC1=O)c2ccccc2 Amb25247209 [0,0,0,1,0,0|2,0,1]=4 1857 B13R2.373 O=C1C=C(c2ccccc2)C1=O Amb22172059 [0,0,0,1,0,0|1,0,1]=3 1858 B13R2.373 O=C1CC(=C1Cl)c2ccccc2 Amb25706972 [0,0,0,1,0,0|2,0,1]=4 1859 B13R2.373 O=C1NC(C1Cl)c2ccccc2 Amb25159285 [0,0,0,1,0,0|2,0,1]=4 1860 B13R2.373 O=C1N[C@@H]([C@H]1F)c2ccccc2 Amb24513256 [0,0,0,1,0,0|2,0,1]=4 1861 B13R2.373 O=C1N[C@H]([C@@H]1F)c2ccccc2 Amb24617812 [0,0,0,1,0,0|2,0,1]=4 1862 B13R2.373 OC1C(NC1=O)c2ccccc2 Amb25272921 [0,0,0,1,0,0|1,0,2]=4 1863 B13R2.373 OC=1C(=O)CC1c2ccccc2 Amb25092955 [0,0,0,1,0,0|1,0,2]=4 1864 B13R2.373 O[C@H]1C(=O)N[C@H]1c2ccccc2 Amb17615687 [0,0,0,1,0,0|1,0,2]=4 1865 B13R2.423 CC(=O)C1OC1c2ccccc2 Amb17594030 [0,0,0,1,0,0|1,0,2]=4 1866 B13R2.423 CC(=O)[C@@H]1CC1c2ccccc2 Amb25759554 [0,0,0,1,0,0|2,0,1]=4 1867 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,0,0,1,0,0|2,0,1]=4 1868 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,0,0,1,0,0|1,0,2]=4 1869 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,0,0,1,0,0|2,0,1]=4 1870 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,0,0,1,0,0|1,0,2]=4 1871 B13R2.423 NC(=O)C1CC1c2ccccc2 Amb24709280 [0,0,0,1,0,0|2,0,1]=4 1872 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [0,0,0,1,0,0|1,0,2]=4 1873 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb25227794 [0,0,0,1,0,0|2,0,1]=4 1874 B13R2.423 NC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24512021 [0,0,0,1,0,0|2,0,1]=4 1875 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,0,0,1,0,0|2,0,1]=4 1876 B13R2.423 O=C(Cl)C1C[C@H]1c2ccccc2 Amb25835857 [0,0,0,1,0,0|2,0,1]=4 1877 B13R2.423 O=C(Cl)C1OC1c2ccccc2 Amb25275213 [0,0,0,1,0,0|1,0,2]=4 1878 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [0,0,0,1,0,0|1,0,2]=4 1879 B13R2.423 O=C(Cl)[C@H]1C[C@H]1c2ccccc2 Amb24654857 [0,0,0,1,0,0|2,0,1]=4 1880 B13R2.423 O=C(Cl)[C@H]1O[C@H]1c2ccccc2 Amb24621250 [0,0,0,1,0,0|1,0,2]=4 1881 B13R2.423 OC(=O)C1CC1c2cc[n]cc2 Amb19514911 [0,0,0,1,0,0|2,0,1]=4 1882 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2cccc[n]2 Amb25209805 [0,0,0,1,0,0|2,0,1]=4 1883 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,0,0,1,0,0|1,0,1]=3 1884 B13R2.423 OC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25299768 [0,0,0,1,0,0|2,0,1]=4 1885 B13R2.423 OC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb25216955 [0,0,0,1,0,0|0,0,2]=3 1886 B13R2.423 OC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24080018 [0,0,0,1,0,0|0,0,2]=3 1887 B13R2.423 OC(=O)[C@@H]1S[C@H]1c2ccccc2 Amb25286929 [0,0,0,1,0,0|0,1,1]=3 1888 B13R2.423 OC(=O)[C@H]1CC1c2cc[n]cc2 Amb24685293 [0,0,0,1,0,0|2,0,1]=4 1889 B13R2.423 OC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,0,0,1,0,0|1,0,1]=3 1890 B13R2.423 OC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,0,0,1,0,0|1,0,1]=3 1891 B13R2.423 OC(=O)[C@H]1O[C@H]1c2ccccc2 Amb24519473 [0,0,0,1,0,0|0,0,2]=3 1892 B13R2.423 OS(=O)C1CC1c2ccccc2 Amb24747050 [0,0,0,1,0,0|2,0,1]=4 1893 B13R2.435 CC(=O)C1=Cc2ccccc2C1 Amb17777848 [0,0,0,1,0,0|2,0,0]=3 1894 B13R2.435 CC(=O)C1Cc2c(C1)cccc2 Amb10071756 [0,0,0,1,0,0|2,0,1]=4 1895 B13R2.435 CC(=O)C1Cc2ccccc2O1 Amb23586288 [0,0,0,1,0,0|1,0,2]=4 1896 B13R2.435 CC(=O)C1Cc2ccccc2S1 Amb25771359 [0,0,0,1,0,0|1,1,1]=4 1897 B13R2.435 CC(=O)[C@H]1Cc2ccccc2O1 Amb25276988 [0,0,0,1,0,0|1,0,2]=4 1898 B13R2.435 CC(=O)c1[n]c2ccccc2o1 Amb19957805 [0,0,0,1,0,0|2,0,1]=4 1899 B13R2.435 CC(=O)c1cc2c([nH]1)cccc2 Amb10576614 [0,0,0,1,0,0|2,0,1]=4 1900 B13R2.435 CC(=O)c1cc2c(o1)cccc2 Amb1212626 [0,0,0,1,0,0|1,0,2]=4 1901 B13R2.435 CC(=O)c1nc2c(s1)cccc2 Amb1655468 [0,0,0,1,0,0|2,1,0]=4 1902 B13R2.435 ClC(=O)C1=Cc2c(C1)cccc2 Amb10553797 [0,0,0,1,0,0|2,0,0]=3 1903 B13R2.435 NC(=O)C=1Cc2ccccc2C1 Amb22227964 [0,0,0,1,0,0|2,0,0]=3 1904 B13R2.435 NC(=O)N1Cc2ccccc2C1 Amb18800622 [0,0,0,1,0,0|3,0,0]=4 1905 B13R2.435 NC(=O)c1[nH]c2ccccc2[n]1 Amb21964182 [0,0,0,1,0,0|3,0,0]=4 1906 B13R2.435 NC(=O)c1[n]c2ccccc2o1 Amb22500295 [0,0,0,1,0,0|2,0,1]=4 1907 B13R2.435 NC(=O)c1nc2c(s1)cccc2 Amb2565672 [0,0,0,1,0,0|2,1,0]=4 1908 B13R2.435 O=C(Cl)C1Cc2ccccc2N1 Amb25276516 [0,0,0,1,0,0|2,0,1]=4 1909 B13R2.435 O=C(Cl)C1Cc2ccccc2S1 Amb25101163 [0,0,0,1,0,0|1,1,1]=4 1910 B13R2.435 O=C(Cl)N1Cc2ccccc2C1 Amb24061265 [0,0,0,1,0,0|3,0,0]=4 1911 B13R2.435 O=C(Cl)[C@@H]1Cc2ccccc2N1 Amb25684645 [0,0,0,1,0,0|2,0,1]=4 1912 B13R2.435 O=C(Cl)c1[nH]c2ccccc2[n]1 Amb21961752 [0,0,0,1,0,0|3,0,0]=4 1913 B13R2.435 O=C(Cl)c1[n]c2ccccc2o1 Amb24061135 [0,0,0,1,0,0|2,0,1]=4 1914 B13R2.435 O=C(F)c1cc2ccccc2[nH]1 Amb24089088 [0,0,0,1,0,0|2,0,1]=4 1915 B13R2.435 OB(O)C=1Cc2ccccc2C1 Amb22753921 [0,0,0,1,0,0|2,0,1]=4 1916 B13R2.435 OC(=O)C1=Cc2c(C1)cccc2 Amb10553818 [0,0,0,1,0,0|1,0,0]=2 1917 B13R2.435 OC(=O)C1CN2C=CC=CC2=N1 Amb24101572 [0,0,0,1,0,0|2,0,1]=4 1918 B13R2.435 OC(=O)C1Cc2c(C1)cccc2 Amb1083109 [0,0,0,1,0,0|1,0,1]=3 1919 B13R2.435 OC(=O)C1Cc2c(N1)cccc2 Amb1914079 [0,0,0,1,0,0|1,0,1]=3 1920 B13R2.435 OC(=O)C1Cc2c(O1)cccc2 Amb1154832 [0,0,0,1,0,0|0,0,2]=3 1921 B13R2.435 OC(=O)C1Cc2c(S1)cccc2 Amb1106305 [0,0,0,1,0,0|0,1,1]=3 1922 B13R2.435 OC(=O)C1Cc2c[n]ccc2C1 Amb24113166 [0,0,0,1,0,0|2,0,1]=4 1923 B13R2.435 OC(=O)C1Cc2c[n]ccc2C1 Amb24563347 [0,0,0,1,0,0|2,0,1]=4 1924 B13R2.435 OC(=O)C1Cc2cc[n]cc2O1 Amb24654010 [0,0,0,1,0,0|1,0,2]=4 1925 B13R2.435 OC(=O)C1Cc2ccc[n]c2C1 Amb18829466 [0,0,0,1,0,0|2,0,1]=4 1926 B13R2.435 OC(=O)C1Cc2ccc[n]c2O1 Amb25276744 [0,0,0,1,0,0|1,0,2]=4 1927 B13R2.435 OC(=O)C=1Cc2ccccc2N1 Amb24078944 [0,0,0,1,0,0|1,0,0]=2 1928 B13R2.435 OC(=O)[C@@H]1Cc2ccc[n]c2C1 Amb25685295 [0,0,0,1,0,0|2,0,1]=4 1929 B13R2.435 OC(=O)[C@@H]1Cc2ccc[n]c2N1 Amb22746980 [0,0,0,1,0,0|2,0,1]=4 1930 B13R2.435 OC(=O)[C@H]1Cc2ccccc2O1 Amb25210803 [0,0,0,1,0,0|0,0,2]=3 1931 B13R2.435 OC(=O)[C@H]1Cc2ccccc2S1 Amb25783934 [0,0,0,1,0,0|0,1,1]=3 1932 B13R2.435 OC(=O)c1[nH]c2[n]cccc2[n]1 Amb18829544 [0,0,0,1,0,0|3,0,0]=4 1933 B13R2.435 OC(=O)c1[nH]c2[n]cccc2[n]1 Amb24178945 [0,0,0,1,0,0|3,0,0]=4 1934 B13R2.435 OC(=O)c1[nH]c2cc[n]cc2[n]1 Amb18829516 [0,0,0,1,0,0|3,0,0]=4 1935 B13R2.435 OC(=O)c1[nH]c2ccccc2[n]1 Amb22499360 [0,0,0,1,0,0|2,0,0]=3 1936 B13R2.435 OC(=O)c1[n]c2[n]cccc2[s]1 Amb22490341 [0,0,0,1,0,0|2,1,0]=4 1937 B13R2.435 OC(=O)c1[n]c2[n]cccc2o1 Amb18829106 [0,0,0,1,0,0|2,0,1]=4 1938 B13R2.435 OC(=O)c1[n]c2c[n]ccc2[s]1 Amb24100066 [0,0,0,1,0,0|2,1,0]=4 1939 B13R2.435 OC(=O)c1[n]c2cc[n]cc2[s]1 Amb22728609 [0,0,0,1,0,0|2,1,0]=4 1940 B13R2.435 OC(=O)c1[n]c2ccc[n]c2[s]1 Amb22499596 [0,0,0,1,0,0|2,1,0]=4 1941 B13R2.435 OC(=O)c1[n]c2ccc[n]c2o1 Amb25053322 [0,0,0,1,0,0|2,0,1]=4 1942 B13R2.435 OC(=O)c1[n]c2cccc[n]2[n]1 Amb21962231 [0,0,0,1,0,0|3,0,0]=4 1943 B13R2.435 OC(=O)c1c[n]2ccccc2[n]1 Amb19514889 [0,0,0,1,0,0|2,0,1]=4 1944 B13R2.435 OC(=O)c1c[n]2ccccc2[n]1 Amb22587715 [0,0,0,1,0,0|2,0,1]=4 1945 B13R2.435 OC(=O)c1cc2[nH]cccc2[n]1 Amb25816404 [0,0,0,1,0,0|2,0,1]=4 1946 B13R2.435 OC(=O)c1cc2c([nH]1)cccc2 Amb1211920 [0,0,0,1,0,0|1,0,1]=3 1947 B13R2.435 OC(=O)c1cc2c([nH]1)cncc2 Amb16233678 [0,0,0,1,0,0|2,0,1]=4 1948 B13R2.435 OC(=O)c1cc2c([nH]1)nccc2 Amb1141884 [0,0,0,1,0,0|2,0,1]=4 1949 B13R2.435 OC(=O)c1cc2c(o1)cccc2 Amb1203290 [0,0,0,1,0,0|0,0,2]=3 1950 B13R2.435 OC(=O)c1cc2c[n]ccc2[s]1 Amb18648240 [0,0,0,1,0,0|1,1,1]=4 1951 B13R2.435 OC(=O)c1cc2c[n]ccc2o1 Amb18645761 [0,0,0,1,0,0|1,0,2]=4 1952 B13R2.435 OC(=O)c1cc2cc[n]cc2[nH]1 Amb24179200 [0,0,0,1,0,0|2,0,1]=4 1953 B13R2.435 OC(=O)c1cc2cc[n]cc2[s]1 Amb18824745 [0,0,0,1,0,0|1,1,1]=4 1954 B13R2.435 OC(=O)c1cc2cc[n]cc2o1 Amb18645760 [0,0,0,1,0,0|1,0,2]=4 1955 B13R2.435 OC(=O)c1cc2ccc[n]c2[nH]1 Amb21857766 [0,0,0,1,0,0|2,0,1]=4 1956 B13R2.435 OC(=O)c1cc2n(n1)cccc2 Amb2235996 [0,0,0,1,0,0|2,0,1]=4 1957 B13R2.435 OC(=O)c1cc2ncccc2o1 Amb17774703 [0,0,0,1,0,0|1,0,2]=4 1958 B13R2.435 OC(=O)c1nc2c([nH]1)cccc2 Amb17622300 [0,0,0,1,0,0|2,0,0]=3 1959 B13R2.435 OC(=O)c1nc2c([nH]1)cccc2 Amb1797073 [0,0,0,1,0,0|2,0,0]=3 1960 B13R2.435 OC(=O)c1nc2c(o1)cccc2 Amb10066905 [0,0,0,1,0,0|1,0,1]=3 1961 B13R2.435 OC(=O)c1nc2c(s1)cccc2 Amb17622301 [0,0,0,1,0,0|1,1,0]=3 1962 B13R2.435 OC(=O)c1nc2n(c1)cccc2 Amb1106602 [0,0,0,1,0,0|2,0,1]=4 1963 B13R2.435 OC(=O)c1nc2n(c1)cccc2 Amb15694770 [0,0,0,1,0,0|2,0,1]=4 1964 B13R2.435 OC(=O)c:1:c:c-2:c:c:c:[nH]:c2:[n]1 Amb18944027 [0,0,0,1,0,0|2,0,1]=4 1965 B13R2.435 OC(=S)c1cc2ccccc2o1 Amb25253336 [0,0,0,1,0,0|0,1,2]=4 1966 B13R2.435 OS(=O)c1[nH]c2ccccc2[n]1 Amb25373910 [0,0,0,1,0,0|3,0,0]=4 1967 B13R2.435 OS(=O)c1[n]c2ccccc2[s]1 Amb24061131 [0,0,0,1,0,0|2,1,0]=4 1968 B13R2.435 O[13C](=O)c1cc2c([nH]1)cccc2 Amb17616073 [0,0,0,1,0,0|1,0,1]=3 1969 B13R2.435 [O-]C(=O)c1[nH]c2ccccc2[n]1 Amb23469767 [0,0,0,1,0,0|2,0,1]=4 1970 B13R2.435 [O-]C(=O)c1[n]c2ccccc2[s]1 Amb21959896 [0,0,0,1,0,0|1,1,1]=4 1971 B13R2.435 [O-]C(=O)c1[n]c2ccccc2o1 Amb19651173 [0,0,0,1,0,0|1,0,2]=4 1972 B13R2.435 [O-]C(=O)c1[n]c2ccccc2o1 Amb19944614 [0,0,0,1,0,0|1,0,2]=4 1973 B13R2.435 [O-]C(=O)c1[n]c2ccccc2o1 Amb21961465 [0,0,0,1,0,0|1,0,2]=4 1974 B13R2.435 [O-]C(=O)c1nc2c(s1)cccc2 Amb1103264 [0,0,0,1,0,0|1,1,1]=4 1975 B13R2.435 [O-]C(=O)c1nc2c(s1)cccc2 Amb2354722 [0,0,0,1,0,0|1,1,1]=4 1976 B13R2.444 O=C(Cc1ccccc1)C2CC2 Amb18034012 [0,0,0,1,0,0|2,0,1]=4 1977 B13R2.444 O=C(Cc1ccccc1)C2CO2 Amb25238359 [0,0,0,1,0,0|1,0,1]=3 1978 B13R2.444 O=C(Nc1ccccc1)C2CO2 Amb24377141 [0,0,0,1,0,0|2,0,1]=4 1979 B13R2.5517 CC1(Cc2ccccc12)C(O)=O Amb17778872 [0,0,0,1,0,0|1,0,1]=3 1980 B13R2.5517 NC(=O)C1(Cl)Cc2ccccc12 Amb25767195 [0,0,0,1,0,0|2,0,1]=4 1981 B11R1.35 C=C(Cc1ccc[s]1)C(O)=O Amb24558176 [0,0,0,0,1,0|2,0,0]=3 1982 B11R1.35 CC(=C)C(=O)Cc1ccc[s]1 Amb25801387 [0,0,0,0,1,0|3,0,0]=4 1983 B11R1.35 CC(=C)C(=O)Cc1ccco1 Amb24486373 [0,0,0,0,1,0|3,0,0]=4 1984 B11R1.35 CC(=C)C(=O)Cc1ccoc1 Amb24529007 [0,0,0,0,1,0|3,0,0]=4 1985 B11R1.35 CC(=O)C(=O)C[n]1c[n]cc1 Amb24363496 [0,0,0,0,1,0|3,0,0]=4 1986 B11R1.35 CC(=O)C(=O)Cc1ccc[s]1 Amb24456858 [0,0,0,0,1,0|2,0,0]=3 1987 B11R1.35 CC(=O)C(=O)Cc1ccco1 Amb25177671 [0,0,0,0,1,0|2,0,0]=3 1988 B11R1.35 CC(C[n]1cccc1)C(O)=O Amb18994454 [0,0,0,0,1,0|2,0,1]=4 1989 B11R1.35 CC(O)C(=O)Cc1ccc[s]1 Amb25343077 [0,0,0,0,1,0|2,0,1]=4 1990 B11R1.35 C\C(=C\c1ccc[s]1)\C(O)=O Amb25273294 [0,0,0,0,1,0|2,0,1]=4 1991 B11R1.35 C\C(=C\c1ccoc1)\C(O)=O Amb25829028 [0,0,0,0,1,0|2,0,1]=4 1992 B11R1.35 NC(C[n]1cccc1)C(O)=O Amb18200839 [0,0,0,0,1,0|2,0,1]=4 1993 B11R1.35 NC(Cc1cc[nH]c1)C(O)=O Amb18065409 [0,0,0,0,1,0|2,0,1]=4 1994 B11R1.35 NC(Cc1ccc[nH]1)C(O)=O Amb18302277 [0,0,0,0,1,0|2,0,1]=4 1995 B11R1.35 NC(Cc1ccoc1)C(O)=O Amb21858415 [0,0,0,0,1,0|2,0,1]=4 1996 B11R1.35 N[C@@H](Cc1cc[nH]c1)C(O)=O Amb22746047 [0,0,0,0,1,0|2,0,1]=4 1997 B11R1.35 N[C@@H](Cc1ccc[nH]1)C(O)=O Amb22750710 [0,0,0,0,1,0|2,0,1]=4 1998 B11R1.35 N[C@@H](Cc1ccc[s]1)C(O)=O Amb22747410 [0,0,0,0,1,0|2,0,1]=4 1999 B11R1.35 N[C@@H](Cc1ccoc1)C(O)=O Amb22228970 [0,0,0,0,1,0|2,0,1]=4 2000 B11R1.35 N[C@H](Cc1cc[nH]c1)C(O)=O Amb24056486 [0,0,0,0,1,0|2,0,1]=4 2001 B11R1.35 N[C@H](Cc1ccc[nH]1)C(O)=O Amb24082124 [0,0,0,0,1,0|2,0,1]=4 2002 B11R1.35 N[C@H](Cc1ccoc1)C(O)=O Amb22228969 [0,0,0,0,1,0|2,0,1]=4 2003 B11R1.35 N\C(=C\c1cc[s]c1)\C(O)=O Amb24729838 [0,0,0,0,1,0|2,0,1]=4 2004 B11R1.35 N\C(=C\c1ccc[nH]1)\C(O)=O Amb24438740 [0,0,0,0,1,0|2,0,1]=4 2005 B11R1.35 N\C(=C\c1ccoc1)\C(O)=O Amb24549139 [0,0,0,0,1,0|2,0,1]=4 2006 B11R1.35 OC(=O)C(=O)Cc1[nH]cc[n]1 Amb25685368 [0,0,0,0,1,0|2,0,0]=3 2007 B11R1.35 OC(=O)C(=O)Cc1c[n][s][n]1 Amb25243733 [0,0,0,0,1,0|3,0,0]=4 2008 B11R1.35 OC(=O)C(=O)Cc1ccco1 Amb1137668 [0,0,0,0,1,0|1,0,0]=2 2009 B11R1.35 OC(=O)C(=O)Cc1cccs1 Amb1135982 [0,0,0,0,1,0|1,0,0]=2 2010 B11R1.35 OC(=O)C(=O)Cc1cscc1 Amb1133942 [0,0,0,0,1,0|1,0,0]=2 2011 B11R1.35 OC(=O)C(=O)Nc1[nH]cc[n]1 Amb25041377 [0,0,0,0,1,0|3,0,0]=4 2012 B11R1.35 OC(=O)C(=O)Nc1c[n]oc1 Amb18965619 [0,0,0,0,1,0|3,0,0]=4 2013 B11R1.35 OC(=O)C(=O)Nc1cc[nH][n]1 Amb25279842 [0,0,0,0,1,0|3,0,0]=4 2014 B11R1.35 OC(=O)C(=O)Nc1cco[n]1 Amb18965539 [0,0,0,0,1,0|3,0,0]=4 2015 B11R1.35 OC(=O)C(=S)Cc1ccc[s]1 Amb22472986 [0,0,0,0,1,0|1,1,0]=3 2016 B11R1.35 OC(=O)C(Cc1ccco1)O Amb17138461 [0,0,0,0,1,0|1,0,2]=4 2017 B11R1.35 OC(=O)C(Cc1cccs1)O Amb17138686 [0,0,0,0,1,0|1,0,2]=4 2018 B11R1.35 OC(=O)C(Cc1cscc1)C Amb17605844 [0,0,0,0,1,0|2,0,1]=4 2019 B11R1.35 OC(=O)C(F)Cc1cc[s]c1 Amb24568962 [0,0,0,0,1,0|2,0,1]=4 2020 B11R1.35 OC(=O)C(F)Cc1ccco1 Amb25042990 [0,0,0,0,1,0|2,0,1]=4 2021 B11R1.35 OC(=O)C(S)Cc1cc[s]c1 Amb18288888 [0,0,0,0,1,0|1,1,1]=4 2022 B11R1.35 OC(=O)C(S)Cc1ccc[s]1 Amb18968268 [0,0,0,0,1,0|1,1,1]=4 2023 B11R1.35 OC(=O)C(S)Cc1ccco1 Amb18968270 [0,0,0,0,1,0|1,1,1]=4 2024 B11R1.35 OC(=O)[C@@H](Cc1ccco1)N Amb10068215 [0,0,0,0,1,0|2,0,1]=4 2025 B11R1.35 OC(=O)[C@@H](Cc1cccs1)C Amb10844000 [0,0,0,0,1,0|2,0,1]=4 2026 B11R1.35 OC(=O)[C@@H](Cc1cccs1)N Amb10068211 [0,0,0,0,1,0|2,0,1]=4 2027 B11R1.35 OC(=O)[C@@H](Cc1cscc1)N Amb10068213 [0,0,0,0,1,0|2,0,1]=4 2028 B11R1.35 OC(=O)[C@@H](O)Cc1c[s]cc1 Amb24739592 [0,0,0,0,1,0|1,0,2]=4 2029 B11R1.35 OC(=O)[C@@H](O)Cc1ccc[s]1 Amb25074591 [0,0,0,0,1,0|1,0,2]=4 2030 B11R1.35 OC(=O)[C@H](Cc1ccco1)N Amb10068214 [0,0,0,0,1,0|2,0,1]=4 2031 B11R1.35 OC(=O)[C@H](Cc1cccs1)C Amb10844001 [0,0,0,0,1,0|2,0,1]=4 2032 B11R1.35 OC(=O)[C@H](Cc1cccs1)N Amb10068210 [0,0,0,0,1,0|2,0,1]=4 2033 B11R1.35 OC(=O)[C@H](Cc1cscc1)N Amb10068212 [0,0,0,0,1,0|2,0,1]=4 2034 B11R1.35 OC(=O)[C@H](F)Cc1cc[s]c1 Amb25103346 [0,0,0,0,1,0|2,0,1]=4 2035 B11R1.35 OC(=O)[C@H](F)Cc1ccc[s]1 Amb25724921 [0,0,0,0,1,0|2,0,1]=4 2036 B11R1.35 OC(=O)\C(\Br)=C\c1ccco1 Amb25827160 [0,0,0,0,1,0|2,0,1]=4 2037 B11R1.35 OC(=O)\C(\Cl)=C\c1ccc[s]1 Amb24511927 [0,0,0,0,1,0|2,0,1]=4 2038 B11R1.35 OC(=O)\C(\F)=C\c1cc[nH]c1 Amb25859294 [0,0,0,0,1,0|2,0,1]=4 2039 B11R1.35 OC(=O)\C(\F)=C\c1cc[s]c1 Amb24725504 [0,0,0,0,1,0|2,0,1]=4 2040 B11R1.35 OC(=O)\C(\F)=C\c1ccc[nH]1 Amb25735919 [0,0,0,0,1,0|2,0,1]=4 2041 B11R1.35 OC(=O)\C(\S)=C\c1cc[s]c1 Amb25172800 [0,0,0,0,1,0|1,1,1]=4 2042 B11R1.35 OC(=O)\C(\S)=C\c1ccc[nH]1 Amb25238397 [0,0,0,0,1,0|1,1,1]=4 2043 B11R1.35 OC(=O)\C(\S)=C\c1ccc[s]1 Amb18649398 [0,0,0,0,1,0|1,1,1]=4 2044 B11R1.36 BrC(Br)=C(Br)c1ccccc1 Amb20246913 [0,0,0,0,1,0|3,0,0]=4 2045 B11R1.36 BrC(Br)C(=O)c1ccccc1 Amb17940392 [0,0,0,0,1,0|2,0,1]=4 2046 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [0,0,0,0,1,0|2,0,1]=4 2047 B11R1.36 C(=C(c1ccccc1)[2H])([2H])[2H] Amb16185561 [0,0,0,0,1,0|3,0,0]=4 2048 B11R1.36 C=C(Br)C(=O)c1ccccc1 Amb25208336 [0,0,0,0,1,0|2,0,0]=3 2049 B11R1.36 C=C(C(=O)Cl)c1ccccc1 Amb24687929 [0,0,0,0,1,0|2,0,0]=3 2050 B11R1.36 C=C(C(O)=O)[n+]1ccccc1 Amb24433450 [0,0,0,0,1,0|2,0,0]=3 2051 B11R1.36 C=C(C(O)=O)c1ccc[n]c1 Amb24578705 [0,0,0,0,1,0|2,0,0]=3 2052 B11R1.36 C=C(C(O)=O)c1cccc[n]1 Amb24657250 [0,0,0,0,1,0|2,0,0]=3 2053 B11R1.36 C=C(F)C(=O)c1ccccc1 Amb25347602 [0,0,0,0,1,0|2,0,0]=3 2054 B11R1.36 C=[N+]([O-])C(=O)c1ccccc1 Amb24069126 [0,0,0,0,1,0|2,0,1]=4 2055 B11R1.36 CC(=C)C(=O)c1cc[n]cc1 Amb24413658 [0,0,0,0,1,0|3,0,0]=4 2056 B11R1.36 CC(=C)C(=O)c1ccc[n]c1 Amb25139926 [0,0,0,0,1,0|3,0,0]=4 2057 B11R1.36 CC(=N)C(=O)c1ccccc1 Amb24612580 [0,0,0,0,1,0|2,0,0]=3 2058 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [0,0,0,0,1,0|2,0,0]=3 2059 B11R1.36 CC(=O)C(=O)c1c[n]ccc1 Amb25152863 [0,0,0,0,1,0|2,0,0]=3 2060 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [0,0,0,0,1,0|2,0,1]=4 2061 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [0,0,0,0,1,0|3,0,0]=4 2062 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [0,0,0,0,1,0|2,0,1]=4 2063 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [0,0,0,0,1,0|1,0,2]=4 2064 B11R1.36 CC(C(=O)c1ccccc1)F Amb10603603 [0,0,0,0,1,0|2,0,1]=4 2065 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [0,0,0,0,1,0|2,0,1]=4 2066 B11R1.36 CC(C(O)=O)[n+]1ccccc1 Amb25708377 [0,0,0,0,1,0|2,0,1]=4 2067 B11R1.36 CC(C(O)=O)c1cc[n]cc1 Amb18952037 [0,0,0,0,1,0|2,0,1]=4 2068 B11R1.36 CC(C(O)=O)c1ccc[n]c1 Amb18952038 [0,0,0,0,1,0|2,0,1]=4 2069 B11R1.36 CC(C(O)=O)c1cccc[n]1 Amb18951446 [0,0,0,0,1,0|2,0,1]=4 2070 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [0,0,0,0,1,0|3,0,0]=4 2071 B11R1.36 CC(O)C(=C)c1ccccc1 Amb25226435 [0,0,0,0,1,0|2,0,1]=4 2072 B11R1.36 CC(O)C(=O)c1ccc[n]c1 Amb25712989 [0,0,0,0,1,0|2,0,1]=4 2073 B11R1.36 CC(O)C(=O)c1ccccc1 Amb18799361 [0,0,0,0,1,0|1,0,1]=3 2074 B11R1.36 CC(S)C(=O)c1ccccc1 Amb25142605 [0,0,0,0,1,0|1,1,1]=4 2075 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [0,0,0,0,1,0|2,0,1]=4 2076 B11R1.36 CN(C(=O)c1ccccn1)O Amb10572675 [0,0,0,0,1,0|3,0,0]=4 2077 B11R1.36 CN(N)C(=O)c1ccccc1 Amb18125146 [0,0,0,0,1,0|3,0,0]=4 2078 B11R1.36 CN(O)C(=O)c1ccc[n]c1 Amb24062385 [0,0,0,0,1,0|3,0,0]=4 2079 B11R1.36 CN(O)C(=O)c1ccccc1 Amb25082592 [0,0,0,0,1,0|2,0,0]=3 2080 B11R1.36 CN(c1ccccc1)C(=O)N Amb1137584 [0,0,0,0,1,0|3,0,0]=4 2081 B11R1.36 C[C@@H](C(=O)c1ccccc1)N Amb17610655 [0,0,0,0,1,0|2,0,1]=4 2082 B11R1.36 C[C@@H](Cl)C(=O)c1ccccc1 Amb24068213 [0,0,0,0,1,0|2,0,1]=4 2083 B11R1.36 C[C@@H](F)C(=O)c1ccccc1 Amb24068215 [0,0,0,0,1,0|2,0,1]=4 2084 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb19131140 [0,0,0,0,1,0|2,0,1]=4 2085 B11R1.36 C[C@@H](N)C(=O)c1ccccc1 Amb25757602 [0,0,0,0,1,0|2,0,1]=4 2086 B11R1.36 C[C@@H](O)C(=O)c1ccc[n]c1 Amb24608705 [0,0,0,0,1,0|2,0,1]=4 2087 B11R1.36 C[C@H](Br)C(=O)c1ccccc1 Amb25689646 [0,0,0,0,1,0|2,0,1]=4 2088 B11R1.36 C[C@H](Cl)C(=O)c1ccccc1 Amb24068277 [0,0,0,0,1,0|2,0,1]=4 2089 B11R1.36 C[C@H](N)C(=O)c1ccccc1 Amb25853969 [0,0,0,0,1,0|2,0,1]=4 2090 B11R1.36 C[C@H](O)C(=C)c1ccccc1 Amb25188700 [0,0,0,0,1,0|2,0,1]=4 2091 B11R1.36 C[C@H](O)C(=O)c1ccc[n]c1 Amb25714471 [0,0,0,0,1,0|2,0,1]=4 2092 B11R1.36 C[C@H](O)C(=O)c1cccc[n]1 Amb24486355 [0,0,0,0,1,0|2,0,1]=4 2093 B11R1.36 C[C@H](O)C(=O)c1ccccc1 Amb25151480 [0,0,0,0,1,0|1,0,1]=3 2094 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [0,0,0,0,1,0|2,0,1]=4 2095 B11R1.36 C\C(\c1ccccc1)=C(\C)/Br Amb25211055 [0,0,0,0,1,0|3,0,0]=4 2096 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [0,0,0,0,1,0|2,0,1]=4 2097 B11R1.36 FC(=C(F)F)c1ccccc1 Amb10839818 [0,0,0,0,1,0|3,0,0]=4 2098 B11R1.36 FC(F)=C(Br)c1ccccc1 Amb22008100 [0,0,0,0,1,0|3,0,0]=4 2099 B11R1.36 F\C(=C(\Cl)/F)\c1ccccc1 Amb13952905 [0,0,0,0,1,0|3,0,0]=4 2100 B11R1.36 F\C(\c1ccccc1)=C(\F)/Cl Amb25776764 [0,0,0,0,1,0|3,0,0]=4 2101 B11R1.36 N=C(C(O)=O)c1ccccc1 Amb24581249 [0,0,0,0,1,0|1,0,0]=2 2102 B11R1.36 N=C(c1ccccc1)C(=N)Cl Amb25236876 [0,0,0,0,1,0|3,0,0]=4 2103 B11R1.36 N=C(c1ccccc1)N(O)O Amb24486661 [0,0,0,0,1,0|2,0,1]=4 2104 B11R1.36 NC(=O)C(=N)c1ccccc1 Amb24714517 [0,0,0,0,1,0|2,0,0]=3 2105 B11R1.36 NC(=O)C(=O)c1c[n]ccc1 Amb18063199 [0,0,0,0,1,0|2,0,0]=3 2106 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,0,0,0,1,0|1,0,0]=2 2107 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [0,0,0,0,1,0|2,0,1]=4 2108 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [0,0,0,0,1,0|2,0,1]=4 2109 B11R1.36 NC(=O)N(N)c1ccccc1 Amb18125271 [0,0,0,0,1,0|3,0,0]=4 2110 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [0,0,0,0,1,0|2,0,1]=4 2111 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [0,0,0,0,1,0|2,0,1]=4 2112 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [0,0,0,0,1,0|2,0,1]=4 2113 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,0,0,0,1,0|1,0,2]=4 2114 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [0,0,0,0,1,0|2,0,1]=4 2115 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [0,0,0,0,1,0|2,0,1]=4 2116 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [0,0,0,0,1,0|2,0,1]=4 2117 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,0,0,0,1,0|1,0,2]=4 2118 B11R1.36 NC(=S)C(=O)c1ccc[n]c1 Amb24664127 [0,0,0,0,1,0|2,1,0]=4 2119 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [0,0,0,0,1,0|2,0,1]=4 2120 B11R1.36 NC(C(O)=O)c1cccc[n]1 Amb22496612 [0,0,0,0,1,0|2,0,1]=4 2121 B11R1.36 NC(c1ccccc1)C(=O)Cl Amb16203807 [0,0,0,0,1,0|2,0,1]=4 2122 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [0,0,0,0,1,0|2,0,1]=4 2123 B11R1.36 NC(c1ccccc1)C(=O)O Amb1869285 [0,0,0,0,1,0|1,0,1]=3 2124 B11R1.36 NC(c1ccccc1)P(O)=O Amb25191187 [0,0,0,0,1,0|2,0,1]=4 2125 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [0,0,0,0,1,0|2,0,1]=4 2126 B11R1.36 N[C@@H](C(O)=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351396 [0,0,0,0,1,0|1,0,1]=3 2127 B11R1.36 N[C@@H](C(O)=O)c1ccc[n]c1 Amb24074448 [0,0,0,0,1,0|2,0,1]=4 2128 B11R1.36 N[C@@H](C(O)=O)c1ccccc1 Amb22745585 [0,0,0,0,1,0|1,0,1]=3 2129 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [0,0,0,0,1,0|2,0,1]=4 2130 B11R1.36 N[C@H](C(=O)Cl)c1ccccc1 Amb25152830 [0,0,0,0,1,0|2,0,1]=4 2131 B11R1.36 O=C(C(=S)Cl)c1ccccc1 Amb24096825 [0,0,0,0,1,0|1,1,0]=3 2132 B11R1.36 O=C(C(Cl)Br)c1ccccc1 Amb25240116 [0,0,0,0,1,0|2,0,1]=4 2133 B11R1.36 O=C(C(F)Br)c1ccccc1 Amb24104059 [0,0,0,0,1,0|2,0,1]=4 2134 B11R1.36 O=C(C(F)Cl)c1ccccc1 Amb24104242 [0,0,0,0,1,0|2,0,1]=4 2135 B11R1.36 O=C(Cl)[C@@H](Cl)c1ccccc1 Amb24657090 [0,0,0,0,1,0|2,0,1]=4 2136 B11R1.36 O=C(c1ccccc1)C(=C)C Amb17593661 [0,0,0,0,1,0|2,0,0]=3 2137 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [0,0,0,0,1,0|1,0,0]=2 2138 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [0,0,0,0,1,0|1,0,0]=2 2139 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [0,0,0,0,1,0|1,0,0]=2 2140 B11R1.36 OB(C(=C)c1ccccc1)O Amb10071036 [0,0,0,0,1,0|2,0,1]=4 2141 B11R1.36 OB(O)C(=O)c1ccccc1 Amb25260688 [0,0,0,0,1,0|1,0,1]=3 2142 B11R1.36 OC(=O)C(=O)c1[n]ccc[n]1 Amb25127552 [0,0,0,0,1,0|2,0,0]=3 2143 B11R1.36 OC(=O)C(=O)c1c[n]cc[n]1 Amb24361851 [0,0,0,0,1,0|2,0,0]=3 2144 B11R1.36 OC(=O)C(=O)c1c[n]ccc1 Amb22492371 [0,0,0,0,1,0|1,0,0]=2 2145 B11R1.36 OC(=O)C(=O)c1cc[n]cc1 Amb18125209 [0,0,0,0,1,0|1,0,0]=2 2146 B11R1.36 OC(=O)C(=O)c1cccc[n]1 Amb18831273 [0,0,0,0,1,0|1,0,0]=2 2147 B11R1.36 OC(=O)C(=O)c1cccnc1 Amb15701278 [0,0,0,0,1,0|1,0,0]=2 2148 B11R1.36 OC(=O)C(Br)c1ccc[n]c1 Amb19929998 [0,0,0,0,1,0|2,0,1]=4 2149 B11R1.36 OC(=O)C(Br)c1cccc[n]1 Amb24081184 [0,0,0,0,1,0|2,0,1]=4 2150 B11R1.36 OC(=O)C(Cl)c1cc[n]cc1 Amb24488132 [0,0,0,0,1,0|2,0,1]=4 2151 B11R1.36 OC(=O)C(Cl)c1ccc[n]c1 Amb24089492 [0,0,0,0,1,0|2,0,1]=4 2152 B11R1.36 OC(=O)C(F)c1cc[n]cc1 Amb24466152 [0,0,0,0,1,0|2,0,1]=4 2153 B11R1.36 OC(=O)C(F)c1cccc[n]1 Amb25149165 [0,0,0,0,1,0|2,0,1]=4 2154 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb18952024 [0,0,0,0,1,0|1,0,2]=4 2155 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb19373382 [0,0,0,0,1,0|1,0,2]=4 2156 B11R1.36 OC(=O)C(O)c1cc[n]cc1 Amb18201200 [0,0,0,0,1,0|1,0,2]=4 2157 B11R1.36 OC(=O)C(O)c1cccc[n]1 Amb18201201 [0,0,0,0,1,0|1,0,2]=4 2158 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [0,0,0,0,1,0|0,0,2]=3 2159 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [0,0,0,0,1,0|0,0,2]=3 2160 B11R1.36 OC(=O)C(c1ccccc1)N Amb2228457 [0,0,0,0,1,0|1,0,1]=3 2161 B11R1.36 OC(=O)C(c1cccnc1)N Amb10632723 [0,0,0,0,1,0|2,0,1]=4 2162 B11R1.36 OC(=O)[C@@H](Br)c1ccccc1 Amb25056175 [0,0,0,0,1,0|1,0,1]=3 2163 B11R1.36 OC(=O)[C@@H](O)c1c[n]ccc1 Amb24595431 [0,0,0,0,1,0|1,0,2]=4 2164 B11R1.36 OC(=O)[C@H](Cl)c1ccccc1 Amb24650918 [0,0,0,0,1,0|1,0,1]=3 2165 B11R1.36 OC(=O)[C@H](O)c1c[n]ccc1 Amb25060746 [0,0,0,0,1,0|1,0,2]=4 2166 B11R1.36 OC(Br)C(=O)c1ccccc1 Amb24104060 [0,0,0,0,1,0|1,0,1]=3 2167 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [0,0,0,0,1,0|1,0,2]=4 2168 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [0,0,0,0,1,0|0,1,2]=4 2169 B11R1.36 OC(Cl)C(=O)c1ccccc1 Amb24528115 [0,0,0,0,1,0|1,0,1]=3 2170 B11R1.36 OC(O)C(=O)c1ccc[n]c1 Amb24408354 [0,0,0,0,1,0|1,0,2]=4 2171 B11R1.36 OC(c1ccccc1)=C(Cl)Cl Amb24101433 [0,0,0,0,1,0|2,0,1]=4 2172 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [0,0,0,0,1,0|1,0,2]=4 2173 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [0,0,0,0,1,0|1,0,2]=4 2174 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [0,0,0,0,1,0|1,0,2]=4 2175 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [0,0,0,0,1,0|1,0,2]=4 2176 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [0,0,0,0,1,0|1,1,1]=4 2177 B11R1.36 [NH3+]C(C(O)=O)c1ccccc1 Amb22641589 [0,0,0,0,1,0|1,0,1]=3 2178 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [0,0,0,0,1,0|0,0,3]=4 2179 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [0,0,0,0,1,0|0,0,3]=4 2180 B11R1.36 [O-]C(c1cccc[n]1)C(O)=O Amb22453597 [0,0,0,0,1,0|1,0,2]=4 2181 B13R1.348 CC(=C)CC(=O)Nc1ccccc1 Amb24759109 [0,0,0,0,0,1|3,0,0]=4 2182 B13R1.348 CC(=C)OC(=O)Nc1ccccc1 Amb25121132 [0,0,0,0,0,1|3,0,0]=4 2183 B13R1.348 CC(=N)NC(=O)Oc1ccccc1 Amb25288293 [0,0,0,0,0,1|3,0,0]=4 2184 B13R1.348 CC(=O)/C=C(\C)Cc1ccccc1 Amb17778969 [0,0,0,0,0,1|2,0,0]=3 2185 B13R1.348 CC(=O)C/C(C)=C/c1ccccc1 Amb17778970 [0,0,0,0,0,1|2,0,1]=4 2186 B13R1.348 CC(=O)CC(=O)Cc1cccc[n]1 Amb24076575 [0,0,0,0,0,1|2,0,0]=3 2187 B13R1.348 CC(=O)CC(=O)Nc1cc[n]cc1 Amb18178501 [0,0,0,0,0,1|3,0,0]=4 2188 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,0,0,0,0,1|2,0,0]=3 2189 B13R1.348 CC(=O)CC(=S)Nc1ccccc1 Amb25190045 [0,0,0,0,0,1|2,1,0]=4 2190 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,0,0,0,0,1|3,0,0]=4 2191 B13R1.348 CC(=O)NC(=N)Nc1ccccc1 Amb25046689 [0,0,0,0,0,1|3,0,0]=4 2192 B13R1.348 CC(=O)NC(=O)Cc1ccccc1 Amb24073557 [0,0,0,0,0,1|1,0,0]=2 2193 B13R1.348 CC(=O)NC(=S)Cc1ccccc1 Amb25689518 [0,0,0,0,0,1|1,1,0]=3 2194 B13R1.348 CC(=O)NC(=S)Oc1ccccc1 Amb25758641 [0,0,0,0,0,1|2,1,0]=4 2195 B13R1.348 CC(=O)NC(N)Cc1ccccc1 Amb25322191 [0,0,0,0,0,1|2,0,1]=4 2196 B13R1.348 CC(=O)N[C@H](C)Cc1ccccc1 Amb24496665 [0,0,0,0,0,1|2,0,1]=4 2197 B13R1.348 CC(=O)OC(C)Cc1ccccc1 Amb24323251 [0,0,0,0,0,1|2,0,1]=4 2198 B13R1.348 CC(=O)SC(=O)Nc1ccccc1 Amb24396677 [0,0,0,0,0,1|2,0,0]=3 2199 B13R1.348 CC(=O)\C=C(\N)/Cc1ccccc1 Amb24739677 [0,0,0,0,0,1|2,0,0]=3 2200 B13R1.348 CC(=O)\C=C(\S)/Nc1ccccc1 Amb25840398 [0,0,0,0,0,1|2,1,0]=4 2201 B13R1.348 CC(=S)NC(=O)Cc1ccccc1 Amb25835179 [0,0,0,0,0,1|1,1,0]=3 2202 B13R1.348 CC(=S)NC(=O)Nc1ccccc1 Amb25104910 [0,0,0,0,0,1|2,1,0]=4 2203 B13R1.348 CC(C)=CC(=O)Cc1cc[n]cc1 Amb24455336 [0,0,0,0,0,1|3,0,0]=4 2204 B13R1.348 CC(CC(=O)Cc1ccccc1)C Amb15690932 [0,0,0,0,0,1|2,0,1]=4 2205 B13R1.348 CC(Cc1ccccc1)CC(=O)O Amb17233403 [0,0,0,0,0,1|1,0,1]=3 2206 B13R1.348 CC(Cc1ccccn1)CC(=O)O Amb17335285 [0,0,0,0,0,1|2,0,1]=4 2207 B13R1.348 CC(Cc1cccnc1)CC(=O)O Amb17335287 [0,0,0,0,0,1|2,0,1]=4 2208 B13R1.348 CC(Cc1ccncc1)CC(=O)O Amb17335288 [0,0,0,0,0,1|2,0,1]=4 2209 B13R1.348 CC(O)CC(=O)Sc1ccccc1 Amb20671502 [0,0,0,0,0,1|2,0,1]=4 2210 B13R1.348 CC(O)NC(=O)Cc1ccccc1 Amb25737869 [0,0,0,0,0,1|1,0,1]=3 2211 B13R1.348 CN(C)NC(=O)Cc1ccccc1 Amb24350087 [0,0,0,0,0,1|3,0,0]=4 2212 B13R1.348 CN(Cc1cc[n]cc1)CC(O)=O Amb22586727 [0,0,0,0,0,1|3,0,0]=4 2213 B13R1.348 CN(Cc1ccc[n]c1)CC(O)=O Amb21955498 [0,0,0,0,0,1|3,0,0]=4 2214 B13R1.348 CN(Cc1cccc[n]1)CC(O)=O Amb21955225 [0,0,0,0,0,1|3,0,0]=4 2215 B13R1.348 CN(Cc1cccc[n]1)CC(O)=O Amb22586726 [0,0,0,0,0,1|3,0,0]=4 2216 B13R1.348 CN(Cc1ccccc1)CC(=O)Cl Amb17143178 [0,0,0,0,0,1|3,0,0]=4 2217 B13R1.348 CN(Cc1ccccc1)CC(=O)N Amb17142972 [0,0,0,0,0,1|3,0,0]=4 2218 B13R1.348 CN(Cc1ccccc1)CC(=O)O Amb10610460 [0,0,0,0,0,1|2,0,0]=3 2219 B13R1.348 CN(O)CC(=O)Nc1ccccc1 Amb25790561 [0,0,0,0,0,1|3,0,0]=4 2220 B13R1.348 CS(C)=CC(=O)Cc1ccccc1 Amb18048727 [0,0,0,0,0,1|3,0,0]=4 2221 B13R1.348 C[C@@H](O)CC(=O)Nc1ccccc1 Amb25075634 [0,0,0,0,0,1|2,0,1]=4 2222 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,0,0,0,0,1|2,0,1]=4 2223 B13R1.348 C[C@H](O)CC(=O)Nc1ccccc1 Amb24452163 [0,0,0,0,0,1|2,0,1]=4 2224 B13R1.348 C\C(=C/C(=O)O)\Cc1ccccc1 Amb17233183 [0,0,0,0,0,1|1,0,0]=2 2225 B13R1.348 C\C(=C/C(C)=O)\Nc1ccccc1 Amb20672001 [0,0,0,0,0,1|3,0,0]=4 2226 B13R1.348 C\C(=C/C(O)=O)\Sc1ccccc1 Amb18130094 [0,0,0,0,0,1|2,0,0]=3 2227 B13R1.348 C\C(=C/c1ccccc1)\CC(=O)O Amb17594482 [0,0,0,0,0,1|1,0,1]=3 2228 B13R1.348 C\C(=C\C(=O)C)\Nc1ccccc1 Amb2386561 [0,0,0,0,0,1|3,0,0]=4 2229 B13R1.348 C\C(=C\C(N)=O)\Sc1ccccc1 Amb25178969 [0,0,0,0,0,1|3,0,0]=4 2230 B13R1.348 C\C(\CC(N)=O)=C/c1ccccc1 Amb22734412 [0,0,0,0,0,1|2,0,1]=4 2231 B13R1.348 C\C(\CC(N)=O)=C\c1ccccc1 Amb24603442 [0,0,0,0,0,1|2,0,1]=4 2232 B13R1.348 C\C(\CC(O)=O)=C\c1ccccc1 Amb25229524 [0,0,0,0,0,1|1,0,1]=3 2233 B13R1.348 C\C(\Cc1ccccc1)=C\C(C)O Amb25092323 [0,0,0,0,0,1|2,0,1]=4 2234 B13R1.348 C\C(\Cl)=C\C(=O)Nc1ccccc1 Amb22462104 [0,0,0,0,0,1|3,0,0]=4 2235 B13R1.348 C\C(\N)=C\C(=O)Cc1ccccc1 Amb25767909 [0,0,0,0,0,1|2,0,0]=3 2236 B13R1.348 C\C(\O)=C\C(=O)Cc1ccccc1 Amb24492639 [0,0,0,0,0,1|1,0,0]=2 2237 B13R1.348 Cl\C(=C/C(=O)C)\Sc1ccccc1 Amb17595760 [0,0,0,0,0,1|3,0,0]=4 2238 B13R1.348 NC(=N)CC(=O)Nc1ccccc1 Amb22913302 [0,0,0,0,0,1|3,0,0]=4 2239 B13R1.348 NC(=N)NC(=O)Cc1ccccc1 Amb24426154 [0,0,0,0,0,1|2,0,0]=3 2240 B13R1.348 NC(=O)CC(=O)Nc1cc[n]cc1 Amb25337529 [0,0,0,0,0,1|3,0,0]=4 2241 B13R1.348 NC(=O)CC(=O)Nc1cccc[n]1 Amb25279648 [0,0,0,0,0,1|3,0,0]=4 2242 B13R1.348 NC(=O)CC(=O)Nc1ccccc1 Amb25188019 [0,0,0,0,0,1|2,0,0]=3 2243 B13R1.348 NC(=O)CC(=S)Nc1ccccc1 Amb25772797 [0,0,0,0,0,1|2,1,0]=4 2244 B13R1.348 NC(=O)NC(=O)C[n+]1ccccc1 Amb24640386 [0,0,0,0,0,1|2,0,0]=3 2245 B13R1.348 NC(=O)NC(=O)Nc1cccc[n]1 Amb24373811 [0,0,0,0,0,1|3,0,0]=4 2246 B13R1.348 NC(=O)NC(=O)Oc1ccccc1 Amb24635786 [0,0,0,0,0,1|2,0,0]=3 2247 B13R1.348 NC(=O)OC(=O)Nc1ccccc1 Amb25350415 [0,0,0,0,0,1|2,0,0]=3 2248 B13R1.348 NC(=S)NC(=O)Nc1ccccc1 Amb25264418 [0,0,0,0,0,1|2,1,0]=4 2249 B13R1.348 NC(=S)NC(=O)Oc1ccccc1 Amb24634040 [0,0,0,0,0,1|2,1,0]=4 2250 B13R1.348 NC(Cc1ccccc1)CC(O)=O Amb20623358 [0,0,0,0,0,1|1,0,1]=3 2251 B13R1.348 NC(Cc1ccccn1)CC(=O)O Amb17470627 [0,0,0,0,0,1|2,0,1]=4 2252 B13R1.348 NC(Cc1cccnc1)CC(=O)O Amb17470630 [0,0,0,0,0,1|2,0,1]=4 2253 B13R1.348 NC(Cc1ccncc1)CC(=O)O Amb17470634 [0,0,0,0,0,1|2,0,1]=4 2254 B13R1.348 N[C@@H](Cc1cc[n]cc1)CC(O)=O Amb22746344 [0,0,0,0,0,1|2,0,1]=4 2255 B13R1.348 N[C@@H](Cc1ccc[n]c1)CC(O)=O Amb22746342 [0,0,0,0,0,1|2,0,1]=4 2256 B13R1.348 N\C(=C\C(O)=O)\Oc1ccccc1 Amb24655097 [0,0,0,0,0,1|2,0,0]=3 2257 B13R1.348 N\C(\Cc1ccccc1)=C\C(N)=O Amb24602390 [0,0,0,0,0,1|2,0,0]=3 2258 B13R1.348 O=C(C[N+](=O)[O-])Cc1ccccc1 Amb1107860 [0,0,0,0,0,1|1,0,1]=3 2259 B13R1.348 O=C(Cc1ccccc1)CC(=O)C Amb15692856 [0,0,0,0,0,1|1,0,0]=2 2260 B13R1.348 O=C(Nc1ccccc1)CC(=O)C Amb1210069 [0,0,0,0,0,1|2,0,0]=3 2261 B13R1.348 O=C(Nc1ccccc1)CC(=O)O Amb2436726 [0,0,0,0,0,1|1,0,0]=2 2262 B13R1.348 O=C(Nc1ccccc1)CC(=S)N Amb1105766 [0,0,0,0,0,1|2,1,0]=4 2263 B13R1.348 O=C(Nc1ccccc1)NC(=O)N Amb2222030 [0,0,0,0,0,1|2,0,0]=3 2264 B13R1.348 O=C(Nc1ccccn1)CC(=O)C Amb1200449 [0,0,0,0,0,1|3,0,0]=4 2265 B13R1.348 O=C(Oc1ccccc1)CC(=O)O Amb2417322 [0,0,0,0,0,1|1,0,0]=2 2266 B13R1.348 O=C(Oc1ccccc1)CC(=S)N Amb1981073 [0,0,0,0,0,1|2,1,0]=4 2267 B13R1.348 OC(=O)CC(=O)Cc1ccccc1 Amb18128104 [0,0,0,0,0,1|0,0,0]=1 2268 B13R1.348 OC(=O)CC(=O)Nc1c[n]c[n]c1 Amb25101285 [0,0,0,0,0,1|3,0,0]=4 2269 B13R1.348 OC(=O)CC(=O)Nc1c[n]ccc1 Amb18987417 [0,0,0,0,0,1|2,0,0]=3 2270 B13R1.348 OC(=O)CC(=O)Nc1cc[n]cc1 Amb18295926 [0,0,0,0,0,1|2,0,0]=3 2271 B13R1.348 OC(=O)CC(=S)Nc1ccccc1 Amb24470037 [0,0,0,0,0,1|1,1,0]=3 2272 B13R1.348 OC(=O)CC(Br)Cc1ccccc1 Amb18111137 [0,0,0,0,0,1|1,0,1]=3 2273 B13R1.348 OC(=O)CC(Cl)Cc1ccccc1 Amb18111136 [0,0,0,0,0,1|1,0,1]=3 2274 B13R1.348 OC(Cc1ccccc1)CC(=O)O Amb17233662 [0,0,0,0,0,1|0,0,2]=3 2275 B13R1.348 S=C(Nc1ccccc1)NC(=O)C Amb2456399 [0,0,0,0,0,1|2,1,0]=4 2276 B13R1.348 [O-][N+](=O)CC(=O)Nc1ccccc1 Amb23589334 [0,0,0,0,0,1|2,0,1]=4 2277 B13R1.351 C=C(CSc1ccccc1)C(O)=O Amb18130089 [0,0,0,0,0,1|1,0,0]=2 2278 B13R1.351 C=C(Cl)C(=O)NCc1cc[n]cc1 Amb25229708 [0,0,0,0,0,1|3,0,0]=4 2279 B13R1.351 C=C(Cl)C(=O)NCc1ccc[n]c1 Amb25243861 [0,0,0,0,0,1|3,0,0]=4 2280 B13R1.351 C=C(Cl)C(=O)NNc1ccccc1 Amb22461851 [0,0,0,0,0,1|3,0,0]=4 2281 B13R1.351 C=C(F)C(=O)\C=C\c1ccccc1 Amb24577794 [0,0,0,0,0,1|2,0,1]=4 2282 B13R1.351 C=C(OCc1ccccc1)C(O)=O Amb24626599 [0,0,0,0,0,1|1,0,0]=2 2283 B13R1.351 CC(=C)C(=C)CNc1ccccc1 Amb24664158 [0,0,0,0,0,1|3,0,0]=4 2284 B13R1.351 CC(=C)C(=O)\C=C\c1ccccc1 Amb24357139 [0,0,0,0,0,1|2,0,1]=4 2285 B13R1.351 CC(=C)C(=S)NCc1ccccc1 Amb24366057 [0,0,0,0,0,1|2,1,0]=4 2286 B13R1.351 CC(=C=Cc1ccccc1)C(O)=O Amb25337779 [0,0,0,0,0,1|1,0,1]=3 2287 B13R1.351 CC(=C=Nc1ccccc1)C(C)=O Amb24721727 [0,0,0,0,0,1|2,0,1]=4 2288 B13R1.351 CC(=NNc1cccc[n]1)C(O)=O Amb22479269 [0,0,0,0,0,1|3,0,0]=4 2289 B13R1.351 CC(=O)C(/C)=C\Nc1ccccc1 Amb17778142 [0,0,0,0,0,1|2,0,1]=4 2290 B13R1.351 CC(=O)C(=O)CNc1ccccc1 Amb25123358 [0,0,0,0,0,1|1,0,0]=2 2291 B13R1.351 CC(=O)C(=O)NCc1ccccn1 Amb17400654 [0,0,0,0,0,1|2,0,0]=3 2292 B13R1.351 CC(=O)C(=O)NCc1cccnc1 Amb17400655 [0,0,0,0,0,1|2,0,0]=3 2293 B13R1.351 CC(=O)C(=O)NNc1ccccc1 Amb25128271 [0,0,0,0,0,1|2,0,0]=3 2294 B13R1.351 CC(=O)C(=O)OCc1ccccc1 Amb24740169 [0,0,0,0,0,1|1,0,0]=2 2295 B13R1.351 CC(=O)C(=O)\C=C\c1ccccc1 Amb24697906 [0,0,0,0,0,1|1,0,1]=3 2296 B13R1.351 CC(=O)C(C)CNc1ccccc1 Amb25325974 [0,0,0,0,0,1|2,0,1]=4 2297 B13R1.351 CC(=O)C(C)NCc1ccccc1 Amb18127991 [0,0,0,0,0,1|2,0,1]=4 2298 B13R1.351 CC(=O)N(C)OCc1ccccc1 Amb25829924 [0,0,0,0,0,1|3,0,0]=4 2299 B13R1.351 CC(=O)[C@H](C)OCc1ccccc1 Amb24492590 [0,0,0,0,0,1|2,0,1]=4 2300 B13R1.351 CC(=O)\C(\O)=C\Nc1ccccc1 Amb24488935 [0,0,0,0,0,1|1,0,2]=4 2301 B13R1.351 CC(Br)C(=O)OCc1ccccc1 Amb22054568 [0,0,0,0,0,1|2,0,1]=4 2302 B13R1.351 CC(C(=O)C)OCc1ccccc1 Amb16231123 [0,0,0,0,0,1|2,0,1]=4 2303 B13R1.351 CC(C(=O)N)COc1ccccc1 Amb17233540 [0,0,0,0,0,1|2,0,1]=4 2304 B13R1.351 CC(C(=O)NCc1ccccc1)C Amb1806323 [0,0,0,0,0,1|2,0,1]=4 2305 B13R1.351 CC(C(=O)NCc1ccccc1)Cl Amb1208021 [0,0,0,0,0,1|2,0,1]=4 2306 B13R1.351 CC(C(=O)NCc1ccccc1)N Amb10610119 [0,0,0,0,0,1|2,0,1]=4 2307 B13R1.351 CC(C(=O)NCc1ccccc1)O Amb10766141 [0,0,0,0,0,1|1,0,1]=3 2308 B13R1.351 CC(C(=O)NCc1ccncc1)O Amb17400770 [0,0,0,0,0,1|2,0,1]=4 2309 B13R1.351 CC(C(=O)O)CCc1ccncc1 Amb17335289 [0,0,0,0,0,1|2,0,1]=4 2310 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb10199880 [0,0,0,0,0,1|1,0,1]=3 2311 B13R1.351 CC(C(=O)O)NCc1ccccc1 Amb1111423 [0,0,0,0,0,1|1,0,1]=3 2312 B13R1.351 CC(C(=O)O)SCc1ccccc1 Amb1137630 [0,0,0,0,0,1|1,0,1]=3 2313 B13R1.351 CC(C(=O)OCc1ccccc1)N Amb17335303 [0,0,0,0,0,1|2,0,1]=4 2314 B13R1.351 CC(C)=C(C)CNc1ccccc1 Amb25191847 [0,0,0,0,0,1|3,0,0]=4 2315 B13R1.351 CC(CNc1cc[n]cc1)C(O)=O Amb19027731 [0,0,0,0,0,1|2,0,1]=4 2316 B13R1.351 CC(CNc1ccccc1)=C(Cl)Cl Amb24396680 [0,0,0,0,0,1|3,0,0]=4 2317 B13R1.351 CC(N)C(=O)OCc1ccccc1 Amb22233549 [0,0,0,0,0,1|2,0,1]=4 2318 B13R1.351 CC(O)C(=O)O[Hg]c1ccccc1 Amb22345872 [0,0,0,0,0,1|2,0,1]=4 2319 B13R1.351 CC(O)C(=O)\C=C\c1ccccc1 Amb24534525 [0,0,0,0,0,1|1,0,2]=4 2320 B13R1.351 CC(OCc1ccccc1)C(=O)Cl Amb24354312 [0,0,0,0,0,1|2,0,1]=4 2321 B13R1.351 CC(S)C(=O)OCc1ccccc1 Amb25058345 [0,0,0,0,0,1|1,1,1]=4 2322 B13R1.351 CC(\C=C\c1ccccc1)C(O)=O Amb18127714 [0,0,0,0,0,1|1,0,2]=4 2323 B13R1.351 CN(N)C(=O)OCc1ccccc1 Amb19959276 [0,0,0,0,0,1|3,0,0]=4 2324 B13R1.351 CN(O)C(=O)NCc1ccccc1 Amb24595889 [0,0,0,0,0,1|2,0,0]=3 2325 B13R1.351 CN(O)C(=O)NNc1ccccc1 Amb25350874 [0,0,0,0,0,1|3,0,0]=4 2326 B13R1.351 C[C@@H](C(=O)OCc1ccccc1)N Amb2404812 [0,0,0,0,0,1|2,0,1]=4 2327 B13R1.351 C[C@@H](Cl)C(=O)NCc1ccccc1 Amb25188021 [0,0,0,0,0,1|2,0,1]=4 2328 B13R1.351 C[C@@H](N)C(=O)NCc1ccccc1 Amb18014651 [0,0,0,0,0,1|2,0,1]=4 2329 B13R1.351 C[C@@H](O)C(=O)NCc1cc[n]cc1 Amb24459060 [0,0,0,0,0,1|2,0,1]=4 2330 B13R1.351 C[C@@H](O)C(=O)NCc1ccc[n]c1 Amb25749540 [0,0,0,0,0,1|2,0,1]=4 2331 B13R1.351 C[C@@H](O)C(=O)OCc1ccccc1 Amb22801052 [0,0,0,0,0,1|1,0,1]=3 2332 B13R1.351 C[C@@H](O)C(=O)\C=C\c1ccccc1 Amb25766283 [0,0,0,0,0,1|1,0,2]=4 2333 B13R1.351 C[C@@H](OCc1ccccc1)C(=O)Cl Amb24533460 [0,0,0,0,0,1|2,0,1]=4 2334 B13R1.351 C[C@@H](OCc1ccccc1)C(N)=O Amb25192194 [0,0,0,0,0,1|2,0,1]=4 2335 B13R1.351 C[C@H](C(=O)O)NCc1ccccc1 Amb16185448 [0,0,0,0,0,1|1,0,1]=3 2336 B13R1.351 C[C@H](C(=O)OCc1ccccc1)N Amb16183910 [0,0,0,0,0,1|2,0,1]=4 2337 B13R1.351 C[C@H](C(=O)OCc1ccccc1)N Amb17607755 [0,0,0,0,0,1|2,0,1]=4 2338 B13R1.351 C[C@H](O)C(=O)NCc1ccc[n]c1 Amb25066064 [0,0,0,0,0,1|2,0,1]=4 2339 B13R1.351 C[C@H](O)C(=O)NCc1ccccc1 Amb24452587 [0,0,0,0,0,1|1,0,1]=3 2340 B13R1.351 C[C@H](O)C(=O)NNc1ccccc1 Amb24351965 [0,0,0,0,0,1|2,0,1]=4 2341 B13R1.351 C[C@H](OCc1ccccc1)C(O)=O Amb25072743 [0,0,0,0,0,1|1,0,1]=3 2342 B13R1.351 C[C@H](\N=C\c1ccccc1)C(O)=O Amb25124071 [0,0,0,0,0,1|1,0,2]=4 2343 B13R1.351 C\C(=C/Cc1ccccc1)\C(C)=O Amb24529690 [0,0,0,0,0,1|2,0,0]=3 2344 B13R1.351 C\C(=C/Cc1ccccc1)\C(O)=O Amb24462262 [0,0,0,0,0,1|1,0,0]=2 2345 B13R1.351 C\C(=C/Sc1ccccc1)\C(O)=O Amb25072536 [0,0,0,0,0,1|1,0,1]=3 2346 B13R1.351 C\C(=C\Oc1ccccc1)\C(O)=O Amb25798942 [0,0,0,0,0,1|1,0,1]=3 2347 B13R1.351 C\C(=C\Sc1ccccc1)\C(O)=O Amb18130088 [0,0,0,0,0,1|1,0,1]=3 2348 B13R1.351 C\C(=N/Cc1ccccc1)\C(C)=O Amb25130600 [0,0,0,0,0,1|2,0,0]=3 2349 B13R1.351 C\C(=N/Nc1ccccc1)\C(=O)O Amb16205342 [0,0,0,0,0,1|2,0,0]=3 2350 B13R1.351 C\C(=N\Cc1cc[n]cc1)\C(O)=O Amb25684774 [0,0,0,0,0,1|2,0,0]=3 2351 B13R1.351 C\C(=N\Nc1cc[n]cc1)\C(O)=O Amb24346684 [0,0,0,0,0,1|3,0,0]=4 2352 B13R1.351 C\C(=N\Nc1cccc[n]1)\C(O)=O Amb24710122 [0,0,0,0,0,1|3,0,0]=4 2353 B13R1.351 C\C(=N\Nc1ccccc1)\C(N)=O Amb25211060 [0,0,0,0,0,1|3,0,0]=4 2354 B13R1.351 ClC(=NNc1ccccc1)C(=O)C Amb16236176 [0,0,0,0,0,1|3,0,0]=4 2355 B13R1.351 Cl\C(=N\Nc1ccccc1)\C(=O)C Amb1980993 [0,0,0,0,0,1|3,0,0]=4 2356 B13R1.351 FC(C(=O)OCc1ccccc1)Cl Amb10841341 [0,0,0,0,0,1|2,0,1]=4 2357 B13R1.351 N=C(NCc1ccccc1)C(O)=O Amb18128144 [0,0,0,0,0,1|1,0,0]=2 2358 B13R1.351 NC(=O)C(=O)CCc1ccccc1 Amb24273105 [0,0,0,0,0,1|1,0,0]=2 2359 B13R1.351 NC(=O)C(=O)NCc1ccccc1 Amb25858184 [0,0,0,0,0,1|1,0,0]=2 2360 B13R1.351 NC(=O)C(=O)NCc1cccnc1 Amb1830622 [0,0,0,0,0,1|2,0,0]=3 2361 B13R1.351 NC(=O)C(=O)\C=C\c1ccccc1 Amb25798864 [0,0,0,0,0,1|1,0,1]=3 2362 B13R1.351 NC(=O)C(N)CCc1ccccc1 Amb19035976 [0,0,0,0,0,1|2,0,1]=4 2363 B13R1.351 NC(=O)C(O)CNc1ccccc1 Amb24696346 [0,0,0,0,0,1|1,0,2]=4 2364 B13R1.351 NC(=O)C(O)COc1ccccc1 Amb22497384 [0,0,0,0,0,1|1,0,2]=4 2365 B13R1.351 NC(=S)C(=O)OCc1ccccc1 Amb25836805 [0,0,0,0,0,1|1,1,0]=3 2366 B13R1.351 NC(=S)C(=S)NCc1ccccc1 Amb24529367 [0,0,0,0,0,1|1,2,0]=4 2367 B13R1.351 NC(C(=O)O)CCc1ccncc1 Amb17470633 [0,0,0,0,0,1|2,0,1]=4 2368 B13R1.351 NC(CCc1cccc[n]1)C(O)=O Amb24117831 [0,0,0,0,0,1|2,0,1]=4 2369 B13R1.351 NC(CNc1ccccc1)C(O)=O Amb25360987 [0,0,0,0,0,1|1,0,1]=3 2370 B13R1.351 NC(CSc1ccccc1)C(O)=O Amb18325246 [0,0,0,0,0,1|1,0,1]=3 2371 B13R1.351 N[C@H](CCc1ccccc1)C(O)=O Amb17872441 [0,0,0,0,0,1|1,0,1]=3 2372 B13R1.351 N[C@H](CNc1ccccc1)C(O)=O Amb24652450 [0,0,0,0,0,1|1,0,1]=3 2373 B13R1.351 N[C@H](\C=C\c1ccccc1)C(O)=O Amb25187708 [0,0,0,0,0,1|1,0,2]=4 2374 B13R1.351 N\C(=N/Nc1ccccc1)\C(O)=O Amb24658773 [0,0,0,0,0,1|2,0,0]=3 2375 B13R1.351 O=C(C(=C)C)OCc1ccccc1 Amb10807491 [0,0,0,0,0,1|2,0,0]=3 2376 B13R1.351 O=C(C(=O)C)C#Cc1ccccc1 Amb10562238 [0,0,0,0,0,1|1,0,1]=3 2377 B13R1.351 O=C(C(=O)C)NCc1ccccc1 Amb17400597 [0,0,0,0,0,1|1,0,0]=2 2378 B13R1.351 O=C(C(=O)C)NCc1ccncc1 Amb17400656 [0,0,0,0,0,1|2,0,0]=3 2379 B13R1.351 O=C(C(=O)O)\C=C\c1ccccc1 Amb16192457 [0,0,0,0,0,1|0,0,1]=2 2380 B13R1.351 O=C(C(=O)O)\C=C\c1ccncc1 Amb17470560 [0,0,0,0,0,1|1,0,1]=3 2381 B13R1.351 O=C(C(O)C)NCc1ccccn1 Amb17400768 [0,0,0,0,0,1|2,0,1]=4 2382 B13R1.351 O=C(C(O)C)NCc1cccnc1 Amb17400769 [0,0,0,0,0,1|2,0,1]=4 2383 B13R1.351 O=C(NCc1ccccc1)C(F)Cl Amb25289199 [0,0,0,0,0,1|2,0,1]=4 2384 B13R1.351 O=C(OCc1ccccc1)C(=O)Cl Amb24687217 [0,0,0,0,0,1|1,0,0]=2 2385 B13R1.351 O=C(OCc1ccccc1)C(F)F Amb25163661 [0,0,0,0,0,1|2,0,1]=4 2386 B13R1.351 O=C([C@H]([NH3+])C)OCc1ccccc1 Amb10807781 [0,0,0,0,0,1|2,0,1]=4 2387 B13R1.351 OC(=O)C(=O)C#Cc1ccccc1 Amb25298732 [0,0,0,0,0,1|0,0,1]=2 2388 B13R1.351 OC(=O)C(=O)NCc1c[n]cc[n]1 Amb24096834 [0,0,0,0,0,1|2,0,0]=3 2389 B13R1.351 OC(=O)C(=O)NCc1cc[n]c[n]1 Amb24495466 [0,0,0,0,0,1|2,0,0]=3 2390 B13R1.351 OC(=O)C(=O)NCc1ccc[n][n]1 Amb25083706 [0,0,0,0,0,1|2,0,0]=3 2391 B13R1.351 OC(=O)C(=O)NNc1cc[n]cc1 Amb24717922 [0,0,0,0,0,1|2,0,0]=3 2392 B13R1.351 OC(=O)C(=O)NNc1ccccc1 Amb18128574 [0,0,0,0,0,1|1,0,0]=2 2393 B13R1.351 OC(=O)C(=O)OCc1ccccc1 Amb18128558 [0,0,0,0,0,1|0,0,0]=1 2394 B13R1.351 OC(=O)C(=O)\C=C\c1ccccn1 Amb17470558 [0,0,0,0,0,1|1,0,1]=3 2395 B13R1.351 OC(=O)C(=O)\C=C\c1cccnc1 Amb17470559 [0,0,0,0,0,1|1,0,1]=3 2396 B13R1.351 OC(=O)C(Br)CCc1ccccc1 Amb18662872 [0,0,0,0,0,1|1,0,1]=3 2397 B13R1.351 OC(=O)C(CCc1ccccn1)C Amb17335286 [0,0,0,0,0,1|2,0,1]=4 2398 B13R1.351 OC(=O)C(CCc1ccccn1)N Amb1101108 [0,0,0,0,0,1|2,0,1]=4 2399 B13R1.351 OC(=O)C(CCc1cccnc1)C Amb17233532 [0,0,0,0,0,1|2,0,1]=4 2400 B13R1.351 OC(=O)C(Cl)\N=N\c1ccccc1 Amb25724891 [0,0,0,0,0,1|2,0,1]=4 2401 B13R1.351 OC(=O)C(F)OCc1ccccc1 Amb25369072 [0,0,0,0,0,1|1,0,1]=3 2402 B13R1.351 OC(=O)C(NCc1ccccn1)C Amb10609128 [0,0,0,0,0,1|2,0,1]=4 2403 B13R1.351 OC(=O)C(NCc1ccccn1)C Amb1110995 [0,0,0,0,0,1|2,0,1]=4 2404 B13R1.351 OC(=O)C(NCc1cccnc1)C Amb10199875 [0,0,0,0,0,1|2,0,1]=4 2405 B13R1.351 OC(=O)C(NCc1cccnc1)C Amb1110808 [0,0,0,0,0,1|2,0,1]=4 2406 B13R1.351 OC(=O)C(O)C#Cc1ccccc1 Amb25111134 [0,0,0,0,0,1|0,0,3]=4 2407 B13R1.351 OC(=O)\C(\Cl)=C\Sc1ccccc1 Amb24587115 [0,0,0,0,0,1|1,0,1]=3 2408 B13R1.351 OC(=O)\C(\F)=C\Cc1ccccc1 Amb25265375 [0,0,0,0,0,1|1,0,0]=2 2409 B13R1.351 OC(=O)\C(\F)=C\Sc1ccccc1 Amb25288171 [0,0,0,0,0,1|1,0,1]=3 2410 B13R1.351 OC(=O)\C(\S)=N\Nc1ccccc1 Amb18130277 [0,0,0,0,0,1|1,1,0]=3 2411 B13R1.351 OC(C(=O)O)\C=C\c1ccccc1 Amb17594531 [0,0,0,0,0,1|0,0,3]=4 2412 B13R1.351 O[C@H](C(=O)O)CCc1ccccc1 Amb10603260 [0,0,0,0,0,1|0,0,2]=3 2413 B13R1.351 O\C(=C/Nc1ccccc1)\C(O)=O Amb24677773 [0,0,0,0,0,1|0,0,2]=3 2414 B13R1.351 [O-]C(=O)C(=O)C=Cc1ccccc1 Amb22484596 [0,0,0,0,0,1|0,0,2]=3 2415 B13R1.351 [O-]C(=O)C(=O)NCc1cccc[n]1 Amb21953022 [0,0,0,0,0,1|1,0,1]=3 2416 B10R0.26 OC(=O)C(=O)C\C(\Cl)=C/C=O Amb25385010 [1,0,1,0,0,0|2,0,0]=4 2417 B10R0.4 C=C\C=C\C=C\C=C\C(O)=O Amb25386381 [1,0,1,0,0,0|0,0,1]=3 2418 B10R0.75 C\C(=C/C=C/C=C/C)\C(O)=O Amb24373133 [1,0,1,0,0,0|1,0,1]=4 2419 B10R1.17 Br\C=C/Oc1ccccc1 Amb25794486 [2,0,0,0,0,0|2,0,0]=4 2420 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [2,0,0,0,0,0|1,0,0]=3 2421 B10R1.17 C=C/C=C/c1ccccc1 Amb17938988 [2,0,0,0,0,0|1,0,1]=4 2422 B10R1.17 C=CNCc1ccccc1 Amb24505107 [2,0,0,0,0,0|2,0,0]=4 2423 B10R1.17 C=COCc1ccccc1 Amb17940722 [2,0,0,0,0,0|2,0,0]=4 2424 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [2,0,0,0,0,0|2,0,0]=4 2425 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [2,0,0,0,0,0|2,0,0]=4 2426 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [2,0,0,0,0,0|2,0,0]=4 2427 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [2,0,0,0,0,0|1,0,0]=3 2428 B10R1.17 Cl\C=C\C[n+]1ccccc1 Amb24396864 [2,0,0,0,0,0|2,0,0]=4 2429 B10R1.17 Cl\C=C\Cc1cc[n]cc1 Amb24697784 [2,0,0,0,0,0|2,0,0]=4 2430 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [2,0,0,0,0,0|1,0,0]=3 2431 B10R1.17 N=COCc1ccccc1 Amb22269902 [2,0,0,0,0,0|2,0,0]=4 2432 B10R1.17 N=COCc1ccccc1 Amb24652885 [2,0,0,0,0,0|2,0,0]=4 2433 B10R1.17 O=CCCc1ccccn1 Amb17081674 [2,0,0,0,0,0|1,0,1]=4 2434 B10R1.17 O=CCCc1cccnc1 Amb17081675 [2,0,0,0,0,0|1,0,1]=4 2435 B10R1.17 O=CCNc1ccccc1 Amb24566865 [2,0,0,0,0,0|1,0,1]=4 2436 B10R1.17 O=CCSc1ccccc1 Amb17082903 [2,0,0,0,0,0|1,0,1]=4 2437 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [2,0,0,0,0,0|2,0,0]=4 2438 B10R1.17 O=CNCc1ccccc1 Amb1916036 [2,0,0,0,0,0|1,0,0]=3 2439 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [2,0,0,0,0,0|0,0,1]=3 2440 B10R1.17 O=C\C=C\c1cc[n]cc1 Amb24325387 [2,0,0,0,0,0|1,0,1]=4 2441 B10R1.17 O=C\C=C\c1ccccn1 Amb17334135 [2,0,0,0,0,0|1,0,1]=4 2442 B10R1.17 O=C\C=C\c1cccnc1 Amb17334136 [2,0,0,0,0,0|1,0,1]=4 2443 B10R1.17 O=C\C=C\c1ccncc1 Amb17334137 [2,0,0,0,0,0|1,0,1]=4 2444 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [2,0,0,0,0,0|1,0,0]=3 2445 B10R1.17 OCNCc1ccccc1 Amb24756521 [2,0,0,0,0,0|1,0,1]=4 2446 B10R1.17 OCOCc1ccccc1 Amb25727798 [2,0,0,0,0,0|1,0,1]=4 2447 B10R1.17 OC\C=N\c1ccccc1 Amb25740591 [2,0,0,0,0,0|1,0,1]=4 2448 B10R1.17 ONCCc1ccccc1 Amb24117032 [2,0,0,0,0,0|1,0,1]=4 2449 B10R1.18 C=C(Cl)C[n+]1ccccc1 Amb24717958 [2,0,0,0,0,0|2,0,0]=4 2450 B10R1.18 C=C(F)Sc1ccccc1 Amb24630548 [2,0,0,0,0,0|2,0,0]=4 2451 B10R1.18 C=[N+]([O-])Cc1ccccc1 Amb24708106 [2,0,0,0,0,0|1,0,1]=4 2452 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [2,0,0,0,0,0|2,0,0]=4 2453 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [2,0,0,0,0,0|1,0,1]=4 2454 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [2,0,0,0,0,0|1,0,1]=4 2455 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [2,0,0,0,0,0|1,0,1]=4 2456 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [2,0,0,0,0,0|1,0,1]=4 2457 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [2,0,0,0,0,0|1,0,1]=4 2458 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [2,0,0,0,0,0|1,0,1]=4 2459 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [2,0,0,0,0,0|1,0,1]=4 2460 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [2,0,0,0,0,0|1,0,1]=4 2461 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [2,0,0,0,0,0|1,0,1]=4 2462 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [2,0,0,0,0,0|1,0,1]=4 2463 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [2,0,0,0,0,0|1,0,1]=4 2464 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [2,0,0,0,0,0|1,0,1]=4 2465 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [2,0,0,0,0,0|1,0,1]=4 2466 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [2,0,0,0,0,0|1,0,1]=4 2467 B10R1.18 N=C(O)Nc1ccccc1 Amb19516159 [2,0,0,0,0,0|2,0,0]=4 2468 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [2,0,0,0,0,0|2,0,0]=4 2469 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [2,0,0,0,0,0|1,0,0]=3 2470 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [2,0,0,0,0,0|2,0,0]=4 2471 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [2,0,0,0,0,0|1,1,0]=4 2472 B10R1.18 NC(O)Cc1ccccc1 Amb25348475 [2,0,0,0,0,0|1,0,1]=4 2473 B10R1.18 N[C@@H](O)Cc1ccccc1 Amb25790547 [2,0,0,0,0,0|1,0,1]=4 2474 B10R1.18 N[C@H](O)Cc1ccccc1 Amb24444592 [2,0,0,0,0,0|1,0,1]=4 2475 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [2,0,0,0,0,0|2,0,0]=4 2476 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [2,0,0,0,0,0|2,0,0]=4 2477 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [2,0,0,0,0,0|2,0,0]=4 2478 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [2,0,0,0,0,0|2,0,0]=4 2479 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [2,0,0,0,0,0|2,0,0]=4 2480 B10R1.18 OB(Cc1ccccc1)O Amb10071580 [2,0,0,0,0,0|1,0,1]=4 2481 B10R1.18 OC(=O)CC=1CC=CCC1 Amb24120619 [2,0,0,0,0,0|0,0,2]=4 2482 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [2,0,0,0,0,0|0,0,0]=2 2483 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [2,0,0,0,0,0|1,0,0]=3 2484 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [2,0,0,0,0,0|1,0,0]=3 2485 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [2,0,0,0,0,0|1,0,0]=3 2486 B10R1.18 OC(=O)Cc1c[n]cc[n]1 Amb19929342 [2,0,0,0,0,0|2,0,0]=4 2487 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [2,0,0,0,0,0|1,0,0]=3 2488 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [2,0,0,0,0,0|1,0,0]=3 2489 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [2,0,0,0,0,0|1,0,0]=3 2490 B10R1.18 OC(=O)Cc1cnccn1 Amb10602133 [2,0,0,0,0,0|2,0,0]=4 2491 B10R1.18 OC(=O)Nc1cc[n]cc1 Amb24070647 [2,0,0,0,0,0|2,0,0]=4 2492 B10R1.18 OC(=O)Nc1ccc[n]c1 Amb24102579 [2,0,0,0,0,0|2,0,0]=4 2493 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [2,0,0,0,0,0|0,0,0]=2 2494 B10R1.18 OC(=S)Cc1cc[n]cc1 Amb24099577 [2,0,0,0,0,0|1,1,0]=4 2495 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [2,0,0,0,0,0|0,1,0]=3 2496 B10R1.18 OC(=S)Nc1ccccc1 Amb24669066 [2,0,0,0,0,0|1,1,0]=4 2497 B10R1.18 OC(F)Cc1ccccc1 Amb25147731 [2,0,0,0,0,0|1,0,1]=4 2498 B10R1.18 OC(O)Cc1ccccc1 Amb24639712 [2,0,0,0,0,0|0,0,2]=4 2499 B10R1.18 OP(=O)Cc1cccc[n]1 Amb25787147 [2,0,0,0,0,0|2,0,0]=4 2500 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [2,0,0,0,0,0|1,0,0]=3 2501 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [2,0,0,0,0,0|2,0,0]=4 2502 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [2,0,0,0,0,0|0,0,0]=2 2503 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [2,0,0,0,0,0|0,0,0]=2 2504 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [2,0,0,0,0,0|0,0,0]=2 2505 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [2,0,0,0,0,0|0,1,0]=3 2506 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [2,0,0,0,0,0|1,0,1]=4 2507 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [2,0,0,0,0,0|1,0,1]=4 2508 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [2,0,0,0,0,0|1,0,1]=4 2509 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [2,0,0,0,0,0|1,0,1]=4 2510 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [2,0,0,0,0,0|1,0,1]=4 2511 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [2,0,0,0,0,0|1,0,1]=4 2512 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [2,0,0,0,0,0|0,0,1]=3 2513 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [2,0,0,0,0,0|0,0,1]=3 2514 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [2,0,0,0,0,0|1,0,1]=4 2515 B12R1.32 C#CCC(=O)Cc1ccccc1 Amb18799925 [1,1,0,0,0,0|1,0,1]=4 2516 B12R1.32 C=C=CC(=O)Cc1ccccc1 Amb25713668 [1,1,0,0,0,0|1,0,0]=3 2517 B12R1.32 C=CCC(=O)Nc1ccccc1 Amb25123880 [1,1,0,0,0,0|2,0,0]=4 2518 B12R1.32 C=CNC(=O)Oc1ccccc1 Amb25159436 [1,1,0,0,0,0|2,0,0]=4 2519 B12R1.32 C=COC(=O)Cc1ccccc1 Amb17934203 [1,1,0,0,0,0|1,0,0]=3 2520 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [1,1,0,0,0,0|2,0,0]=4 2521 B12R1.32 CONC(=O)Cc1ccccc1 Amb16969924 [1,1,0,0,0,0|1,0,0]=3 2522 B12R1.32 CONC(=O)Oc1ccccc1 Amb16969957 [1,1,0,0,0,0|2,0,0]=4 2523 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [1,1,0,0,0,0|1,0,1]=4 2524 B12R1.32 C\C(=C/C=O)\Nc1ccccc1 Amb18645507 [1,1,0,0,0,0|2,0,0]=4 2525 B12R1.32 C\C(=C/C=O)\Oc1ccccc1 Amb25326052 [1,1,0,0,0,0|2,0,0]=4 2526 B12R1.32 C\C(=C/C=O)\Sc1ccccc1 Amb18648150 [1,1,0,0,0,0|2,0,0]=4 2527 B12R1.32 C\C(=C\C=O)\Nc1ccccc1 Amb24611198 [1,1,0,0,0,0|2,0,0]=4 2528 B12R1.32 C\C(\CC=O)=C/c1ccccc1 Amb18126261 [1,1,0,0,0,0|1,0,1]=4 2529 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [1,1,0,0,0,0|1,0,0]=3 2530 B12R1.32 C\C(\Cc1ccccc1)=C\C#N Amb24595292 [1,1,0,0,0,0|2,0,0]=4 2531 B12R1.32 C\C(\Cc1ccccc1)=C\CN Amb25669583 [1,1,0,0,0,0|2,0,0]=4 2532 B12R1.32 C\C=C\C(=O)Nc1ccccc1 Amb24497299 [1,1,0,0,0,0|2,0,0]=4 2533 B12R1.32 Cl\C(\Cc1ccccc1)=C/CCl Amb25035226 [1,1,0,0,0,0|2,0,0]=4 2534 B12R1.32 Cl\C(\Cc1ccccc1)=C\CCl Amb24563867 [1,1,0,0,0,0|2,0,0]=4 2535 B12R1.32 N#CCC(=O)Cc1ccccc1 Amb17232286 [1,1,0,0,0,0|1,0,1]=4 2536 B12R1.32 N#CNC(=O)Cc1ccccc1 Amb25149956 [1,1,0,0,0,0|1,0,1]=4 2537 B12R1.32 NOCC(=O)Nc1ccccc1 Amb24596278 [1,1,0,0,0,0|1,0,1]=4 2538 B12R1.32 NOCC(=O)Oc1ccccc1 Amb24096859 [1,1,0,0,0,0|1,0,1]=4 2539 B12R1.32 N\N=C\C(=O)Cc1ccccc1 Amb25046103 [1,1,0,0,0,0|1,0,0]=3 2540 B12R1.32 O=C(C=C=O)Nc1ccccc1 Amb24441652 [1,1,0,0,0,0|1,0,0]=3 2541 B12R1.32 O=C(Cc1c[n]ccc1)N=C=O Amb25071469 [1,1,0,0,0,0|1,0,1]=4 2542 B12R1.32 O=C(Cc1cccc[n]1)N=C=O Amb25204303 [1,1,0,0,0,0|1,0,1]=4 2543 B12R1.32 O=C(Cc1ccccc1)\C=C\Cl Amb25216983 [1,1,0,0,0,0|1,0,0]=3 2544 B12R1.32 O=C(N=C=O)Oc1ccccc1 Amb22348017 [1,1,0,0,0,0|1,0,1]=4 2545 B12R1.32 O=C(NC=O)Nc1ccccc1 Amb22347423 [1,1,0,0,0,0|1,0,0]=3 2546 B12R1.32 O=C(\C=C\F)Nc1ccccc1 Amb24386157 [1,1,0,0,0,0|2,0,0]=4 2547 B12R1.32 O=C=NC(=O)Cc1ccccc1 Amb17232352 [1,1,0,0,0,0|0,0,1]=3 2548 B12R1.32 OCNC(=O)C[n+]1ccccc1 Amb25046777 [1,1,0,0,0,0|1,0,1]=4 2549 B12R1.32 OCNC(=O)Oc1ccccc1 Amb10552983 [1,1,0,0,0,0|1,0,1]=4 2550 B12R1.32 ON=CC(Cl)=Cc1ccccc1 Amb24061196 [1,1,0,0,0,0|1,0,1]=4 2551 B12R1.32 ONCC(=O)Nc1ccccc1 Amb24495972 [1,1,0,0,0,0|1,0,1]=4 2552 B12R1.32 O\C=C/C(=S)Nc1ccccc1 Amb24495245 [1,1,0,0,0,0|1,1,0]=4 2553 B12R1.32 O\C=C\C(=O)Cc1ccccc1 Amb25093804 [1,1,0,0,0,0|0,0,0]=2 2554 B12R1.32 O\C=C\C(=S)Nc1ccccc1 Amb24592387 [1,1,0,0,0,0|1,1,0]=4 2555 B12R1.32 O\N=C\C(=O)Cc1ccccc1 Amb24577781 [1,1,0,0,0,0|0,0,0]=2 2556 B12R1.32 O\N=C\C(=O)Nc1ccccc1 Amb1205570 [1,1,0,0,0,0|1,0,0]=3 2557 B12R1.32 O\N=C\C(Br)=Cc1ccccc1 Amb25852504 [1,1,0,0,0,0|1,0,1]=4 2558 B12R1.32 O\N=C\C(Cl)=Cc1ccccc1 Amb25855465 [1,1,0,0,0,0|1,0,1]=4 2559 B12R1.32 O\N=C\C(O)Cc1ccccc1 Amb25136306 [1,1,0,0,0,0|0,0,2]=4 2560 B12R1.32 [K]ONC(=O)Cc1ccccc1 Amb10558422 [1,1,0,0,0,0|1,0,0]=3 2561 B12R1.32 [N-]=[N+]=CC(=O)Oc1ccccc1 Amb24576332 [1,1,0,0,0,0|2,0,0]=4 2562 B12R1.34 C#CC(=O)C(N)c1ccccc1 Amb24460507 [1,1,0,0,0,0|1,0,1]=4 2563 B12R1.34 C#CC(=O)C(O)c1ccccc1 Amb25373683 [1,1,0,0,0,0|1,0,1]=4 2564 B12R1.34 C#CC(=O)[C@H](N)c1ccccc1 Amb24426693 [1,1,0,0,0,0|1,0,1]=4 2565 B12R1.34 C=C(C(=O)C=C)c1ccccc1 Amb24559066 [1,1,0,0,0,0|1,0,1]=4 2566 B12R1.34 C=C(C=C)C(O)c1ccccc1 Amb25334723 [1,1,0,0,0,0|2,0,0]=4 2567 B12R1.34 C=C(C=C)[C@@H](O)c1ccccc1 Amb25215362 [1,1,0,0,0,0|2,0,0]=4 2568 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [1,1,0,0,0,0|1,0,0]=3 2569 B12R1.34 C=C(CO)C(O)c1ccccc1 Amb24671500 [1,1,0,0,0,0|1,0,1]=4 2570 B12R1.34 C=CC(=O)[C@H](F)c1ccccc1 Amb24676844 [1,1,0,0,0,0|1,0,0]=3 2571 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [1,1,0,0,0,0|1,0,0]=3 2572 B12R1.34 CC(C(=O)CBr)c1ccccc1 Amb25134301 [1,1,0,0,0,0|1,0,1]=4 2573 B12R1.34 CC(C(=O)CCl)c1ccccc1 Amb25150842 [1,1,0,0,0,0|1,0,1]=4 2574 B12R1.34 CC(C(=O)CN)c1ccccc1 Amb24535411 [1,1,0,0,0,0|1,0,1]=4 2575 B12R1.34 CC(C(=O)NO)c1ccccc1 Amb25800798 [1,1,0,0,0,0|1,0,0]=3 2576 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [1,1,0,0,0,0|1,0,1]=4 2577 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [1,1,0,0,0,0|1,0,1]=4 2578 B12R1.34 CC(N(C)C=O)c1ccccc1 Amb17672989 [1,1,0,0,0,0|2,0,0]=4 2579 B12R1.34 CC(\C(\N)=N\O)c1ccccc1 Amb24595995 [1,1,0,0,0,0|2,0,0]=4 2580 B12R1.34 CCC(=O)C(c1ccccc1)Br Amb17596238 [1,1,0,0,0,0|1,0,1]=4 2581 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [1,1,0,0,0,0|1,0,1]=4 2582 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [1,1,0,0,0,0|1,0,1]=4 2583 B12R1.34 CCC(=O)[C@H](N)c1ccccc1 Amb25757342 [1,1,0,0,0,0|1,0,1]=4 2584 B12R1.34 CNC(=O)C(c1ccccc1)N Amb10609276 [1,1,0,0,0,0|2,0,0]=4 2585 B12R1.34 CNC(=O)C(c1ccccc1)O Amb17400179 [1,1,0,0,0,0|2,0,0]=4 2586 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [1,1,0,0,0,0|2,0,0]=4 2587 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [1,1,0,0,0,0|2,0,0]=4 2588 B12R1.34 CNC(=O)[C@H](N)c1ccccc1 Amb24678684 [1,1,0,0,0,0|2,0,0]=4 2589 B12R1.34 CNC(=O)[C@H](O)c1ccccc1 Amb25792321 [1,1,0,0,0,0|2,0,0]=4 2590 B12R1.34 CNC(=O)[C@H](c1ccccc1)N Amb17232478 [1,1,0,0,0,0|2,0,0]=4 2591 B12R1.34 COC(=O)C(F)c1ccccc1 Amb24179152 [1,1,0,0,0,0|2,0,0]=4 2592 B12R1.34 COC(=O)C(O)c1ccccc1 Amb22500374 [1,1,0,0,0,0|2,0,0]=4 2593 B12R1.34 COC(=O)C(c1ccccc1)C Amb16185437 [1,1,0,0,0,0|2,0,0]=4 2594 B12R1.34 COC(=O)C(c1ccccc1)Cl Amb1212399 [1,1,0,0,0,0|2,0,0]=4 2595 B12R1.34 COC(=O)C(c1ccccc1)N Amb1196141 [1,1,0,0,0,0|2,0,0]=4 2596 B12R1.34 COC(=O)C(c1ccccc1)N Amb1911591 [1,1,0,0,0,0|2,0,0]=4 2597 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [1,1,0,0,0,0|2,0,0]=4 2598 B12R1.34 COC(=O)[C@H](Cl)c1ccccc1 Amb25210876 [1,1,0,0,0,0|2,0,0]=4 2599 B12R1.34 COC(=O)[C@H](N)c1ccccc1 Amb20240647 [1,1,0,0,0,0|2,0,0]=4 2600 B12R1.34 C[C@@H](C(=O)NN)c1ccccc1 Amb25361548 [1,1,0,0,0,0|2,0,0]=4 2601 B12R1.34 C[C@@H](C(=O)NO)c1ccccc1 Amb24722255 [1,1,0,0,0,0|1,0,0]=3 2602 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [1,1,0,0,0,0|1,0,1]=4 2603 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [1,1,0,0,0,0|1,0,1]=4 2604 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [1,1,0,0,0,0|1,0,1]=4 2605 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [1,1,0,0,0,0|1,0,1]=4 2606 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [1,1,0,0,0,0|1,0,0]=3 2607 B12R1.34 C[C@H](C(=O)NO)c1ccccc1 Amb24459061 [1,1,0,0,0,0|1,0,0]=3 2608 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [1,1,0,0,0,0|1,0,1]=4 2609 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [1,1,0,0,0,0|1,0,1]=4 2610 B12R1.34 C\C(=C(\F)/C=O)\c1ccccc1 Amb24757282 [1,1,0,0,0,0|1,0,1]=4 2611 B12R1.34 C\C(=C\O)\C(=O)c1ccccc1 Amb24725291 [1,1,0,0,0,0|1,0,1]=4 2612 B12R1.34 C\C(=N/O)\C(C)c1ccccc1 Amb24518613 [1,1,0,0,0,0|2,0,0]=4 2613 B12R1.34 C\C(\C=O)=C(\Cl)/c1ccccc1 Amb18648444 [1,1,0,0,0,0|1,0,1]=4 2614 B12R1.34 C\C(\C=O)=C(\S)/c1ccccc1 Amb18648152 [1,1,0,0,0,0|1,0,1]=4 2615 B12R1.34 C\C(\c1ccccc1)=C(\C)/C=O Amb18645379 [1,1,0,0,0,0|1,0,1]=4 2616 B12R1.34 C\C=C(/Cl)\C(Cl)c1ccccc1 Amb24728456 [1,1,0,0,0,0|2,0,0]=4 2617 B12R1.34 C\C=C(\Cl)/C(Cl)c1ccccc1 Amb24593524 [1,1,0,0,0,0|2,0,0]=4 2618 B12R1.34 C\C=C(\Cl)/C(O)c1ccccc1 Amb25092807 [1,1,0,0,0,0|2,0,0]=4 2619 B12R1.34 NC(=S=O)C(N)c1ccccc1 Amb24739656 [1,1,0,0,0,0|2,0,0]=4 2620 B12R1.34 NC(C(=O)CCl)c1ccccc1 Amb24341671 [1,1,0,0,0,0|1,0,1]=4 2621 B12R1.34 NNC(=O)C(F)c1ccccc1 Amb25799083 [1,1,0,0,0,0|2,0,0]=4 2622 B12R1.34 NNC(=O)C(N)c1ccccc1 Amb18061964 [1,1,0,0,0,0|2,0,0]=4 2623 B12R1.34 NNC(=O)C(S)c1ccccc1 Amb24716717 [1,1,0,0,0,0|2,0,0]=4 2624 B12R1.34 NNC(=O)C(c1ccccc1)O Amb1786264 [1,1,0,0,0,0|2,0,0]=4 2625 B12R1.34 NNC(=O)[C@@H](O)c1ccccc1 Amb22587557 [1,1,0,0,0,0|2,0,0]=4 2626 B12R1.34 NNC(=O)[C@H](O)c1ccccc1 Amb25121730 [1,1,0,0,0,0|2,0,0]=4 2627 B12R1.34 N[C@@H](C(=O)C#N)c1ccccc1 Amb24483753 [1,1,0,0,0,0|1,0,1]=4 2628 B12R1.34 N[C@@H](C(=O)NO)c1ccccc1 Amb25061821 [1,1,0,0,0,0|1,0,0]=3 2629 B12R1.34 N\C(=N\O)\C(O)c1ccccc1 Amb22052910 [1,1,0,0,0,0|2,0,0]=4 2630 B12R1.34 O=C(CCl)C(F)c1ccccc1 Amb24390277 [1,1,0,0,0,0|1,0,1]=4 2631 B12R1.34 O=C(O[SiH3])C(Cl)c1ccccc1 Amb25313110 [1,1,0,0,0,0|2,0,0]=4 2632 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [1,1,0,0,0,0|1,0,1]=4 2633 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [1,1,0,0,0,0|1,0,1]=4 2634 B12R1.34 O=CN(C(c1ccccc1)C)O Amb10606548 [1,1,0,0,0,0|1,0,1]=4 2635 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [1,1,0,0,0,0|1,0,1]=4 2636 B12R1.34 O=C\C(\F)=C(/F)\c1ccccc1 Amb18646831 [1,1,0,0,0,0|1,0,1]=4 2637 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [1,1,0,0,0,0|0,0,2]=4 2638 B12R1.34 OC(c1ccccc1)\C(\F)=C\F Amb25317636 [1,1,0,0,0,0|2,0,0]=4 2639 B12R1.34 OCC(=O)C(O)c1ccc[n]c1 Amb25059701 [1,1,0,0,0,0|1,0,1]=4 2640 B12R1.34 OCC(=O)C(O)c1ccccc1 Amb24364158 [1,1,0,0,0,0|0,0,1]=3 2641 B12R1.34 OCC(=O)[C@@H](O)c1ccccc1 Amb24357245 [1,1,0,0,0,0|0,0,1]=3 2642 B12R1.34 ONC(=O)C(Cl)c1ccccc1 Amb25361902 [1,1,0,0,0,0|1,0,0]=3 2643 B12R1.34 ONC(=O)C(F)c1ccccc1 Amb25777677 [1,1,0,0,0,0|1,0,0]=3 2644 B12R1.34 ONC(=O)C(O)c1ccc[n]c1 Amb25279670 [1,1,0,0,0,0|2,0,0]=4 2645 B12R1.34 ONC(=O)C(c1ccccc1)N Amb2430893 [1,1,0,0,0,0|1,0,0]=3 2646 B12R1.34 ONC(=O)[C@@H](O)c1ccccc1 Amb25071532 [1,1,0,0,0,0|1,0,0]=3 2647 B12R1.34 ONC(=O)[C@H](O)c1ccccc1 Amb25787201 [1,1,0,0,0,0|1,0,0]=3 2648 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [1,1,0,0,0,0|0,0,2]=4 2649 B12R1.34 O[C@H](c1ccccc1)C(=O)N=O Amb25157813 [1,1,0,0,0,0|1,0,0]=3 2650 B12R1.34 O[C@H](c1ccccc1)\C(\F)=C\F Amb25157818 [1,1,0,0,0,0|2,0,0]=4 2651 B12R1.34 O\C(=C/O)\C(=O)c1ccccc1 Amb24662497 [1,1,0,0,0,0|0,0,2]=4 2652 B12R1.34 O\C(=C\O)\C(=O)c1ccccc1 Amb25358915 [1,1,0,0,0,0|0,0,2]=4 2653 B12R1.49 C#CC(=O)Cc1ccc(Br)cc1 Amb24700806 [1,1,0,0,0,0|1,0,1]=4 2654 B12R1.49 C#CC(=O)Cc1ccc(Cl)cc1 Amb25710197 [1,1,0,0,0,0|1,0,1]=4 2655 B12R1.49 C#CC(=O)Cc1ccc(F)cc1 Amb25340982 [1,1,0,0,0,0|1,0,1]=4 2656 B12R1.49 C=C(Cc1ccc(Cl)cc1)C=O Amb25733131 [1,1,0,0,0,0|1,0,0]=3 2657 B12R1.49 C=C(Cc1ccc(F)cc1)C=O Amb24380075 [1,1,0,0,0,0|1,0,0]=3 2658 B12R1.49 C=CC(=O)Cc1ccc(Br)cc1 Amb25710195 [1,1,0,0,0,0|1,0,0]=3 2659 B12R1.49 C=CC(=O)Cc1ccc(Cl)cc1 Amb25715125 [1,1,0,0,0,0|1,0,0]=3 2660 B12R1.49 C=CC(=O)Nc1ccc(N)cc1 Amb24483453 [1,1,0,0,0,0|2,0,0]=4 2661 B12R1.49 C=CC(=O)Nc1ccc(cc1)[Hg+] Amb17607706 [1,1,0,0,0,0|2,0,0]=4 2662 B12R1.49 C=CC(=O)Oc1ccc(Br)cc1 Amb22497276 [1,1,0,0,0,0|2,0,0]=4 2663 B12R1.49 C=CC(=O)Oc1ccc(Cl)cc1 Amb17933976 [1,1,0,0,0,0|2,0,0]=4 2664 B12R1.49 C=CC(=O)Oc1ccc(F)cc1 Amb25281891 [1,1,0,0,0,0|2,0,0]=4 2665 B12R1.49 CC(Cc1ccc(Br)cc1)C=O Amb25060263 [1,1,0,0,0,0|1,0,1]=4 2666 B12R1.49 CC(Cc1ccc(Cl)cc1)C=O Amb18648716 [1,1,0,0,0,0|1,0,1]=4 2667 B12R1.49 CC(Cc1ccc(O)cc1)C=O Amb18646060 [1,1,0,0,0,0|1,0,1]=4 2668 B12R1.49 CCC(=O)Cc1ccc(I)cc1 Amb25229794 [1,1,0,0,0,0|1,0,1]=4 2669 B12R1.49 CCC(=O)Cc1ccc(O)cc1 Amb18646040 [1,1,0,0,0,0|1,0,1]=4 2670 B12R1.49 CCC(=O)Cc1ccc(cc1)Br Amb17477612 [1,1,0,0,0,0|1,0,1]=4 2671 B12R1.49 CCC(=O)Cc1ccc(cc1)C Amb17138536 [1,1,0,0,0,0|1,0,1]=4 2672 B12R1.49 CCC(=O)Cc1ccc(cc1)Cl Amb17139038 [1,1,0,0,0,0|1,0,1]=4 2673 B12R1.49 CCC(=O)Cc1ccc(cc1)F Amb17138600 [1,1,0,0,0,0|1,0,1]=4 2674 B12R1.49 CN(Cc1ccc(O)cc1)C=O Amb18792633 [1,1,0,0,0,0|2,0,0]=4 2675 B12R1.49 CNC(=O)Cc1ccc(I)cc1 Amb25680399 [1,1,0,0,0,0|2,0,0]=4 2676 B12R1.49 CNC(=O)Cc1ccc(O)cc1 Amb18646280 [1,1,0,0,0,0|2,0,0]=4 2677 B12R1.49 CNC(=O)Cc1ccc(S)cc1 Amb24346465 [1,1,0,0,0,0|2,0,0]=4 2678 B12R1.49 CNC(=O)Cc1ccc(cc1)C Amb1795465 [1,1,0,0,0,0|2,0,0]=4 2679 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb1117771 [1,1,0,0,0,0|2,0,0]=4 2680 B12R1.49 CNC(=O)Cc1ccc(cc1)N Amb15740907 [1,1,0,0,0,0|2,0,0]=4 2681 B12R1.49 COC(=O)Cc1ccc(cc1)I Amb10601390 [1,1,0,0,0,0|2,0,0]=4 2682 B12R1.49 C\C(=C\c1ccc(N)cc1)\C=O Amb24605302 [1,1,0,0,0,0|1,0,1]=4 2683 B12R1.49 C\C(\C=O)=C\c1ccc(Br)cc1 Amb25823713 [1,1,0,0,0,0|1,0,1]=4 2684 B12R1.49 C\C(\C=O)=C\c1ccc(F)cc1 Amb25857570 [1,1,0,0,0,0|1,0,1]=4 2685 B12R1.49 C\C(\C=O)=C\c1ccc(I)cc1 Amb24571541 [1,1,0,0,0,0|1,0,1]=4 2686 B12R1.49 C\C(\Cc1ccc(Cl)cc1)=N\O Amb25159945 [1,1,0,0,0,0|2,0,0]=4 2687 B12R1.49 C\C(\Cc1ccc(F)cc1)=N\O Amb24359271 [1,1,0,0,0,0|2,0,0]=4 2688 B12R1.49 C\C(\Cc1ccc(I)cc1)=N\O Amb25258473 [1,1,0,0,0,0|2,0,0]=4 2689 B12R1.49 C\C(\Cc1ccc(O)cc1)=N\O Amb25371887 [1,1,0,0,0,0|2,0,0]=4 2690 B12R1.49 Cc1ccc(CC(=C)C=O)cc1 Amb24653692 [1,1,0,0,0,0|1,0,0]=3 2691 B12R1.49 Cc1ccc(CC(=O)C=C)cc1 Amb25069127 [1,1,0,0,0,0|1,0,0]=3 2692 B12R1.49 Cc1ccc(CC(=O)C=O)cc1 Amb24567096 [1,1,0,0,0,0|0,0,0]=2 2693 B12R1.49 Cc1ccc(CC(=O)CN)cc1 Amb18829243 [1,1,0,0,0,0|1,0,1]=4 2694 B12R1.49 Cc1ccc(CC(=O)CO)cc1 Amb18563613 [1,1,0,0,0,0|0,0,1]=3 2695 B12R1.49 Cc1ccc(CC(=O)NO)c[n]1 Amb25144208 [1,1,0,0,0,0|2,0,0]=4 2696 B12R1.49 Cc1ccc(CC(C)C=O)cc1 Amb18645702 [1,1,0,0,0,0|1,0,1]=4 2697 B12R1.49 Cc1ccc(CC(F)C=O)cc1 Amb24715586 [1,1,0,0,0,0|1,0,1]=4 2698 B12R1.49 Cc1ccc(CC(O)C=O)cc1 Amb24466339 [1,1,0,0,0,0|0,0,2]=4 2699 B12R1.49 Cc1ccc(CN(C)C=O)cc1 Amb24601810 [1,1,0,0,0,0|2,0,0]=4 2700 B12R1.49 Cc1ccc(C\C(\C)=N/O)cc1 Amb24563486 [1,1,0,0,0,0|2,0,0]=4 2701 B12R1.49 Cc1ccc(\C=C(/O)\C=O)cc1 Amb18645658 [1,1,0,0,0,0|0,0,2]=4 2702 B12R1.49 Cc1ccc(\C=C(\C)/C=O)cc1 Amb25667362 [1,1,0,0,0,0|1,0,1]=4 2703 B12R1.49 Cc1ccc(\C=C(\Cl)/C=O)cc1 Amb25674237 [1,1,0,0,0,0|1,0,1]=4 2704 B12R1.49 Cc1ccc(\C=C(\O)/C=O)cc1 Amb25179856 [1,1,0,0,0,0|0,0,2]=4 2705 B12R1.49 Cc1ccc(cc1)NC(=O)C=O Amb25690866 [1,1,0,0,0,0|1,0,0]=3 2706 B12R1.49 Cc1ccc(cc1)OC(=O)C=C Amb24493128 [1,1,0,0,0,0|2,0,0]=4 2707 B12R1.49 Cc1ccc(cc1)OC(=O)CO Amb25829911 [1,1,0,0,0,0|1,0,1]=4 2708 B12R1.49 Cc1ccc(cc1)SC(=C)C=O Amb24497102 [1,1,0,0,0,0|2,0,0]=4 2709 B12R1.49 N#CC(=O)Cc1ccc(Cl)cc1 Amb22498650 [1,1,0,0,0,0|1,0,1]=4 2710 B12R1.49 N=C(Cc1ccc(O)cc1)NO Amb22494626 [1,1,0,0,0,0|2,0,0]=4 2711 B12R1.49 NCC(=O)Cc1ccc(Br)cc1 Amb18160380 [1,1,0,0,0,0|1,0,1]=4 2712 B12R1.49 NCC(=O)Cc1ccc(Cl)cc1 Amb18823029 [1,1,0,0,0,0|1,0,1]=4 2713 B12R1.49 NCC(=O)Cc1ccc(F)cc1 Amb18827238 [1,1,0,0,0,0|1,0,1]=4 2714 B12R1.49 NCC(=O)Cc1ccc(O)cc1 Amb25369044 [1,1,0,0,0,0|1,0,1]=4 2715 B12R1.49 NNC(=O)Cc1ccc(cc1)C Amb1921793 [1,1,0,0,0,0|2,0,0]=4 2716 B12R1.49 N[C@@H](Cc1ccc(O)cc1)C=O Amb24106989 [1,1,0,0,0,0|1,0,1]=4 2717 B12R1.49 N\C(\Cc1ccc(I)cc1)=N\O Amb24454140 [1,1,0,0,0,0|2,0,0]=4 2718 B12R1.49 Nc1ccc(CC(=O)CBr)cc1 Amb25247650 [1,1,0,0,0,0|1,0,1]=4 2719 B12R1.49 Nc1ccc(CC(=O)NN)cc1 Amb23247868 [1,1,0,0,0,0|2,0,0]=4 2720 B12R1.49 Nc1ccc(CC(=O)NO)[n]c1 Amb25347985 [1,1,0,0,0,0|2,0,0]=4 2721 B12R1.49 Nc1ccc(CC(=O)NO)cc1 Amb25222304 [1,1,0,0,0,0|1,0,0]=3 2722 B12R1.49 Nc1ccc(CC(F)C=O)cc1 Amb25148624 [1,1,0,0,0,0|1,0,1]=4 2723 B12R1.49 Nc1ccc(CC(N)C=O)cc1 Amb24416655 [1,1,0,0,0,0|1,0,1]=4 2724 B12R1.49 Nc1ccc(cc1)OC(=O)CO Amb24730945 [1,1,0,0,0,0|1,0,1]=4 2725 B12R1.49 O=C(CF)Cc1ccc(Cl)cc1 Amb23454833 [1,1,0,0,0,0|1,0,1]=4 2726 B12R1.49 O=C(Cc1ccc(Br)cc1)CBr Amb25364120 [1,1,0,0,0,0|1,0,1]=4 2727 B12R1.49 O=C(Cc1ccc(F)cc1)CBr Amb25082934 [1,1,0,0,0,0|1,0,1]=4 2728 B12R1.49 O=CC(Cc1ccc(cc1)Br)Cl Amb17204706 [1,1,0,0,0,0|1,0,1]=4 2729 B12R1.49 O=CC(Cc1ccc(cc1)C)Cl Amb17204328 [1,1,0,0,0,0|1,0,1]=4 2730 B12R1.49 O=CC(Cc1ccc(cc1)Cl)Cl Amb17204403 [1,1,0,0,0,0|1,0,1]=4 2731 B12R1.49 O=CC(Cc1ccc(cc1)F)Cl Amb17204342 [1,1,0,0,0,0|1,0,1]=4 2732 B12R1.49 O=CC(F)Cc1ccc(Cl)cc1 Amb25369013 [1,1,0,0,0,0|1,0,1]=4 2733 B12R1.49 O=C\C(=C\c1ccc(cc1)Br)\C Amb17343202 [1,1,0,0,0,0|1,0,1]=4 2734 B12R1.49 O=C\C(=C\c1ccc(cc1)C)\C Amb17334499 [1,1,0,0,0,0|1,0,1]=4 2735 B12R1.49 O=C\C(=C\c1ccc(cc1)Cl)\C Amb17335458 [1,1,0,0,0,0|1,0,1]=4 2736 B12R1.49 O=C\C(=C\c1ccc(cc1)F)\C Amb17334600 [1,1,0,0,0,0|1,0,1]=4 2737 B12R1.49 O=C\C(=C\c1ccc(cc1)O)\C Amb17334556 [1,1,0,0,0,0|1,0,1]=4 2738 B12R1.49 O=C\C(\F)=C/c1ccc(Cl)cc1 Amb24697918 [1,1,0,0,0,0|1,0,1]=4 2739 B12R1.49 O=C\C(\F)=C/c1ccc(F)cc1 Amb25326695 [1,1,0,0,0,0|1,0,1]=4 2740 B12R1.49 O=C\C(\F)=C\c1ccc(F)cc1 Amb24736150 [1,1,0,0,0,0|1,0,1]=4 2741 B12R1.49 OC(Cc1ccc(Br)cc1)C=O Amb25856500 [1,1,0,0,0,0|0,0,2]=4 2742 B12R1.49 OC(Cc1ccc(Cl)cc1)C=O Amb25205198 [1,1,0,0,0,0|0,0,2]=4 2743 B12R1.49 OC(Cc1ccc(F)cc1)C=O Amb25731164 [1,1,0,0,0,0|0,0,2]=4 2744 B12R1.49 OCC(=O)Cc1ccc(Br)cc1 Amb18069830 [1,1,0,0,0,0|0,0,1]=3 2745 B12R1.49 OCC(=O)Cc1ccc(Cl)cc1 Amb18564300 [1,1,0,0,0,0|0,0,1]=3 2746 B12R1.49 OCC(=O)Cc1ccc(F)cc1 Amb18805789 [1,1,0,0,0,0|0,0,1]=3 2747 B12R1.49 OCC(=O)Nc1ccc(cc1)Br Amb1111396 [1,1,0,0,0,0|1,0,1]=4 2748 B12R1.49 OCC(=O)Nc1ccc(cc1)C Amb1109727 [1,1,0,0,0,0|1,0,1]=4 2749 B12R1.49 OCC(=O)Nc1ccc(cc1)Cl Amb1111272 [1,1,0,0,0,0|1,0,1]=4 2750 B12R1.49 OCC(=O)Nc1ccc(cc1)F Amb1110979 [1,1,0,0,0,0|1,0,1]=4 2751 B12R1.49 OCC(=O)Nc1ccc(cc1)I Amb1110138 [1,1,0,0,0,0|1,0,1]=4 2752 B12R1.49 ONC(=O)Cc1ccc(I)cc1 Amb25119664 [1,1,0,0,0,0|1,0,0]=3 2753 B12R1.49 ONC(=O)Nc1ccc(I)cc1 Amb22475257 [1,1,0,0,0,0|2,0,0]=4 2754 B12R1.49 O\C(\C=O)=C/c1ccc(Cl)cc1 Amb18648698 [1,1,0,0,0,0|0,0,2]=4 2755 B12R1.49 O\C(\C=O)=C\c1ccc(F)cc1 Amb25240049 [1,1,0,0,0,0|0,0,2]=4 2756 B12R1.49 O\N=C(/Cc1ccc(cc1)O)\N Amb2224478 [1,1,0,0,0,0|2,0,0]=4 2757 B12R1.49 O\N=C(\Cc1ccc(cc1)Cl)/N Amb1114808 [1,1,0,0,0,0|2,0,0]=4 2758 B12R1.49 O\N=C(\Cc1ccc(cc1)N)/N Amb1114107 [1,1,0,0,0,0|2,0,0]=4 2759 B12R1.49 O\N=C(\Cc1ccc(cc1)O)/N Amb1113789 [1,1,0,0,0,0|2,0,0]=4 2760 B12R1.49 Oc1ccc(CC(=O)C=O)cc1 Amb25359086 [1,1,0,0,0,0|0,0,0]=2 2761 B12R1.49 Oc1ccc(CC(=O)NO)cc1 Amb24686463 [1,1,0,0,0,0|1,0,0]=3 2762 B12R1.49 Oc1ccc(CC(F)C=O)cc1 Amb24341525 [1,1,0,0,0,0|1,0,1]=4 2763 B12R1.49 Oc1ccc(\C=C(/F)\C=O)cc1 Amb24497168 [1,1,0,0,0,0|1,0,1]=4 2764 B12R1.50 C#CC(=O)Cc1cccc(Br)c1 Amb25042972 [1,1,0,0,0,0|1,0,1]=4 2765 B12R1.50 C=CC(=O)Cc1c[n]cc(Br)c1 Amb25849642 [1,1,0,0,0,0|2,0,0]=4 2766 B12R1.50 C=CC(=O)Cc1cc[n]c(N)c1 Amb25840227 [1,1,0,0,0,0|2,0,0]=4 2767 B12R1.50 C=CC(=O)Cc1cccc(Br)c1 Amb24450582 [1,1,0,0,0,0|1,0,0]=3 2768 B12R1.50 C=CC(=O)Cc1cccc(N)c1 Amb25809299 [1,1,0,0,0,0|1,0,0]=3 2769 B12R1.50 C=CC(=O)Nc1cccc(N)c1 Amb24740871 [1,1,0,0,0,0|2,0,0]=4 2770 B12R1.50 C=CC(=O)Oc1cccc(F)c1 Amb25156555 [1,1,0,0,0,0|2,0,0]=4 2771 B12R1.50 CC(Cc1cccc(Cl)c1)C=O Amb25804355 [1,1,0,0,0,0|1,0,1]=4 2772 B12R1.50 CC(Cc1cccc(I)c1)C=O Amb25850018 [1,1,0,0,0,0|1,0,1]=4 2773 B12R1.50 CC(Cc1cccc(N)c1)C=O Amb25251154 [1,1,0,0,0,0|1,0,1]=4 2774 B12R1.50 CCC(=O)Cc1cccc(c1)Br Amb17477613 [1,1,0,0,0,0|1,0,1]=4 2775 B12R1.50 CCC(=O)Cc1cccc(c1)C Amb17138543 [1,1,0,0,0,0|1,0,1]=4 2776 B12R1.50 CCC(=O)Cc1cccc(c1)Cl Amb17139042 [1,1,0,0,0,0|1,0,1]=4 2777 B12R1.50 CCC(=O)Cc1cccc(c1)F Amb17138604 [1,1,0,0,0,0|1,0,1]=4 2778 B12R1.50 CNC(=O)Cc1cccc(Br)c1 Amb23111023 [1,1,0,0,0,0|2,0,0]=4 2779 B12R1.50 CNC(=O)Cc1cccc(Cl)c1 Amb22984156 [1,1,0,0,0,0|2,0,0]=4 2780 B12R1.50 CNC(=O)Cc1cccc(O)c1 Amb18788342 [1,1,0,0,0,0|2,0,0]=4 2781 B12R1.50 CNC(=O)Cc1cccc(c1)C Amb2106610 [1,1,0,0,0,0|2,0,0]=4 2782 B12R1.50 COC(=O)Cc1cccc(S)c1 Amb22490996 [1,1,0,0,0,0|2,0,0]=4 2783 B12R1.50 COC(=O)Cc1cccc(c1)N Amb10071208 [1,1,0,0,0,0|2,0,0]=4 2784 B12R1.50 C\C(=C/c1cccc(N)c1)\C=O Amb25264395 [1,1,0,0,0,0|1,0,1]=4 2785 B12R1.50 C\C(\C=O)=C\c1cccc(F)c1 Amb25857569 [1,1,0,0,0,0|1,0,1]=4 2786 B12R1.50 C\C(\C=O)=C\c1cccc(I)c1 Amb24493268 [1,1,0,0,0,0|1,0,1]=4 2787 B12R1.50 C\C(\Cc1cc(O)ccc1)=N/O Amb24487234 [1,1,0,0,0,0|2,0,0]=4 2788 B12R1.50 C\C(\Cc1cc(O)ccc1)=N\O Amb25227653 [1,1,0,0,0,0|2,0,0]=4 2789 B12R1.50 C\C(\Cc1cccc(Br)c1)=N\O Amb24634595 [1,1,0,0,0,0|2,0,0]=4 2790 B12R1.50 C\C(\Cc1cccc(F)c1)=N\O Amb25225688 [1,1,0,0,0,0|2,0,0]=4 2791 B12R1.50 Cc1cc(CC(=O)C=C)ccc1 Amb25278058 [1,1,0,0,0,0|1,0,0]=3 2792 B12R1.50 Cc1cc(CC(=O)CBr)ccc1 Amb25089939 [1,1,0,0,0,0|1,0,1]=4 2793 B12R1.50 Cc1cc(CC(=O)CN)ccc1 Amb18829247 [1,1,0,0,0,0|1,0,1]=4 2794 B12R1.50 Cc1cc(CC(=O)CO)ccc1 Amb18563612 [1,1,0,0,0,0|0,0,1]=3 2795 B12R1.50 Cc1cc(CC(=O)NO)ccc1 Amb18798398 [1,1,0,0,0,0|1,0,0]=3 2796 B12R1.50 Cc1cc(\C=C(/F)\C=O)ccc1 Amb24497238 [1,1,0,0,0,0|1,0,1]=4 2797 B12R1.50 Cc1cc(ccc1)NC(=O)C=O Amb24468252 [1,1,0,0,0,0|1,0,0]=3 2798 B12R1.50 Cc1cc(ccc1)OC(=O)C=C Amb25330984 [1,1,0,0,0,0|2,0,0]=4 2799 B12R1.50 Cc1cc(ccc1)OC(=O)CO Amb25160233 [1,1,0,0,0,0|1,0,1]=4 2800 B12R1.50 Cc1cccc(CC(C)C=O)c1 Amb25120274 [1,1,0,0,0,0|1,0,1]=4 2801 B12R1.50 Cc1cccc(C\C(\C)=N\O)c1 Amb24487383 [1,1,0,0,0,0|2,0,0]=4 2802 B12R1.50 NCC(=O)Cc1cc(Br)ccc1 Amb18160371 [1,1,0,0,0,0|1,0,1]=4 2803 B12R1.50 NCC(=O)Cc1cc(Cl)ccc1 Amb18823030 [1,1,0,0,0,0|1,0,1]=4 2804 B12R1.50 NCC(=O)Cc1cc(F)ccc1 Amb18199528 [1,1,0,0,0,0|1,0,1]=4 2805 B12R1.50 NCC(=O)Cc1cc(O)ccc1 Amb18251724 [1,1,0,0,0,0|1,0,1]=4 2806 B12R1.50 NNC(=O)Cc1cccc(I)c1 Amb25092748 [1,1,0,0,0,0|2,0,0]=4 2807 B12R1.50 NNC(=O)Cc1cccc(O)c1 Amb18788433 [1,1,0,0,0,0|2,0,0]=4 2808 B12R1.50 NNC(=O)Cc1cccc(c1)C Amb10075484 [1,1,0,0,0,0|2,0,0]=4 2809 B12R1.50 N\C(\Cc1cc(O)ccc1)=N\O Amb25103462 [1,1,0,0,0,0|2,0,0]=4 2810 B12R1.50 Nc1cccc(C\C(\N)=N/O)c1 Amb24711722 [1,1,0,0,0,0|2,0,0]=4 2811 B12R1.50 O=C(CF)Cc1cc(Cl)ccc1 Amb23454832 [1,1,0,0,0,0|1,0,1]=4 2812 B12R1.50 O=C(Cc1cc(Br)ccc1)CBr Amb22233785 [1,1,0,0,0,0|1,0,1]=4 2813 B12R1.50 O=C(Cc1cccc(Br)c1)C=O Amb24402453 [1,1,0,0,0,0|0,0,0]=2 2814 B12R1.50 O=C(Cc1cccc(Cl)c1)CBr Amb24627962 [1,1,0,0,0,0|1,0,1]=4 2815 B12R1.50 O=CC(Cc1cccc(c1)Br)Cl Amb17204708 [1,1,0,0,0,0|1,0,1]=4 2816 B12R1.50 O=CC(Cc1cccc(c1)C)Cl Amb17204327 [1,1,0,0,0,0|1,0,1]=4 2817 B12R1.50 O=CC(Cc1cccc(c1)Cl)Cl Amb17204402 [1,1,0,0,0,0|1,0,1]=4 2818 B12R1.50 O=CC(Cc1cccc(c1)F)Cl Amb17204343 [1,1,0,0,0,0|1,0,1]=4 2819 B12R1.50 O=CC(F)Cc1cccc(Cl)c1 Amb24341527 [1,1,0,0,0,0|1,0,1]=4 2820 B12R1.50 O=C\C(=C\c1cccc(c1)Br)\C Amb17343200 [1,1,0,0,0,0|1,0,1]=4 2821 B12R1.50 O=C\C(=C\c1cccc(c1)C)\C Amb17334497 [1,1,0,0,0,0|1,0,1]=4 2822 B12R1.50 O=C\C(=C\c1cccc(c1)Cl)\C Amb17335456 [1,1,0,0,0,0|1,0,1]=4 2823 B12R1.50 O=C\C(=C\c1cccc(c1)O)\C Amb17334558 [1,1,0,0,0,0|1,0,1]=4 2824 B12R1.50 OC(Cc1cccc(Br)c1)C=O Amb25802176 [1,1,0,0,0,0|0,0,2]=4 2825 B12R1.50 OC(Cc1cccc(Cl)c1)C=O Amb25107935 [1,1,0,0,0,0|0,0,2]=4 2826 B12R1.50 OC(Cc1cccc(F)c1)C=O Amb25047798 [1,1,0,0,0,0|0,0,2]=4 2827 B12R1.50 OCC(=O)Cc1cc(Br)ccc1 Amb18572003 [1,1,0,0,0,0|0,0,1]=3 2828 B12R1.50 OCC(=O)Cc1cc(Cl)ccc1 Amb18564304 [1,1,0,0,0,0|0,0,1]=3 2829 B12R1.50 OCC(=O)Cc1cc(F)ccc1 Amb25232023 [1,1,0,0,0,0|0,0,1]=3 2830 B12R1.50 OCC(=O)Nc1cccc(c1)Cl Amb1110353 [1,1,0,0,0,0|1,0,1]=4 2831 B12R1.50 OCC(=O)Nc1cccc(c1)F Amb1110282 [1,1,0,0,0,0|1,0,1]=4 2832 B12R1.50 OCC(=O)Oc1cccc(Cl)c1 Amb25043439 [1,1,0,0,0,0|1,0,1]=4 2833 B12R1.50 ONC(=O)Cc1cccc(Br)c1 Amb25751442 [1,1,0,0,0,0|1,0,0]=3 2834 B12R1.50 ONC(=O)Cc1cccc(Cl)c1 Amb19075673 [1,1,0,0,0,0|1,0,0]=3 2835 B12R1.50 O\C(\C=O)=C/c1cccc(F)c1 Amb25130617 [1,1,0,0,0,0|0,0,2]=4 2836 B12R1.50 O\N=C(\Cc1cccc(c1)Cl)/N Amb1117604 [1,1,0,0,0,0|2,0,0]=4 2837 B12R1.50 Oc1cc(CC(=O)NO)ccc1 Amb18788532 [1,1,0,0,0,0|1,0,0]=3 2838 B12R1.50 Oc1cc(CC(F)C=O)ccc1 Amb25836660 [1,1,0,0,0,0|1,0,1]=4 2839 B12R1.118 C=C=C(CO)Cc1ccccc1 Amb25777134 [1,1,0,0,0,0|1,0,1]=4 2840 B12R1.118 C=C=C(Cc1ccccc1)C=O Amb25123884 [1,1,0,0,0,0|1,0,0]=3 2841 B12R1.118 C=C\C(\C=O)=C\c1ccccc1 Amb24553053 [1,1,0,0,0,0|1,0,1]=4 2842 B12R1.118 CCN(Cc1ccccc1)C=O Amb25034769 [1,1,0,0,0,0|2,0,0]=4 2843 B12R1.118 CN\C(\Cc1ccccc1)=N\O Amb25376955 [1,1,0,0,0,0|2,0,0]=4 2844 B12R1.118 CO\C(=C\c1ccccc1)\C=O Amb17594035 [1,1,0,0,0,0|0,0,2]=4 2845 B12R1.118 C\C=C(/C=O)\Oc1ccccc1 Amb24697807 [1,1,0,0,0,0|2,0,0]=4 2846 B12R1.118 C\C=C(/Cc1ccccc1)\C=O Amb18645376 [1,1,0,0,0,0|1,0,0]=3 2847 B12R1.118 C\C=C(\C=O)/Sc1ccccc1 Amb18648151 [1,1,0,0,0,0|2,0,0]=4 2848 B12R1.118 C\C=C(\Cc1ccccc1)/C=O Amb25743406 [1,1,0,0,0,0|1,0,0]=3 2849 B12R1.118 N#CC(Cc1ccccc1)C=O Amb22371309 [1,1,0,0,0,0|1,0,1]=4 2850 B12R1.118 N#C\C(=C/O)\Sc1ccccc1 Amb25687961 [1,1,0,0,0,0|2,0,0]=4 2851 B12R1.118 N#C\C(\C=O)=C/c1ccccc1 Amb24566216 [1,1,0,0,0,0|1,0,1]=4 2852 B12R1.118 N#C\C(\C=O)=C\c1ccccc1 Amb18644900 [1,1,0,0,0,0|1,0,1]=4 2853 B12R1.118 N#C\C(\Cc1ccc[n]c1)=C/O Amb25357837 [1,1,0,0,0,0|2,0,0]=4 2854 B12R1.118 N\C=C(\Cc1ccccc1)/C#N Amb24743507 [1,1,0,0,0,0|2,0,0]=4 2855 B12R1.118 O=CC(=Cc1ccccc1)C=O Amb18645276 [1,1,0,0,0,0|0,0,1]=3 2856 B12R1.118 O=C\C(\CCl)=C\c1ccccc1 Amb25669592 [1,1,0,0,0,0|1,0,1]=4 2857 B12R1.118 O=C\C(\Cc1ccccc1)=C/Cl Amb25300287 [1,1,0,0,0,0|1,0,0]=3 2858 B12R1.118 OC\C(\Cc1ccccc1)=C\F Amb25037074 [1,1,0,0,0,0|1,0,1]=4 2859 B12R1.118 OC\C(\Cc1ccccc1)=N\O Amb25052256 [1,1,0,0,0,0|0,0,2]=4 2860 B12R1.118 O\C=C(/C=O)\Oc1ccccc1 Amb24625847 [1,1,0,0,0,0|1,0,0]=3 2861 B12R1.118 O\C=C(/Cc1cccnc1)\C#N Amb10605347 [1,1,0,0,0,0|2,0,0]=4 2862 B12R1.118 O\C=C(\Cc1ccncc1)/C#N Amb10605342 [1,1,0,0,0,0|2,0,0]=4 2863 B12R1.194 C=CS(=O)(=O)Cc1ccccc1 Amb2459233 [1,1,0,0,0,0|2,0,0]=4 2864 B12R1.194 C[C@@](O)(Cc1ccccc1)C=O Amb24539297 [1,1,0,0,0,0|0,0,2]=4 2865 B12R1.194 O=CC(F)(F)Cc1ccccc1 Amb24424443 [1,1,0,0,0,0|1,0,1]=4 2866 B12R1.371 C#CC(=O)Cc1ccccc1Br Amb24483898 [1,1,0,0,0,0|1,0,1]=4 2867 B12R1.371 C=C(Cc1ccccc1Cl)C=O Amb25373181 [1,1,0,0,0,0|1,0,0]=3 2868 B12R1.371 C=C(Cc1ccccc1F)C=O Amb25674264 [1,1,0,0,0,0|1,0,0]=3 2869 B12R1.371 C=CC(=O)Cc1cc[n]cc1Cl Amb25160000 [1,1,0,0,0,0|2,0,0]=4 2870 B12R1.371 C=CC(=O)Cc1ccccc1Cl Amb24350181 [1,1,0,0,0,0|1,0,0]=3 2871 B12R1.371 C=CC(=O)Nc1ccccc1O Amb18645794 [1,1,0,0,0,0|2,0,0]=4 2872 B12R1.371 C=CC(=O)Oc1ccccc1Br Amb25156556 [1,1,0,0,0,0|2,0,0]=4 2873 B12R1.371 CC(Cc1ccccc1Br)C=O Amb25324057 [1,1,0,0,0,0|1,0,1]=4 2874 B12R1.371 CC(Cc1ccccc1F)C=O Amb24429443 [1,1,0,0,0,0|1,0,1]=4 2875 B12R1.371 CC(Cc1ccccc1I)C=O Amb24437612 [1,1,0,0,0,0|1,0,1]=4 2876 B12R1.371 CC(Cc1ccccc1O)C=O Amb25313067 [1,1,0,0,0,0|1,0,1]=4 2877 B12R1.371 CCC(=O)Cc1ccccc1Br Amb19148340 [1,1,0,0,0,0|1,0,1]=4 2878 B12R1.371 CCC(=O)Cc1ccccc1C Amb17138542 [1,1,0,0,0,0|1,0,1]=4 2879 B12R1.371 CCC(=O)Cc1ccccc1Cl Amb17139041 [1,1,0,0,0,0|1,0,1]=4 2880 B12R1.371 CCC(=O)Cc1ccccc1F Amb17138603 [1,1,0,0,0,0|1,0,1]=4 2881 B12R1.371 CCC(=O)Cc1ccccc1O Amb18646038 [1,1,0,0,0,0|1,0,1]=4 2882 B12R1.371 CN(Cc1ccccc1F)C=O Amb25211597 [1,1,0,0,0,0|2,0,0]=4 2883 B12R1.371 CN(Cc1ccccc1O)C=O Amb25349061 [1,1,0,0,0,0|2,0,0]=4 2884 B12R1.371 CNC(=O)Cc1ccccc1Br Amb22001453 [1,1,0,0,0,0|2,0,0]=4 2885 B12R1.371 CNC(=O)Cc1ccccc1C Amb2106609 [1,1,0,0,0,0|2,0,0]=4 2886 B12R1.371 CNC(=O)Cc1ccccc1Cl Amb23014080 [1,1,0,0,0,0|2,0,0]=4 2887 B12R1.371 CNC(=O)Cc1ccccc1F Amb23014294 [1,1,0,0,0,0|2,0,0]=4 2888 B12R1.371 CNC(=O)Cc1ccccc1N Amb1114729 [1,1,0,0,0,0|2,0,0]=4 2889 B12R1.371 COC(=O)Cc1ccccc1I Amb22749395 [1,1,0,0,0,0|2,0,0]=4 2890 B12R1.371 COC(=O)Cc1ccccc1N Amb20623565 [1,1,0,0,0,0|2,0,0]=4 2891 B12R1.371 C\C(\C=O)=C\c1ccccc1Br Amb24639745 [1,1,0,0,0,0|1,0,1]=4 2892 B12R1.371 C\C(\C=O)=C\c1ccccc1Cl Amb25827711 [1,1,0,0,0,0|1,0,1]=4 2893 B12R1.371 C\C(\C=O)=C\c1ccccc1F Amb25793939 [1,1,0,0,0,0|1,0,1]=4 2894 B12R1.371 C\C(\Cc1ccccc1Cl)=N\O Amb25290972 [1,1,0,0,0,0|2,0,0]=4 2895 B12R1.371 C\C(\Cc1ccccc1F)=N\O Amb25252610 [1,1,0,0,0,0|2,0,0]=4 2896 B12R1.371 C\C(\Cc1ccccc1O)=C/C Amb25130619 [1,1,0,0,0,0|2,0,0]=4 2897 B12R1.371 C\C(\Cc1ccccc1O)=C\C Amb24380771 [1,1,0,0,0,0|2,0,0]=4 2898 B12R1.371 C\C(\Cc1ccccc1O)=N\O Amb25211004 [1,1,0,0,0,0|2,0,0]=4 2899 B12R1.371 Cc1[n]cccc1CC(=O)NO Amb24448842 [1,1,0,0,0,0|2,0,0]=4 2900 B12R1.371 Cc1ccccc1CC(=O)C#C Amb25209391 [1,1,0,0,0,0|1,0,1]=4 2901 B12R1.371 Cc1ccccc1CC(=O)C=C Amb25678802 [1,1,0,0,0,0|1,0,0]=3 2902 B12R1.371 Cc1ccccc1CC(=O)CN Amb18829246 [1,1,0,0,0,0|1,0,1]=4 2903 B12R1.371 Cc1ccccc1CC(=O)CO Amb18563611 [1,1,0,0,0,0|0,0,1]=3 2904 B12R1.371 Cc1ccccc1CC(C)C=O Amb18645713 [1,1,0,0,0,0|1,0,1]=4 2905 B12R1.371 Cc1ccccc1CC(O)C=O Amb25789140 [1,1,0,0,0,0|0,0,2]=4 2906 B12R1.371 Cc1ccccc1CN(C)C=O Amb25088109 [1,1,0,0,0,0|2,0,0]=4 2907 B12R1.371 Cc1ccccc1\C=C(\C)/C=O Amb25230198 [1,1,0,0,0,0|1,0,1]=4 2908 B12R1.371 Cc1ccccc1\C=C(\F)/C=O Amb24612450 [1,1,0,0,0,0|1,0,1]=4 2909 B12R1.371 NCC(=O)Cc1ccccc1Br Amb25667280 [1,1,0,0,0,0|1,0,1]=4 2910 B12R1.371 NCC(=O)Cc1ccccc1Cl Amb18909368 [1,1,0,0,0,0|1,0,1]=4 2911 B12R1.371 NCC(=O)Cc1ccccc1F Amb18827239 [1,1,0,0,0,0|1,0,1]=4 2912 B12R1.371 NNC(=O)Cc1ccccc1Br Amb22484618 [1,1,0,0,0,0|2,0,0]=4 2913 B12R1.371 NNC(=O)Cc1ccccc1F Amb1126168 [1,1,0,0,0,0|2,0,0]=4 2914 B12R1.371 NNC(=O)Cc1ccccc1I Amb25334643 [1,1,0,0,0,0|2,0,0]=4 2915 B12R1.371 Nc1ccccc1CC(=O)NN Amb25072774 [1,1,0,0,0,0|2,0,0]=4 2916 B12R1.371 O=C(CBr)Cc1ccccc1I Amb25352153 [1,1,0,0,0,0|1,0,1]=4 2917 B12R1.371 O=C(CCl)Cc1ccccc1I Amb25253621 [1,1,0,0,0,0|1,0,1]=4 2918 B12R1.371 O=C(CF)Cc1ccccc1Cl Amb23454831 [1,1,0,0,0,0|1,0,1]=4 2919 B12R1.371 O=C(Cc1ccccc1Cl)CBr Amb25312032 [1,1,0,0,0,0|1,0,1]=4 2920 B12R1.371 O=CC(Cc1ccccc1Br)Cl Amb17204707 [1,1,0,0,0,0|1,0,1]=4 2921 B12R1.371 O=CC(Cc1ccccc1C)Cl Amb17204326 [1,1,0,0,0,0|1,0,1]=4 2922 B12R1.371 O=CC(Cc1ccccc1Cl)Cl Amb17204401 [1,1,0,0,0,0|1,0,1]=4 2923 B12R1.371 O=CC(Cc1ccccc1F)Cl Amb17204341 [1,1,0,0,0,0|1,0,1]=4 2924 B12R1.371 O=CC(Cl)Cc1ccccc1I Amb25827697 [1,1,0,0,0,0|1,0,1]=4 2925 B12R1.371 O=CC(F)Cc1ccccc1Cl Amb25148636 [1,1,0,0,0,0|1,0,1]=4 2926 B12R1.371 O=CC(F)Cc1ccccc1F Amb24341410 [1,1,0,0,0,0|1,0,1]=4 2927 B12R1.371 O=C\C(=C\c1ccccc1C)\C Amb17334495 [1,1,0,0,0,0|1,0,1]=4 2928 B12R1.371 O=C\C(=C\c1ccccc1Cl)\C Amb17335454 [1,1,0,0,0,0|1,0,1]=4 2929 B12R1.371 O=C\C(=C\c1ccccc1F)\C Amb17334598 [1,1,0,0,0,0|1,0,1]=4 2930 B12R1.371 OC(Cc1ccccc1F)C=O Amb24554950 [1,1,0,0,0,0|0,0,2]=4 2931 B12R1.371 OCC(=O)Cc1ccccc1Cl Amb18564303 [1,1,0,0,0,0|0,0,1]=3 2932 B12R1.371 OCC(=O)Cc1ccccc1F Amb18805788 [1,1,0,0,0,0|0,0,1]=3 2933 B12R1.371 OCC(=O)Nc1ccccc1Br Amb1109988 [1,1,0,0,0,0|1,0,1]=4 2934 B12R1.371 OCC(=O)Nc1ccccc1C Amb1110662 [1,1,0,0,0,0|1,0,1]=4 2935 B12R1.371 OCC(=O)Nc1ccccc1Cl Amb1111147 [1,1,0,0,0,0|1,0,1]=4 2936 B12R1.371 OCC(=O)Nc1ccccc1F Amb1109775 [1,1,0,0,0,0|1,0,1]=4 2937 B12R1.371 OCC(=O)Oc1ccccc1Cl Amb25072212 [1,1,0,0,0,0|1,0,1]=4 2938 B12R1.371 OCC(=O)Oc1ccccc1F Amb25122488 [1,1,0,0,0,0|1,0,1]=4 2939 B12R1.371 OCC(=O)Oc1ccccc1I Amb25056604 [1,1,0,0,0,0|1,0,1]=4 2940 B12R1.371 ON(Cc1ccccc1Cl)C=O Amb22469654 [1,1,0,0,0,0|1,0,1]=4 2941 B12R1.371 O\C(\C=O)=C/c1ccccc1F Amb24532563 [1,1,0,0,0,0|0,0,2]=4 2942 B12R1.371 O\C(\C=O)=C\c1ccccc1F Amb24621919 [1,1,0,0,0,0|0,0,2]=4 2943 B12R1.371 O\N=C(\Cc1ccccc1C)/N Amb1118586 [1,1,0,0,0,0|2,0,0]=4 2944 B12R1.371 O\N=C(\Cc1ccccc1Cl)/N Amb10205341 [1,1,0,0,0,0|2,0,0]=4 2945 B12R1.371 Oc1ccccc1CC(=O)CCl Amb25376294 [1,1,0,0,0,0|1,0,1]=4 2946 B12R1.371 Oc1ccccc1CC(F)C=O Amb25148635 [1,1,0,0,0,0|1,0,1]=4 2947 B12R1.371 Oc1ccccc1OC(=O)NO Amb24631630 [1,1,0,0,0,0|2,0,0]=4 2948 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [1,1,0,0,0,0|2,0,0]=4 2949 B12R1.21 CC(=O)NCc1ccc(cc1)O Amb10549495 [1,1,0,0,0,0|2,0,0]=4 2950 B12R1.21 CC(=O)OCc1ccc(I)cc1 Amb25687671 [1,1,0,0,0,0|2,0,0]=4 2951 B12R1.21 CC(=O)OCc1ccc(O)cc1 Amb18646455 [1,1,0,0,0,0|2,0,0]=4 2952 B12R1.21 CC(=O)OCc1ccc(cc1)Cl Amb2421366 [1,1,0,0,0,0|2,0,0]=4 2953 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [1,1,0,0,0,0|2,0,0]=4 2954 B12R1.21 CC(=O)\C=C\c1ccc(I)cc1 Amb25736694 [1,1,0,0,0,0|1,0,1]=4 2955 B12R1.21 CC(=O)\C=C\c1ccc(N)cc1 Amb23247750 [1,1,0,0,0,0|1,0,1]=4 2956 B12R1.21 Cc1ccc(CCC(O)=O)[n]c1 Amb22886574 [1,1,0,0,0,0|1,0,1]=4 2957 B12R1.21 Cc1ccc(CCC(O)=O)c[n]1 Amb18828437 [1,1,0,0,0,0|1,0,1]=4 2958 B12R1.21 Cc1ccc(\C=C/C(C)=O)cc1 Amb24422503 [1,1,0,0,0,0|1,0,1]=4 2959 B12R1.21 Cc1ccc(\C=C\C(O)=O)[n]c1 Amb24711355 [1,1,0,0,0,0|1,0,1]=4 2960 B12R1.21 Cc1ccc(\C=C\C(O)=O)c[n]1 Amb18645813 [1,1,0,0,0,0|1,0,1]=4 2961 B12R1.21 Cc1ccc(cc1)\N=C\C(C)=O Amb25334923 [1,1,0,0,0,0|2,0,0]=4 2962 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [1,1,0,0,0,0|1,0,1]=4 2963 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [1,1,0,0,0,0|1,0,1]=4 2964 B12R1.21 ClC(=O)\C=C\c1ccc(cc1)Br Amb16230246 [1,1,0,0,0,0|1,0,1]=4 2965 B12R1.21 ClC(=O)\C=C\c1ccc(cc1)C Amb16230247 [1,1,0,0,0,0|1,0,1]=4 2966 B12R1.21 ClC(=O)\C=C\c1ccc(cc1)Cl Amb16186540 [1,1,0,0,0,0|1,0,1]=4 2967 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [1,1,0,0,0,0|1,0,1]=4 2968 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [1,1,0,0,0,0|1,0,1]=4 2969 B12R1.21 NC(=O)NCc1ccc(cc1)Br Amb1139295 [1,1,0,0,0,0|2,0,0]=4 2970 B12R1.21 NC(=O)NCc1ccc(cc1)C Amb1134976 [1,1,0,0,0,0|2,0,0]=4 2971 B12R1.21 NC(=O)NCc1ccc(cc1)Cl Amb2435054 [1,1,0,0,0,0|2,0,0]=4 2972 B12R1.21 NC(=O)NCc1ccc(cc1)F Amb1128118 [1,1,0,0,0,0|2,0,0]=4 2973 B12R1.21 NC(=O)OCc1ccc(Cl)cc1 Amb25737813 [1,1,0,0,0,0|2,0,0]=4 2974 B12R1.21 NC(=O)\C=C/c1ccc(cc1)Cl Amb17142990 [1,1,0,0,0,0|1,0,1]=4 2975 B12R1.21 NC(=O)\C=C\c1ccc(I)cc1 Amb24758181 [1,1,0,0,0,0|1,0,1]=4 2976 B12R1.21 NC(=O)\C=C\c1ccc(cc1)C Amb1662617 [1,1,0,0,0,0|1,0,1]=4 2977 B12R1.21 Nc1ccc(CCC(O)=O)[n]c1 Amb24663664 [1,1,0,0,0,0|1,0,1]=4 2978 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb19958679 [1,1,0,0,0,0|1,0,1]=4 2979 B12R1.21 Nc1ccc(CCC(O)=O)c[n]1 Amb22546430 [1,1,0,0,0,0|1,0,1]=4 2980 B12R1.21 Nc1ccc(\C=C\C(N)=O)cc1 Amb25365075 [1,1,0,0,0,0|1,0,1]=4 2981 B12R1.21 Nc1ccc(\C=C\C(O)=O)c[n]1 Amb19958812 [1,1,0,0,0,0|1,0,1]=4 2982 B12R1.21 Nc1ccc(cc1)C#CC(O)=O Amb25111179 [1,1,0,0,0,0|0,0,2]=4 2983 B12R1.21 Nc1ccc(cc1)NCC(O)=O Amb18296058 [1,1,0,0,0,0|1,0,1]=4 2984 B12R1.21 Nc1ccc(cc1)OCC(O)=O Amb22751390 [1,1,0,0,0,0|1,0,1]=4 2985 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [1,1,0,0,0,0|1,0,1]=4 2986 B12R1.21 O=C(Cl)OCc1ccc(Br)cc1 Amb22059767 [1,1,0,0,0,0|2,0,0]=4 2987 B12R1.21 O=C(Cl)OCc1ccc(F)cc1 Amb24471576 [1,1,0,0,0,0|2,0,0]=4 2988 B12R1.21 OC(=O)C#Cc1ccc(cc1)C Amb17138496 [1,1,0,0,0,0|0,0,2]=4 2989 B12R1.21 OC(=O)C#Cc1ccc(cc1)Cl Amb10575987 [1,1,0,0,0,0|0,0,2]=4 2990 B12R1.21 OC(=O)C#Cc1ccc(cc1)F Amb17138570 [1,1,0,0,0,0|0,0,2]=4 2991 B12R1.21 OC(=O)C=Cc1ccc(I)cc1 Amb24079623 [1,1,0,0,0,0|0,0,1]=3 2992 B12R1.21 OC(=O)CCN1C=CC(=O)C=C1 Amb18534262 [1,1,0,0,0,0|1,0,1]=4 2993 B12R1.21 OC(=O)CCN1C=CC(=S)C=C1 Amb25751169 [1,1,0,0,0,0|1,0,1]=4 2994 B12R1.21 OC(=O)CC[n+]1ccc(cc1)C Amb17098177 [1,1,0,0,0,0|1,0,1]=4 2995 B12R1.21 OC(=O)CCc1ccc(Br)[n]c1 Amb22292277 [1,1,0,0,0,0|1,0,1]=4 2996 B12R1.21 OC(=O)CCc1ccc(Cl)[n]c1 Amb18649204 [1,1,0,0,0,0|1,0,1]=4 2997 B12R1.21 OC(=O)CCc1ccc(F)[n]c1 Amb22886575 [1,1,0,0,0,0|1,0,1]=4 2998 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [1,1,0,0,0,0|0,0,1]=3 2999 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [1,1,0,0,0,0|0,0,1]=3 3000 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [1,1,0,0,0,0|0,0,1]=3 3001 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [1,1,0,0,0,0|0,0,1]=3 3002 B12R1.21 OC(=O)CNc1ccc(cc1)Br Amb1981434 [1,1,0,0,0,0|1,0,1]=4 3003 B12R1.21 OC(=O)CNc1ccc(cc1)C Amb1106469 [1,1,0,0,0,0|1,0,1]=4 3004 B12R1.21 OC(=O)CNc1ccc(cc1)Cl Amb1486152 [1,1,0,0,0,0|1,0,1]=4 3005 B12R1.21 OC(=O)CNc1ccc(cc1)O Amb1950558 [1,1,0,0,0,0|1,0,1]=4 3006 B12R1.21 OC(=O)COc1ccc(cc1)Cl Amb1830178 [1,1,0,0,0,0|1,0,1]=4 3007 B12R1.21 OC(=O)COc1ccc(cc1)F Amb1210357 [1,1,0,0,0,0|1,0,1]=4 3008 B12R1.21 OC(=O)COc1ccc(cc1)I Amb1152251 [1,1,0,0,0,0|1,0,1]=4 3009 B12R1.21 OC(=O)COc1ccc(cc1)N Amb1034889 [1,1,0,0,0,0|1,0,1]=4 3010 B12R1.21 OC(=O)CSc1ccc(S)cc1 Amb24341890 [1,1,0,0,0,0|1,0,1]=4 3011 B12R1.21 OC(=O)CSc1ccc(cc1)Br Amb1208368 [1,1,0,0,0,0|1,0,1]=4 3012 B12R1.21 OC(=O)CSc1ccc(cc1)C Amb1197696 [1,1,0,0,0,0|1,0,1]=4 3013 B12R1.21 OC(=O)CSc1ccc(cc1)F Amb1209262 [1,1,0,0,0,0|1,0,1]=4 3014 B12R1.21 OC(=O)NCc1ccc(Cl)[n]c1 Amb24068954 [1,1,0,0,0,0|2,0,0]=4 3015 B12R1.21 OC(=O)\C=C/c1ccc(F)cc1 Amb24712642 [1,1,0,0,0,0|0,0,1]=3 3016 B12R1.21 OC(=O)\C=C/c1ccc(cc1)Cl Amb2553273 [1,1,0,0,0,0|0,0,1]=3 3017 B12R1.21 OC(=O)\C=C\c1ccc(Br)[n]c1 Amb21864750 [1,1,0,0,0,0|1,0,1]=4 3018 B12R1.21 OC(=O)\C=C\c1ccc(Br)c[n]1 Amb24593980 [1,1,0,0,0,0|1,0,1]=4 3019 B12R1.21 OC(=O)\C=C\c1ccc(Cl)[n]c1 Amb22002669 [1,1,0,0,0,0|1,0,1]=4 3020 B12R1.21 OC(=O)\C=C\c1ccc(F)c[n]1 Amb21962831 [1,1,0,0,0,0|1,0,1]=4 3021 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Br Amb1209603 [1,1,0,0,0,0|0,0,1]=3 3022 B12R1.21 OC(=O)\C=C\c1ccc(cc1)Cl Amb1210744 [1,1,0,0,0,0|0,0,1]=3 3023 B12R1.21 OC(=O)\C=C\c1ccc(cc1)I Amb2227429 [1,1,0,0,0,0|0,0,1]=3 3024 B12R1.21 OC(=O)\C=C\c1ccc(cc1)N Amb1196689 [1,1,0,0,0,0|0,0,1]=3 3025 B12R1.21 OC(=O)\C=C\c1ccc(cc1)O Amb1207922 [1,1,0,0,0,0|0,0,1]=3 3026 B12R1.21 OC(=O)\C=C\c1ccc(cc1)S Amb17616840 [1,1,0,0,0,0|0,0,1]=3 3027 B12R1.21 Oc1ccc(CC=C(Cl)Cl)cc1 Amb25054845 [1,1,0,0,0,0|2,0,0]=4 3028 B12R1.21 Oc1ccc(\C=C\C(O)=O)[n]c1 Amb25794684 [1,1,0,0,0,0|1,0,1]=4 3029 B12R1.21 Oc1ccc(c[n]1)\C=C\C(O)=O Amb25111280 [1,1,0,0,0,0|1,0,1]=4 3030 B12R1.21 Oc1ccc(cc1)C#CC(O)=O Amb23569631 [1,1,0,0,0,0|0,0,2]=4 3031 B12R1.21 Oc1ccc(cc1)SCC(O)=O Amb18291566 [1,1,0,0,0,0|1,0,1]=4 3032 B12R1.21 [O-]C(=O)\C=C\c1ccc(cc1)C Amb10553862 [1,1,0,0,0,0|0,0,2]=4 3033 B12R1.21 [O-][n+]1ccc(\C=C\C(O)=O)cc1 Amb25076703 [1,1,0,0,0,0|1,0,1]=4 3034 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [1,1,0,0,0,0|2,0,0]=4 3035 B12R1.27 BrCC(=O)\C=C\c1ccccc1 Amb17596167 [1,1,0,0,0,0|1,0,1]=4 3036 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [1,1,0,0,0,0|1,0,1]=4 3037 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [1,1,0,0,0,0|2,0,0]=4 3038 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [1,1,0,0,0,0|2,0,0]=4 3039 B12R1.27 C#CC(=O)\C=C\c1ccccc1 Amb25706970 [1,1,0,0,0,0|1,0,1]=4 3040 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [1,1,0,0,0,0|1,0,1]=4 3041 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [1,1,0,0,0,0|2,0,0]=4 3042 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [1,1,0,0,0,0|2,0,0]=4 3043 B12R1.27 CC(C=Cc1ccccc1)=NO Amb24101081 [1,1,0,0,0,0|1,0,1]=4 3044 B12R1.27 CCC(=O)\C=C/c1ccccc1 Amb25271028 [1,1,0,0,0,0|1,0,1]=4 3045 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [1,1,0,0,0,0|1,0,1]=4 3046 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [1,1,0,0,0,0|2,0,0]=4 3047 B12R1.27 COC(=O)/C=C/c1cccnc1 Amb17844385 [1,1,0,0,0,0|1,0,1]=4 3048 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb20668041 [1,1,0,0,0,0|1,0,1]=4 3049 B12R1.27 COC(=O)C=Cc1cc[n]cc1 Amb24074160 [1,1,0,0,0,0|1,0,1]=4 3050 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [1,1,0,0,0,0|1,0,1]=4 3051 B12R1.27 COC(=O)NCc1ccccn1 Amb17736865 [1,1,0,0,0,0|2,0,0]=4 3052 B12R1.27 COC(=O)NCc1cccnc1 Amb17790231 [1,1,0,0,0,0|2,0,0]=4 3053 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [1,1,0,0,0,0|1,0,0]=3 3054 B12R1.27 COC(=O)\C=C\c1cccc[n]1 Amb25036096 [1,1,0,0,0,0|1,0,1]=4 3055 B12R1.27 COC(=O)\C=C\c1ccncc1 Amb10604946 [1,1,0,0,0,0|1,0,1]=4 3056 B12R1.27 COC(=O)\N=N\c1ccccc1 Amb25836861 [1,1,0,0,0,0|2,0,0]=4 3057 B12R1.27 CSC(=O)NCc1ccccc1 Amb24495681 [1,1,0,0,0,0|1,1,0]=4 3058 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [1,1,0,0,0,0|1,0,0]=3 3059 B12R1.27 C\C(\C=O)=C/Nc1ccccc1 Amb18645511 [1,1,0,0,0,0|2,0,0]=4 3060 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [1,1,0,0,0,0|1,0,0]=3 3061 B12R1.27 C\C(\C=O)=C\Sc1ccccc1 Amb25277189 [1,1,0,0,0,0|2,0,0]=4 3062 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [1,1,0,0,0,0|1,0,1]=4 3063 B12R1.27 C\C(\CCl)=C\Cc1ccccc1 Amb25279568 [1,1,0,0,0,0|2,0,0]=4 3064 B12R1.27 C\C(\CN)=C\Cc1ccccc1 Amb24438874 [1,1,0,0,0,0|2,0,0]=4 3065 B12R1.27 C\C(\NCc1ccccc1)=N\O Amb25083251 [1,1,0,0,0,0|2,0,0]=4 3066 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [1,1,0,0,0,0|1,0,1]=4 3067 B12R1.27 ClCC(=O)\C=C\c1ccccc1 Amb17594640 [1,1,0,0,0,0|1,0,1]=4 3068 B12R1.27 Cl\C(\CCl)=C/Cc1ccccc1 Amb25803609 [1,1,0,0,0,0|2,0,0]=4 3069 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [1,1,0,0,0,0|1,0,1]=4 3070 B12R1.27 N#CC(=O)\C=C\c1ccccc1 Amb10069227 [1,1,0,0,0,0|1,0,1]=4 3071 B12R1.27 NC(NCc1ccccc1)=NO Amb18800915 [1,1,0,0,0,0|2,0,0]=4 3072 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [1,1,0,0,0,0|1,0,1]=4 3073 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [1,1,0,0,0,0|2,0,0]=4 3074 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [1,1,0,0,0,0|2,0,0]=4 3075 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [1,1,0,0,0,0|2,0,0]=4 3076 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb18908593 [1,1,0,0,0,0|1,0,1]=4 3077 B12R1.27 NC\C(\F)=C\Cc1ccccc1 Amb24743578 [1,1,0,0,0,0|2,0,0]=4 3078 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [1,1,0,0,0,0|1,0,1]=4 3079 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [1,1,0,0,0,0|2,0,0]=4 3080 B12R1.27 NNC(=O)\C=C\c1ccccc1 Amb25838381 [1,1,0,0,0,0|1,0,1]=4 3081 B12R1.27 N\C(\C=Cc1ccccc1)=N\O Amb25065269 [1,1,0,0,0,0|1,0,1]=4 3082 B12R1.27 N\C(\CCc1ccccc1)=N\O Amb22053006 [1,1,0,0,0,0|1,0,1]=4 3083 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [1,1,0,0,0,0|1,0,1]=4 3084 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [1,1,0,0,0,0|1,0,1]=4 3085 B12R1.27 O=C(CF)\C=C\c1ccccc1 Amb24572849 [1,1,0,0,0,0|1,0,1]=4 3086 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [1,1,0,0,0,0|2,0,0]=4 3087 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [1,1,0,0,0,0|2,0,0]=4 3088 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [1,1,0,0,0,0|2,0,0]=4 3089 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [1,1,0,0,0,0|2,0,0]=4 3090 B12R1.27 O=C(\C=C\c1ccccc1)C=O Amb18126247 [1,1,0,0,0,0|0,0,2]=4 3091 B12R1.27 O=C\C(\Cl)=C/Nc1ccccc1 Amb24603974 [1,1,0,0,0,0|2,0,0]=4 3092 B12R1.27 O=C\C(\Cl)=C\Nc1ccccc1 Amb25797781 [1,1,0,0,0,0|2,0,0]=4 3093 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [1,1,0,0,0,0|1,0,0]=3 3094 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [1,1,0,0,0,0|0,0,2]=4 3095 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [1,1,0,0,0,0|1,0,1]=4 3096 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [1,1,0,0,0,0|1,0,1]=4 3097 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [1,1,0,0,0,0|1,0,1]=4 3098 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [1,1,0,0,0,0|0,0,1]=3 3099 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [1,1,0,0,0,0|1,0,1]=4 3100 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [1,1,0,0,0,0|1,0,0]=3 3101 B12R1.27 OCC(=O)NCc1ccccn1 Amb17334667 [1,1,0,0,0,0|2,0,0]=4 3102 B12R1.27 OCC(=O)NCc1cccnc1 Amb17334668 [1,1,0,0,0,0|2,0,0]=4 3103 B12R1.27 OCC(=O)NCc1ccncc1 Amb17334669 [1,1,0,0,0,0|2,0,0]=4 3104 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [1,1,0,0,0,0|0,0,1]=3 3105 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [1,1,0,0,0,0|1,0,0]=3 3106 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [1,1,0,0,0,0|1,0,0]=3 3107 B12R1.27 ONC(=O)CCc1cc[n]cc1 Amb24577197 [1,1,0,0,0,0|1,0,1]=4 3108 B12R1.27 ONC(=O)CCc1ccc[n]c1 Amb24413046 [1,1,0,0,0,0|1,0,1]=4 3109 B12R1.27 ONC(=O)CCc1cccc[n]1 Amb24703542 [1,1,0,0,0,0|1,0,1]=4 3110 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [1,1,0,0,0,0|1,0,0]=3 3111 B12R1.27 ONC(=O)\C=C\c1cc[n]cc1 Amb22346729 [1,1,0,0,0,0|1,0,1]=4 3112 B12R1.27 ONC(=O)\C=C\c1cc[n]cc1 Amb24565929 [1,1,0,0,0,0|1,0,1]=4 3113 B12R1.27 ONC(=S)NCc1ccccc1 Amb25823184 [1,1,0,0,0,0|1,1,0]=4 3114 B12R1.27 O\C(\C=O)=C/Nc1ccccc1 Amb25187506 [1,1,0,0,0,0|1,0,0]=3 3115 B12R1.27 O\N=C(\CCc1ccccc1)/N Amb1115853 [1,1,0,0,0,0|1,0,1]=4 3116 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [1,1,0,0,0,0|2,0,0]=4 3117 B12R1.107 Br\C(=C/C(=O)O)\c1ccccc1 Amb10069265 [1,1,0,0,0,0|0,0,1]=3 3118 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [1,1,0,0,0,0|0,0,2]=4 3119 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [1,1,0,0,0,0|2,0,0]=4 3120 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [1,1,0,0,0,0|2,0,0]=4 3121 B12R1.107 CC(=O)\C=C(/S)\c1ccccc1 Amb25730212 [1,1,0,0,0,0|1,0,1]=4 3122 B12R1.107 CC(=O)\C=C(\N)/c1ccccc1 Amb25309296 [1,1,0,0,0,0|1,0,1]=4 3123 B12R1.107 CC(C)=CC(N)c1ccccc1 Amb24355884 [1,1,0,0,0,0|2,0,0]=4 3124 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [1,1,0,0,0,0|1,0,1]=4 3125 B12R1.107 CC(NC(=O)Cl)c1ccccc1 Amb25780625 [1,1,0,0,0,0|2,0,0]=4 3126 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [1,1,0,0,0,0|0,0,1]=3 3127 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [1,1,0,0,0,0|2,0,0]=4 3128 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [1,1,0,0,0,0|1,0,1]=4 3129 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [1,1,0,0,0,0|1,0,1]=4 3130 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [1,1,0,0,0,0|2,0,0]=4 3131 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [1,1,0,0,0,0|0,0,1]=3 3132 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [1,1,0,0,0,0|2,0,0]=4 3133 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [1,1,0,0,0,0|0,0,1]=3 3134 B12R1.107 C\C(=C/C(=O)Cl)\c1ccccc1 Amb25195673 [1,1,0,0,0,0|1,0,1]=4 3135 B12R1.107 C\C(=C/C(N)=O)\c1ccccc1 Amb24648875 [1,1,0,0,0,0|1,0,1]=4 3136 B12R1.107 C\C(=C\C(=O)Cl)\c1ccccc1 Amb25220154 [1,1,0,0,0,0|1,0,1]=4 3137 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [1,1,0,0,0,0|1,0,1]=4 3138 B12R1.107 C\C(=C\C(O)=O)\c1cc[n]cc1 Amb20626499 [1,1,0,0,0,0|1,0,1]=4 3139 B12R1.107 C\C(=C\C(O)=O)\c1ccc[n]c1 Amb20626498 [1,1,0,0,0,0|1,0,1]=4 3140 B12R1.107 C\C(=C\C(O)=O)\c1cccc[n]1 Amb24393080 [1,1,0,0,0,0|1,0,1]=4 3141 B12R1.107 C\C(=C\C(O)=O)\c1ccccc1 Amb24271190 [1,1,0,0,0,0|0,0,1]=3 3142 B12R1.107 C\C(\Cl)=C\C(Cl)c1ccccc1 Amb25277290 [1,1,0,0,0,0|2,0,0]=4 3143 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [1,1,0,0,0,0|2,0,0]=4 3144 B12R1.107 Cl\C(=C/C(=O)O)\c1ccccc1 Amb17594707 [1,1,0,0,0,0|0,0,1]=3 3145 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [1,1,0,0,0,0|1,0,1]=4 3146 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [1,1,0,0,0,0|1,0,1]=4 3147 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [1,1,0,0,0,0|1,0,1]=4 3148 B12R1.107 NC(=O)\C=C(\O)/c1ccccc1 Amb24580412 [1,1,0,0,0,0|1,0,1]=4 3149 B12R1.107 NC(CC(O)=O)c1cccc[n]1 Amb22898991 [1,1,0,0,0,0|1,0,1]=4 3150 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [1,1,0,0,0,0|1,0,1]=4 3151 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [1,1,0,0,0,0|1,0,1]=4 3152 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [1,1,0,0,0,0|0,0,1]=3 3153 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [1,1,0,0,0,0|1,0,1]=4 3154 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb19929593 [1,1,0,0,0,0|1,0,1]=4 3155 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb20240885 [1,1,0,0,0,0|1,0,1]=4 3156 B12R1.107 N[C@@H](CC(O)=O)c1ccc[n]c1 Amb19929600 [1,1,0,0,0,0|1,0,1]=4 3157 B12R1.107 N[C@@H](CC(O)=O)c1cccc[n]1 Amb20241102 [1,1,0,0,0,0|1,0,1]=4 3158 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb19929602 [1,1,0,0,0,0|1,0,1]=4 3159 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb20241136 [1,1,0,0,0,0|1,0,1]=4 3160 B12R1.107 N[C@H](CC(O)=O)c1ccc[n]c1 Amb19929601 [1,1,0,0,0,0|1,0,1]=4 3161 B12R1.107 N[C@H](CC(O)=O)c1cccc[n]1 Amb20241101 [1,1,0,0,0,0|1,0,1]=4 3162 B12R1.107 N\C(=C/C(O)=O)\c1ccccc1 Amb22054873 [1,1,0,0,0,0|0,0,1]=3 3163 B12R1.107 N\C(=C\C(O)=O)\c1cccc[n]1 Amb24426187 [1,1,0,0,0,0|1,0,1]=4 3164 B12R1.107 N\C(=C\C(O)=O)\c1ccccc1 Amb25274098 [1,1,0,0,0,0|0,0,1]=3 3165 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [1,1,0,0,0,0|0,0,2]=4 3166 B12R1.107 OC(=O)CC(Cl)c1cc[n]cc1 Amb18119876 [1,1,0,0,0,0|1,0,1]=4 3167 B12R1.107 OC(=O)CC(Cl)c1ccc[n]c1 Amb18119752 [1,1,0,0,0,0|1,0,1]=4 3168 B12R1.107 OC(=O)CC(Cl)c1cccc[n]1 Amb18120042 [1,1,0,0,0,0|1,0,1]=4 3169 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [1,1,0,0,0,0|0,0,1]=3 3170 B12R1.107 OC(=O)CC(F)c1ccc[n]c1 Amb25823686 [1,1,0,0,0,0|1,0,1]=4 3171 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [1,1,0,0,0,0|0,0,1]=3 3172 B12R1.107 OC(=O)CC(O)c1cc[n]cc1 Amb18563783 [1,1,0,0,0,0|1,0,1]=4 3173 B12R1.107 OC(=O)CC(O)c1cccc[n]1 Amb18563782 [1,1,0,0,0,0|1,0,1]=4 3174 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [1,1,0,0,0,0|0,0,1]=3 3175 B12R1.107 OC(=O)CC(c1ccccn1)Br Amb17596297 [1,1,0,0,0,0|1,0,1]=4 3176 B12R1.107 OC(=O)CC(c1cccnc1)N Amb1993735 [1,1,0,0,0,0|1,0,1]=4 3177 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [1,1,0,0,0,0|1,0,1]=4 3178 B12R1.107 OC(=O)\C=C(\F)/c1ccccc1 Amb24426178 [1,1,0,0,0,0|0,0,1]=3 3179 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb1395651 [1,1,0,0,0,0|1,0,1]=4 3180 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb2563772 [1,1,0,0,0,0|1,0,1]=4 3181 B12R1.125 CC(=O)C=Cc1ccccc1O Amb24065680 [1,1,0,0,0,0|1,0,1]=4 3182 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [1,1,0,0,0,0|1,0,1]=4 3183 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [1,1,0,0,0,0|2,0,0]=4 3184 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [1,1,0,0,0,0|2,0,0]=4 3185 B12R1.125 CC(=O)NCc1ccccc1N Amb18284299 [1,1,0,0,0,0|2,0,0]=4 3186 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [1,1,0,0,0,0|2,0,0]=4 3187 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [1,1,0,0,0,0|2,0,0]=4 3188 B12R1.125 CC(=O)OCc1ccccc1F Amb25788639 [1,1,0,0,0,0|2,0,0]=4 3189 B12R1.125 CC(=O)OCc1ccccc1O Amb18646465 [1,1,0,0,0,0|2,0,0]=4 3190 B12R1.125 CC(=O)SCc1ccccc1F Amb22231630 [1,1,0,0,0,0|2,0,0]=4 3191 B12R1.125 CC(=O)\C=C\c1ccccc1Br Amb18068027 [1,1,0,0,0,0|1,0,1]=4 3192 B12R1.125 CC(=O)\C=C\c1ccccc1C Amb17477498 [1,1,0,0,0,0|1,0,1]=4 3193 B12R1.125 CC(=O)\C=C\c1ccccc1F Amb18563599 [1,1,0,0,0,0|1,0,1]=4 3194 B12R1.125 CC(=O)\C=C\c1ccccc1O Amb1266216 [1,1,0,0,0,0|1,0,1]=4 3195 B12R1.125 CC(C)=CCc1ccccc1N Amb18645540 [1,1,0,0,0,0|2,0,0]=4 3196 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [1,1,0,0,0,0|2,0,0]=4 3197 B12R1.125 C\C(\Cl)=C\Cc1ccccc1O Amb24614705 [1,1,0,0,0,0|2,0,0]=4 3198 B12R1.125 Cc1[n]cccc1CCC(O)=O Amb18853387 [1,1,0,0,0,0|1,0,1]=4 3199 B12R1.125 Cc1[n]cccc1\C=C\C(O)=O Amb18522806 [1,1,0,0,0,0|1,0,1]=4 3200 B12R1.125 Cc1c[n]ccc1\C=C\C(O)=O Amb25148916 [1,1,0,0,0,0|1,0,1]=4 3201 B12R1.125 Cc1cc[n]cc1CCC(O)=O Amb18828438 [1,1,0,0,0,0|1,0,1]=4 3202 B12R1.125 Cc1cc[n]cc1\C=C\C(O)=O Amb25210821 [1,1,0,0,0,0|1,0,1]=4 3203 B12R1.125 Cc1cccc[n+]1CCC(O)=O Amb24410939 [1,1,0,0,0,0|1,0,1]=4 3204 B12R1.125 Cc1ccccc1C#CC(O)=O Amb20673097 [1,1,0,0,0,0|0,0,2]=4 3205 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [1,1,0,0,0,0|1,0,1]=4 3206 B12R1.125 Cc1ccccc1CNC(C)=O Amb24721874 [1,1,0,0,0,0|2,0,0]=4 3207 B12R1.125 Cc1ccccc1CNC(N)=O Amb18800799 [1,1,0,0,0,0|2,0,0]=4 3208 B12R1.125 Cc1ccccc1COC(N)=O Amb25152446 [1,1,0,0,0,0|2,0,0]=4 3209 B12R1.125 Cc1ccccc1CSC(C)=O Amb22231631 [1,1,0,0,0,0|2,0,0]=4 3210 B12R1.125 Cc1ccncc1C=CC(O)=O Amb17844101 [1,1,0,0,0,0|1,0,1]=4 3211 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [1,1,0,0,0,0|1,0,1]=4 3212 B12R1.125 ClC(=O)\C=C/c1ccccc1Cl Amb10070071 [1,1,0,0,0,0|1,0,1]=4 3213 B12R1.125 ClC(=O)\C=C\c1ccccc1Br Amb16230254 [1,1,0,0,0,0|1,0,1]=4 3214 B12R1.125 N=C1C=CC=CN1\C=C\C(O)=O Amb25310995 [1,1,0,0,0,0|1,0,1]=4 3215 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [1,1,0,0,0,0|1,0,1]=4 3216 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [1,1,0,0,0,0|1,0,1]=4 3217 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [1,1,0,0,0,0|1,0,1]=4 3218 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [1,1,0,0,0,0|2,0,0]=4 3219 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [1,1,0,0,0,0|2,0,0]=4 3220 B12R1.125 NC(=O)\C=C\c1ccccc1O Amb18645808 [1,1,0,0,0,0|1,0,1]=4 3221 B12R1.125 Nc1[n]cccc1CCC(O)=O Amb25124989 [1,1,0,0,0,0|1,0,1]=4 3222 B12R1.125 Nc1cc[n]cc1CCC(O)=O Amb24375593 [1,1,0,0,0,0|1,0,1]=4 3223 B12R1.125 Nc1cc[n]cc1\C=C\C(O)=O Amb22044028 [1,1,0,0,0,0|1,0,1]=4 3224 B12R1.125 Nc1ccc[n]c1\C=C\C(O)=O Amb25725011 [1,1,0,0,0,0|1,0,1]=4 3225 B12R1.125 Nc1ccccc1/C=C/C(O)=O Amb17777291 [1,1,0,0,0,0|0,0,1]=3 3226 B12R1.125 Nc1ccccc1C#CC(O)=O Amb24355867 [1,1,0,0,0,0|0,0,2]=4 3227 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [1,1,0,0,0,0|0,0,1]=3 3228 B12R1.125 Nc1ccccc1CNC(N)=O Amb18957838 [1,1,0,0,0,0|2,0,0]=4 3229 B12R1.125 Nc1ccccc1NCC(O)=O Amb18296519 [1,1,0,0,0,0|1,0,1]=4 3230 B12R1.125 Nc1ccccc1\C=C/C(N)=O Amb25149881 [1,1,0,0,0,0|1,0,1]=4 3231 B12R1.125 O=C(Cl)C=Cc1ccccc1F Amb24090144 [1,1,0,0,0,0|1,0,1]=4 3232 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [1,1,0,0,0,0|1,0,1]=4 3233 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [1,1,0,0,0,0|1,0,1]=4 3234 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [1,1,0,0,0,0|2,0,0]=4 3235 B12R1.125 O=C(Cl)OCc1ccccc1Cl Amb21618686 [1,1,0,0,0,0|2,0,0]=4 3236 B12R1.125 O=C(Cl)OCc1ccccc1F Amb25039104 [1,1,0,0,0,0|2,0,0]=4 3237 B12R1.125 OC(=O)C#Cc1ccccc1Br Amb25266206 [1,1,0,0,0,0|0,0,2]=4 3238 B12R1.125 OC(=O)CCC1=CC=CNC1=O Amb18262602 [1,1,0,0,0,0|1,0,1]=4 3239 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb18534261 [1,1,0,0,0,0|1,0,1]=4 3240 B12R1.125 OC(=O)CCN1C=CC=CC1=O Amb21955606 [1,1,0,0,0,0|1,0,1]=4 3241 B12R1.125 OC(=O)CCc1[n]cccc1F Amb25311377 [1,1,0,0,0,0|1,0,1]=4 3242 B12R1.125 OC(=O)CCc1c[n]ccc1Br Amb25253329 [1,1,0,0,0,0|1,0,1]=4 3243 B12R1.125 OC(=O)CCc1c[n]ccc1Cl Amb25270751 [1,1,0,0,0,0|1,0,1]=4 3244 B12R1.125 OC(=O)CCc1cc[n]cc1Cl Amb23596515 [1,1,0,0,0,0|1,0,1]=4 3245 B12R1.125 OC(=O)CCc1ccc[n]c1Br Amb24525068 [1,1,0,0,0,0|1,0,1]=4 3246 B12R1.125 OC(=O)CCc1ccc[n]c1Cl Amb24484270 [1,1,0,0,0,0|1,0,1]=4 3247 B12R1.125 OC(=O)CCc1ccc[n]c1F Amb25295347 [1,1,0,0,0,0|1,0,1]=4 3248 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [1,1,0,0,0,0|0,0,1]=3 3249 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [1,1,0,0,0,0|0,0,1]=3 3250 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [1,1,0,0,0,0|0,0,1]=3 3251 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [1,1,0,0,0,0|0,0,1]=3 3252 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [1,1,0,0,0,0|0,0,1]=3 3253 B12R1.125 OC(=O)CCn1ccccc1=O Amb1124605 [1,1,0,0,0,0|1,0,1]=4 3254 B12R1.125 OC(=O)CNc1ccccc1C Amb1258286 [1,1,0,0,0,0|1,0,1]=4 3255 B12R1.125 OC(=O)CNc1ccccc1S Amb25124141 [1,1,0,0,0,0|1,0,1]=4 3256 B12R1.125 OC(=O)COc1ccccc1C Amb1215022 [1,1,0,0,0,0|1,0,1]=4 3257 B12R1.125 OC(=O)COc1ccccc1O Amb1030005 [1,1,0,0,0,0|1,0,1]=4 3258 B12R1.125 OC(=O)CSc1ccccc1Br Amb1113386 [1,1,0,0,0,0|1,0,1]=4 3259 B12R1.125 OC(=O)CSc1ccccc1C Amb1205492 [1,1,0,0,0,0|1,0,1]=4 3260 B12R1.125 OC(=O)CSc1ccccc1Cl Amb1105912 [1,1,0,0,0,0|1,0,1]=4 3261 B12R1.125 OC(=O)CSc1ccccc1F Amb1105913 [1,1,0,0,0,0|1,0,1]=4 3262 B12R1.125 OC(=O)\C=C/c1ccccc1Cl Amb10070070 [1,1,0,0,0,0|0,0,1]=3 3263 B12R1.125 OC(=O)\C=C\C1=CC=CNC1=O Amb18263181 [1,1,0,0,0,0|1,0,1]=4 3264 B12R1.125 OC(=O)\C=C\c1cc[n]cc1Br Amb18659757 [1,1,0,0,0,0|1,0,1]=4 3265 B12R1.125 OC(=O)\C=C\c1cc[n]cc1Cl Amb23590832 [1,1,0,0,0,0|1,0,1]=4 3266 B12R1.125 OC(=O)\C=C\c1cccc[n+]1[O-] Amb10552947 [1,1,0,0,0,0|1,0,1]=4 3267 B12R1.125 OC(=O)\C=C\c1ccccc1I Amb22584152 [1,1,0,0,0,0|0,0,1]=3 3268 B12R1.125 OC(=O)\C=C\c1ccccc1O Amb1935207 [1,1,0,0,0,0|0,0,1]=3 3269 B12R1.125 OC(=O)\C=C\c1ccccc1S Amb18128711 [1,1,0,0,0,0|0,0,1]=3 3270 B12R1.125 Oc1cc[n]cc1\C=C\C(O)=O Amb18646198 [1,1,0,0,0,0|1,0,1]=4 3271 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [1,1,0,0,0,0|1,0,1]=4 3272 B12R1.125 Oc1ccccc1SCC(O)=O Amb18294823 [1,1,0,0,0,0|1,0,1]=4 3273 B12R1.226 CC(=O)C=Cc1cccc(O)c1 Amb24094413 [1,1,0,0,0,0|1,0,1]=4 3274 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl Amb10808067 [1,1,0,0,0,0|1,0,1]=4 3275 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [1,1,0,0,0,0|1,0,1]=4 3276 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [1,1,0,0,0,0|2,0,0]=4 3277 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [1,1,0,0,0,0|2,0,0]=4 3278 B12R1.226 CC(=O)NCc1cccc(O)c1 Amb18792630 [1,1,0,0,0,0|2,0,0]=4 3279 B12R1.226 CC(=O)NCc1cccc(c1)Br Amb2085743 [1,1,0,0,0,0|2,0,0]=4 3280 B12R1.226 CC(=O)NCc1cccc(c1)Cl Amb2023612 [1,1,0,0,0,0|2,0,0]=4 3281 B12R1.226 CC(=O)OCc1cccc(Br)c1 Amb25099120 [1,1,0,0,0,0|2,0,0]=4 3282 B12R1.226 CC(=O)OCc1cccc(Cl)c1 Amb25306228 [1,1,0,0,0,0|2,0,0]=4 3283 B12R1.226 CC(=O)OCc1cccc(F)c1 Amb25145061 [1,1,0,0,0,0|2,0,0]=4 3284 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [1,1,0,0,0,0|2,0,0]=4 3285 B12R1.226 CC(=O)OCc1cccc(c1)C Amb10601899 [1,1,0,0,0,0|2,0,0]=4 3286 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [1,1,0,0,0,0|2,0,0]=4 3287 B12R1.226 CC(=O)SCc1cccc(F)c1 Amb22231633 [1,1,0,0,0,0|2,0,0]=4 3288 B12R1.226 CC(=O)\C=C\c1cccc(F)c1 Amb18563600 [1,1,0,0,0,0|1,0,1]=4 3289 B12R1.226 CC(=O)\C=C\c1cccc(N)c1 Amb23247751 [1,1,0,0,0,0|1,0,1]=4 3290 B12R1.226 CC(=O)\C=C\c1cccc(c1)Br Amb10601440 [1,1,0,0,0,0|1,0,1]=4 3291 B12R1.226 CC(=O)\C=C\c1cccc(c1)C Amb17477497 [1,1,0,0,0,0|1,0,1]=4 3292 B12R1.226 CC(=O)\C=C\c1cccc(c1)O Amb17615740 [1,1,0,0,0,0|1,0,1]=4 3293 B12R1.226 CC(C)=CCc1cccc(O)c1 Amb24341888 [1,1,0,0,0,0|2,0,0]=4 3294 B12R1.226 Cc1cc(C=CC(O)=O)c[n]c1 Amb20668532 [1,1,0,0,0,0|1,0,1]=4 3295 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [1,1,0,0,0,0|1,0,1]=4 3296 B12R1.226 Cc1cc(CCC(O)=O)[n]cc1 Amb18828439 [1,1,0,0,0,0|1,0,1]=4 3297 B12R1.226 Cc1cc(CCC(O)=O)c[n]c1 Amb22886573 [1,1,0,0,0,0|1,0,1]=4 3298 B12R1.226 Cc1cc(CCC(O)=O)cc[n]1 Amb22886572 [1,1,0,0,0,0|1,0,1]=4 3299 B12R1.226 Cc1cc(CNC(N)=O)ccc1 Amb18798292 [1,1,0,0,0,0|2,0,0]=4 3300 B12R1.226 Cc1cc(\C=C\C(O)=O)[n]cc1 Amb23592143 [1,1,0,0,0,0|1,0,1]=4 3301 B12R1.226 Cc1cc(\C=C\C(O)=O)c[n]c1 Amb22059615 [1,1,0,0,0,0|1,0,1]=4 3302 B12R1.226 Cc1cc(\C=C\C(O)=O)cc[n]1 Amb23535924 [1,1,0,0,0,0|1,0,1]=4 3303 B12R1.226 Cc1cc(ccc1)C#CC(O)=O Amb20673071 [1,1,0,0,0,0|0,0,2]=4 3304 B12R1.226 Cc1cccc(n1)\C=C\C(=O)O Amb10669513 [1,1,0,0,0,0|1,0,1]=4 3305 B12R1.226 ClC(=O)\C=C\c1cccc(c1)Br Amb17145216 [1,1,0,0,0,0|1,0,1]=4 3306 B12R1.226 ClC(=O)\C=C\c1cccc(c1)Cl Amb16230245 [1,1,0,0,0,0|1,0,1]=4 3307 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [1,1,0,0,0,0|1,0,1]=4 3308 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [1,1,0,0,0,0|1,0,1]=4 3309 B12R1.226 NC(=O)NCc1cccc(O)c1 Amb18792735 [1,1,0,0,0,0|2,0,0]=4 3310 B12R1.226 NC(=O)NCc1cccc(c1)Cl Amb2440664 [1,1,0,0,0,0|2,0,0]=4 3311 B12R1.226 NC(=O)\C=C/c1cccc(Cl)c1 Amb24484173 [1,1,0,0,0,0|1,0,1]=4 3312 B12R1.226 NC(=O)\C=C/c1cccc(O)c1 Amb24744387 [1,1,0,0,0,0|1,0,1]=4 3313 B12R1.226 NC(=O)\C=C\c1cccc(I)c1 Amb25338405 [1,1,0,0,0,0|1,0,1]=4 3314 B12R1.226 Nc1cc(CCC(O)=O)c[n]c1 Amb25760281 [1,1,0,0,0,0|1,0,1]=4 3315 B12R1.226 Nc1cc(CCC(O)=O)cc[n]1 Amb24105413 [1,1,0,0,0,0|1,0,1]=4 3316 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [1,1,0,0,0,0|0,0,2]=4 3317 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [1,1,0,0,0,0|0,0,2]=4 3318 B12R1.226 Nc1cc(\C=C\C(O)=O)cc[n]1 Amb25201755 [1,1,0,0,0,0|1,0,1]=4 3319 B12R1.226 Nc1cc(ccc1)C#CC(O)=O Amb24650985 [1,1,0,0,0,0|0,0,2]=4 3320 B12R1.226 Nc1cc(ccc1)NCC(O)=O Amb18987711 [1,1,0,0,0,0|1,0,1]=4 3321 B12R1.226 Nc1cc(ccc1)SCC(O)=O Amb25700944 [1,1,0,0,0,0|1,0,1]=4 3322 B12R1.226 Nc1cccc(CNC(N)=O)c1 Amb18962222 [1,1,0,0,0,0|2,0,0]=4 3323 B12R1.226 Nc1cccc(\C=C\C(O)=O)[n]1 Amb24558794 [1,1,0,0,0,0|1,0,1]=4 3324 B12R1.226 Nc1cccc(c1)\C=C\C(N)=O Amb24626095 [1,1,0,0,0,0|1,0,1]=4 3325 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [1,1,0,0,0,0|1,0,1]=4 3326 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [1,1,0,0,0,0|1,0,1]=4 3327 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [1,1,0,0,0,0|1,0,1]=4 3328 B12R1.226 O=C(Cl)OCc1cccc(Br)c1 Amb24649567 [1,1,0,0,0,0|2,0,0]=4 3329 B12R1.226 OC(=O)C#Cc1cc(Br)ccc1 Amb23504362 [1,1,0,0,0,0|0,0,2]=4 3330 B12R1.226 OC(=O)C#Cc1cc(Cl)ccc1 Amb20673086 [1,1,0,0,0,0|0,0,2]=4 3331 B12R1.226 OC(=O)C#Cc1cc(F)ccc1 Amb20673102 [1,1,0,0,0,0|0,0,2]=4 3332 B12R1.226 OC(=O)C=Cc1cc[n]c(Cl)c1 Amb20668239 [1,1,0,0,0,0|1,0,1]=4 3333 B12R1.226 OC(=O)CCC1=CC(=O)C=CN1 Amb25230528 [1,1,0,0,0,0|1,0,1]=4 3334 B12R1.226 OC(=O)CCc1c[n]cc(Cl)c1 Amb25689846 [1,1,0,0,0,0|1,0,1]=4 3335 B12R1.226 OC(=O)CCc1c[n]cc(F)c1 Amb23450303 [1,1,0,0,0,0|1,0,1]=4 3336 B12R1.226 OC(=O)CCc1cc(F)cc[n]1 Amb22886576 [1,1,0,0,0,0|1,0,1]=4 3337 B12R1.226 OC(=O)CCc1cc[n]c(Br)c1 Amb24418909 [1,1,0,0,0,0|1,0,1]=4 3338 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [1,1,0,0,0,0|0,0,1]=3 3339 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [1,1,0,0,0,0|0,0,1]=3 3340 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [1,1,0,0,0,0|0,0,1]=3 3341 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [1,1,0,0,0,0|0,0,1]=3 3342 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [1,1,0,0,0,0|0,0,1]=3 3343 B12R1.226 OC(=O)CNc1cccc(F)c1 Amb19341704 [1,1,0,0,0,0|1,0,1]=4 3344 B12R1.226 OC(=O)CNc1cccc(c1)Cl Amb10609174 [1,1,0,0,0,0|1,0,1]=4 3345 B12R1.226 OC(=O)COc1cccc(c1)Cl Amb1211231 [1,1,0,0,0,0|1,0,1]=4 3346 B12R1.226 OC(=O)COc1cccc(c1)F Amb1102803 [1,1,0,0,0,0|1,0,1]=4 3347 B12R1.226 OC(=O)CSc1cccc(F)c1 Amb19887452 [1,1,0,0,0,0|1,0,1]=4 3348 B12R1.226 OC(=O)CSc1cccc(c1)Br Amb2372547 [1,1,0,0,0,0|1,0,1]=4 3349 B12R1.226 OC(=O)\C=C/c1cccc(c1)F Amb16185904 [1,1,0,0,0,0|0,0,1]=3 3350 B12R1.226 OC(=O)\C=C\C1=CC=CC(=O)N1 Amb25705720 [1,1,0,0,0,0|1,0,1]=4 3351 B12R1.226 OC(=O)\C=C\C1=CC=CC(=O)O1 Amb24425498 [1,1,0,0,0,0|1,0,1]=4 3352 B12R1.226 OC(=O)\C=C\[n+]1cccc(c1)C Amb1030018 [1,1,0,0,0,0|1,0,1]=4 3353 B12R1.226 OC(=O)\C=C\c1c[n]cc(Br)c1 Amb22491337 [1,1,0,0,0,0|1,0,1]=4 3354 B12R1.226 OC(=O)\C=C\c1c[n]cc(F)c1 Amb18283058 [1,1,0,0,0,0|1,0,1]=4 3355 B12R1.226 OC(=O)\C=C\c1cc[n]c(Br)c1 Amb19929893 [1,1,0,0,0,0|1,0,1]=4 3356 B12R1.226 OC(=O)\C=C\c1ccc[n+](c1)[O-] Amb10552948 [1,1,0,0,0,0|1,0,1]=4 3357 B12R1.226 OC(=O)\C=C\c1cccc(Br)[n]1 Amb25674136 [1,1,0,0,0,0|1,0,1]=4 3358 B12R1.226 OC(=O)\C=C\c1cccc(Cl)[n]1 Amb25060200 [1,1,0,0,0,0|1,0,1]=4 3359 B12R1.226 OC(=O)\C=C\c1cccc(F)[n]1 Amb24702245 [1,1,0,0,0,0|1,0,1]=4 3360 B12R1.226 OC(=O)\C=C\c1cccc(c1)Br Amb1207365 [1,1,0,0,0,0|0,0,1]=3 3361 B12R1.226 OC(=O)\C=C\c1cccc(c1)C Amb1212079 [1,1,0,0,0,0|0,0,1]=3 3362 B12R1.226 OC(=O)\C=C\c1cccc(c1)Cl Amb1209598 [1,1,0,0,0,0|0,0,1]=3 3363 B12R1.226 OC(=O)\C=C\c1cccc(c1)F Amb1210956 [1,1,0,0,0,0|0,0,1]=3 3364 B12R1.226 OC(=O)\C=C\c1cccc(c1)I Amb2236388 [1,1,0,0,0,0|0,0,1]=3 3365 B12R1.226 OC(=O)\C=C\c1cccc(c1)N Amb1197625 [1,1,0,0,0,0|0,0,1]=3 3366 B12R1.226 OC(=O)\C=C\c1cccc(c1)O Amb1137756 [1,1,0,0,0,0|0,0,1]=3 3367 B12R1.226 Oc1c[n]cc(CCC(O)=O)c1 Amb24435210 [1,1,0,0,0,0|1,0,1]=4 3368 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [1,1,0,0,0,0|1,0,1]=4 3369 B12R1.226 Oc1cc(cc[n]1)\C=C\C(O)=O Amb24682988 [1,1,0,0,0,0|1,0,1]=4 3370 B12R1.226 Oc1cccc(c1)C#CC(O)=O Amb23569602 [1,1,0,0,0,0|0,0,2]=4 3371 B12R1.226 Oc1cccc(c1)\C=C/C(O)=O Amb24584528 [1,1,0,0,0,0|0,0,1]=3 3372 B12R1.891 OP(=O)(\C=C\c1ccccc1)O Amb1041442 [1,1,0,0,0,0|1,0,1]=4 3373 B12R1.891 OS(=O)(=O)/C=C/c1ccccc1 Amb17672591 [1,1,0,0,0,0|1,0,1]=4 3374 B12R1.891 OS(=O)(=O)CCc1ccccc1 Amb19866568 [1,1,0,0,0,0|1,0,1]=4 3375 B12R1.891 OS(=O)(=O)NCc1ccccc1 Amb22551828 [1,1,0,0,0,0|2,0,0]=4 3376 B12R1.891 OS(=O)(=O)\C=C\c1ccccc1 Amb22364622 [1,1,0,0,0,0|1,0,1]=4 3377 B12R1.891 OS(=O)(=O)\C=C\c1ccccc1 Amb22364623 [1,1,0,0,0,0|1,0,1]=4 3378 B12R1.104 C[n]1c[n]c(CC(=O)C(O)=O)c1 Amb25345972 [0,1,0,0,1,0|2,0,0]=4 3379 B12R1.104 Cc1[n]cc(CC(=O)C(O)=O)[s]1 Amb25714990 [0,1,0,0,1,0|2,0,0]=4 3380 B12R1.104 Cc1c[s]c(CC(=O)C(O)=O)[n]1 Amb25047692 [0,1,0,0,1,0|2,0,0]=4 3381 B12R1.104 Cc1ccc(NC(=O)C(O)=O)[s]1 Amb24068951 [0,1,0,0,1,0|2,0,0]=4 3382 B12R1.104 Cc1ccc(o1)CC(=O)C(=O)O Amb1134823 [0,1,0,0,1,0|1,0,0]=3 3383 B12R1.104 OC(=O)C(=O)Cc1ccc(o1)Br Amb1131460 [0,1,0,0,1,0|1,0,0]=3 3384 B12R1.104 OC(=O)C(=O)Cc1coc(Br)c1 Amb24599217 [0,1,0,0,1,0|1,0,0]=3 3385 B12R1.108 COC(=O)C(=O)Cc1ccco1 Amb17138626 [0,1,0,0,1,0|1,0,0]=3 3386 B12R1.120 C=C(C(N)c1ccco1)C(O)=O Amb25250707 [0,1,0,0,1,0|2,0,0]=4 3387 B12R1.120 C=C([C@@H](N)c1ccco1)C(O)=O Amb25240035 [0,1,0,0,1,0|2,0,0]=4 3388 B12R1.145 Cc1c[s]cc1NC(=O)C(O)=O Amb25706762 [0,1,0,0,1,0|2,0,0]=4 3389 B12R1.145 Cc1ccoc1CC(=O)C(O)=O Amb25854016 [0,1,0,0,1,0|1,0,0]=3 3390 B12R1.145 OC(=O)C(=O)Cc1[s]ccc1Br Amb25110409 [0,1,0,0,1,0|1,0,0]=3 3391 B12R1.145 OC(=O)C(=O)Cc1[s]ccc1Cl Amb24626447 [0,1,0,0,1,0|1,0,0]=3 3392 B12R1.145 OC(=O)C(=O)Cc1c[s]cc1Br Amb25346678 [0,1,0,0,1,0|1,0,0]=3 3393 B12R1.145 OC(=O)C(=O)Cc1cc[s]c1Br Amb24597314 [0,1,0,0,1,0|1,0,0]=3 3394 B12R1.145 OC(=O)C(=O)Cc1cc[s]c1Cl Amb25774607 [0,1,0,0,1,0|1,0,0]=3 3395 B12R1.145 OC(=O)C(=O)Cc1occc1Br Amb25854549 [0,1,0,0,1,0|1,0,0]=3 3396 B12R1.145 OC(=O)C(=O)Cc1sccc1C Amb1132072 [0,1,0,0,1,0|1,0,0]=3 3397 B12R1.298 OC(=O)\C(\Cc1ccc[s]1)=N/O Amb24635623 [0,1,0,0,1,0|1,0,1]=4 3398 B12R1.298 OC(=O)\C(\Cc1ccc[s]1)=N\O Amb22465750 [0,1,0,0,1,0|1,0,1]=4 3399 B12R1.298 OC(=O)\C(\Cc1ccoc1)=N/O Amb24701588 [0,1,0,0,1,0|1,0,1]=4 3400 B12R1.20 C=C(Br)C(=O)c1ccc(F)cc1 Amb24483806 [0,1,0,0,1,0|2,0,0]=4 3401 B12R1.20 C=C(C(N)=O)c1ccc(Cl)cc1 Amb25829588 [0,1,0,0,1,0|2,0,0]=4 3402 B12R1.20 C=C(C(O)=O)c1ccc(N)[n]c1 Amb24415416 [0,1,0,0,1,0|2,0,0]=4 3403 B12R1.20 C=C(c1ccc(cc1)Br)C(=O)O Amb17322199 [0,1,0,0,1,0|1,0,0]=3 3404 B12R1.20 C=C(c1ccc(cc1)C)C(=O)O Amb17322163 [0,1,0,0,1,0|1,0,0]=3 3405 B12R1.20 C=C(c1ccc(cc1)Cl)C(=O)O Amb17322176 [0,1,0,0,1,0|1,0,0]=3 3406 B12R1.20 C=C(c1ccc(cc1)F)C(=O)O Amb17322166 [0,1,0,0,1,0|1,0,0]=3 3407 B12R1.20 CC(=C)C(=O)c1ccc(Br)cc1 Amb18068029 [0,1,0,0,1,0|2,0,0]=4 3408 B12R1.20 CC(=C)C(=O)c1ccc(Cl)cc1 Amb18065628 [0,1,0,0,1,0|2,0,0]=4 3409 B12R1.20 CC(=C)C(=O)c1ccc(F)cc1 Amb18563601 [0,1,0,0,1,0|2,0,0]=4 3410 B12R1.20 CC(=C)C(=O)c1ccc(N)cc1 Amb24699959 [0,1,0,0,1,0|2,0,0]=4 3411 B12R1.20 CC(=C)C(=O)c1ccc(O)cc1 Amb18645631 [0,1,0,0,1,0|2,0,0]=4 3412 B12R1.20 CC(=O)C(=O)c1ccc(F)c[n]1 Amb25844327 [0,1,0,0,1,0|2,0,0]=4 3413 B12R1.20 CC(C(O)=O)c1ccc(C)cc1 Amb17678847 [0,1,0,0,1,0|1,0,1]=4 3414 B12R1.20 CC(C(O)=O)c1ccc(I)cc1 Amb20619418 [0,1,0,0,1,0|1,0,1]=4 3415 B12R1.20 CC(C(O)=O)c1ccc(N)cc1 Amb24113246 [0,1,0,0,1,0|1,0,1]=4 3416 B12R1.20 CC(O)C(=O)c1ccc(Cl)cc1 Amb19075148 [0,1,0,0,1,0|1,0,1]=4 3417 B12R1.20 CC(O)C(=O)c1ccc(F)cc1 Amb18805787 [0,1,0,0,1,0|1,0,1]=4 3418 B12R1.20 CC(O)C(=O)c1ccc(O)cc1 Amb24364113 [0,1,0,0,1,0|1,0,1]=4 3419 B12R1.20 CC(c1ccc(cc1)Br)C(=O)O Amb17087424 [0,1,0,0,1,0|1,0,1]=4 3420 B12R1.20 CC(c1ccc(cc1)N)C(=O)O Amb2438888 [0,1,0,0,1,0|1,0,1]=4 3421 B12R1.20 CN(O)C(=O)c1ccc(Br)cc1 Amb21951004 [0,1,0,0,1,0|2,0,0]=4 3422 B12R1.20 CN(O)C(=O)c1ccc(Cl)cc1 Amb22441605 [0,1,0,0,1,0|2,0,0]=4 3423 B12R1.20 CN(O)C(=O)c1ccc(I)cc1 Amb22434673 [0,1,0,0,1,0|2,0,0]=4 3424 B12R1.20 CN(O)C(=O)c1ccc(N)cc1 Amb24760653 [0,1,0,0,1,0|2,0,0]=4 3425 B12R1.20 C[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb24182093 [0,1,0,0,1,0|1,0,1]=4 3426 B12R1.20 C[C@@H](O)C(=O)c1ccc(O)cc1 Amb24737350 [0,1,0,0,1,0|1,0,1]=4 3427 B12R1.20 C[C@@H](c1ccc(O)cc1)C(O)=O Amb21855850 [0,1,0,0,1,0|1,0,1]=4 3428 B12R1.20 C[C@H](C(O)=O)c1ccc(Cl)cc1 Amb24740781 [0,1,0,0,1,0|1,0,1]=4 3429 B12R1.20 C[C@H](C(O)=O)c1ccc(N)cc1 Amb25708326 [0,1,0,0,1,0|1,0,1]=4 3430 B12R1.20 C[C@H](O)C(=O)c1ccc(O)cc1 Amb25735732 [0,1,0,0,1,0|1,0,1]=4 3431 B12R1.20 C[C@H](c1ccc(cc1)F)C(=O)O Amb10843989 [0,1,0,0,1,0|1,0,1]=4 3432 B12R1.20 Cc1c[n]c(cc1)C(=O)C(O)=O Amb24684067 [0,1,0,0,1,0|1,0,0]=3 3433 B12R1.20 Cc1ccc(cc1)C(=O)C(=C)F Amb24738544 [0,1,0,0,1,0|2,0,0]=4 3434 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)C Amb17400105 [0,1,0,0,1,0|1,0,0]=3 3435 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)Cl Amb24068590 [0,1,0,0,1,0|1,0,0]=3 3436 B12R1.20 Cc1ccc(cc1)C(=O)C(C)=C Amb18563492 [0,1,0,0,1,0|2,0,0]=4 3437 B12R1.20 Cc1ccc(cc1)C(=O)C(C)O Amb18800791 [0,1,0,0,1,0|1,0,1]=4 3438 B12R1.20 Cc1ccc(cc1)C(=O)C(N)=O Amb24100697 [0,1,0,0,1,0|1,0,0]=3 3439 B12R1.20 Cc1ccc(cc1)C(=O)C(O)O Amb22261609 [0,1,0,0,1,0|0,0,2]=4 3440 B12R1.20 Cc1ccc(cc1)C(=O)N(C)O Amb24066856 [0,1,0,0,1,0|2,0,0]=4 3441 B12R1.20 Cc1ccc(cc1)C(F)C(O)=O Amb25320951 [0,1,0,0,1,0|1,0,1]=4 3442 B12R1.20 Cc1ccc(cc1)[C@@H](C)C(O)=O Amb22736712 [0,1,0,0,1,0|1,0,1]=4 3443 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(O)=O Amb22747999 [0,1,0,0,1,0|1,0,1]=4 3444 B12R1.20 Cc1ccc(cc1)[C@H](C)C(O)=O Amb22736713 [0,1,0,0,1,0|1,0,1]=4 3445 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)O Amb17261128 [0,1,0,0,1,0|1,0,1]=4 3446 B12R1.20 ClC(c1ccc(cc1)C)C(=O)O Amb17234143 [0,1,0,0,1,0|1,0,1]=4 3447 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)O Amb17238287 [0,1,0,0,1,0|1,0,1]=4 3448 B12R1.20 ClC(c1ccc(cc1)F)C(=O)O Amb17234610 [0,1,0,0,1,0|1,0,1]=4 3449 B12R1.20 NC(=O)C(=O)c1ccc(Br)cc1 Amb21963977 [0,1,0,0,1,0|1,0,0]=3 3450 B12R1.20 NC(=O)C(=O)c1ccc(F)cc1 Amb25856862 [0,1,0,0,1,0|1,0,0]=3 3451 B12R1.20 NC(=O)C(=O)c1ccc(O)cc1 Amb24485532 [0,1,0,0,1,0|1,0,0]=3 3452 B12R1.20 NC(=S)C(=O)c1ccc(Cl)cc1 Amb25150973 [0,1,0,0,1,0|1,1,0]=4 3453 B12R1.20 NC(=S)C(=O)c1ccc(F)cc1 Amb25322130 [0,1,0,0,1,0|1,1,0]=4 3454 B12R1.20 NC(C(O)=O)c1ccc(I)cc1 Amb22899108 [0,1,0,0,1,0|1,0,1]=4 3455 B12R1.20 NC(C(O)=O)c1ccc(S)cc1 Amb24504681 [0,1,0,0,1,0|1,0,1]=4 3456 B12R1.20 NC(c1ccc(cc1)Br)C(=O)O Amb1837854 [0,1,0,0,1,0|1,0,1]=4 3457 B12R1.20 NC(c1ccc(cc1)C)C(=O)O Amb2234620 [0,1,0,0,1,0|1,0,1]=4 3458 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)O Amb1837642 [0,1,0,0,1,0|1,0,1]=4 3459 B12R1.20 NC(c1ccc(cc1)I)C(=O)O Amb2234604 [0,1,0,0,1,0|1,0,1]=4 3460 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)cc1 Amb22745984 [0,1,0,0,1,0|1,0,1]=4 3461 B12R1.20 N[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb19889601 [0,1,0,0,1,0|1,0,1]=4 3462 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)cc1 Amb19889896 [0,1,0,0,1,0|1,0,1]=4 3463 B12R1.20 N[C@@H](C(O)=O)c1ccc(I)cc1 Amb22745451 [0,1,0,0,1,0|1,0,1]=4 3464 B12R1.20 N[C@@H](c1ccc(cc1)C)C(=O)O Amb17621414 [0,1,0,0,1,0|1,0,1]=4 3465 B12R1.20 N[C@H](C(O)=O)c1ccc(F)cc1 Amb19889897 [0,1,0,0,1,0|1,0,1]=4 3466 B12R1.20 N[C@H](C(O)=O)c1ccc(I)cc1 Amb24653870 [0,1,0,0,1,0|1,0,1]=4 3467 B12R1.20 Nc1ccc(cc1)C(F)C(O)=O Amb25376043 [0,1,0,0,1,0|1,0,1]=4 3468 B12R1.20 Nc1ccc(cc1)C(N)C(O)=O Amb18646484 [0,1,0,0,1,0|1,0,1]=4 3469 B12R1.20 Nc1ccc(cc1)C(O)C(O)=O Amb20668152 [0,1,0,0,1,0|0,0,2]=4 3470 B12R1.20 Nc1ccc(cc1)C(S)C(O)=O Amb25299470 [0,1,0,0,1,0|0,1,1]=4 3471 B12R1.20 Nc1ccc(cc1)[C@@H](N)C(O)=O Amb22745344 [0,1,0,0,1,0|1,0,1]=4 3472 B12R1.20 Nc1ccc(cc1)[C@H](N)C(O)=O Amb24568498 [0,1,0,0,1,0|1,0,1]=4 3473 B12R1.20 O=C(Cl)C(=O)c1ccc(Cl)cc1 Amb24068531 [0,1,0,0,1,0|1,0,0]=3 3474 B12R1.20 O=C(Cl)C(=O)c1ccc(F)cc1 Amb24068567 [0,1,0,0,1,0|1,0,0]=3 3475 B12R1.20 O=C(c1ccc(cc1)C)C(=O)O Amb1220932 [0,1,0,0,1,0|0,0,0]=2 3476 B12R1.20 O=C(c1ccc(cc1)F)C(=O)C Amb17400192 [0,1,0,0,1,0|1,0,0]=3 3477 B12R1.20 OC(=O)C(Br)c1ccc(Br)cc1 Amb23510124 [0,1,0,0,1,0|1,0,1]=4 3478 B12R1.20 OC(=O)C(Br)c1ccc(Cl)cc1 Amb18665883 [0,1,0,0,1,0|1,0,1]=4 3479 B12R1.20 OC(=O)C(Br)c1ccc(F)cc1 Amb22337461 [0,1,0,0,1,0|1,0,1]=4 3480 B12R1.20 OC(=O)C(F)c1ccc(Cl)cc1 Amb24355948 [0,1,0,0,1,0|1,0,1]=4 3481 B12R1.20 OC(=O)C(O)c1ccc(I)cc1 Amb25798219 [0,1,0,0,1,0|0,0,2]=4 3482 B12R1.20 OC(=O)C(S)c1ccc(Cl)cc1 Amb24668947 [0,1,0,0,1,0|0,1,1]=4 3483 B12R1.20 OC(=O)[C@@H](F)c1ccc(Br)cc1 Amb25112439 [0,1,0,0,1,0|1,0,1]=4 3484 B12R1.20 OC(=O)[C@@H](O)c1ccc(Br)cc1 Amb22737259 [0,1,0,0,1,0|0,0,2]=4 3485 B12R1.20 OC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb22388650 [0,1,0,0,1,0|0,0,2]=4 3486 B12R1.20 OC(=O)[C@@H](O)c1ccc(F)cc1 Amb25138794 [0,1,0,0,1,0|0,0,2]=4 3487 B12R1.20 OC(=O)[C@@H](S)c1ccc(Cl)cc1 Amb24497033 [0,1,0,0,1,0|0,1,1]=4 3488 B12R1.20 OC(=O)[C@@H](c1ccc(cc1)O)C Amb10843991 [0,1,0,0,1,0|1,0,1]=4 3489 B12R1.20 OC(=O)[C@H](F)c1ccc(Br)cc1 Amb25117435 [0,1,0,0,1,0|1,0,1]=4 3490 B12R1.20 OC(=O)[C@H](O)c1ccc(Br)cc1 Amb22737260 [0,1,0,0,1,0|0,0,2]=4 3491 B12R1.20 OC(=O)[C@H](O)c1ccc(F)cc1 Amb24059762 [0,1,0,0,1,0|0,0,2]=4 3492 B12R1.20 OC(O)C(=O)c1ccc(F)cc1 Amb22261608 [0,1,0,0,1,0|0,0,2]=4 3493 B12R1.20 OC(c1ccc(cc1)F)C(=O)O Amb1218322 [0,1,0,0,1,0|0,0,2]=4 3494 B12R1.20 O[C@H](c1ccc(cc1)C)C(=O)O Amb10808019 [0,1,0,0,1,0|0,0,2]=4 3495 B12R1.20 Oc1ccc(cc1)C(=O)C(=O)Cl Amb24068578 [0,1,0,0,1,0|1,0,0]=3 3496 B12R1.20 Oc1ccc(cc1)C(=O)C(=O)O Amb16231521 [0,1,0,0,1,0|0,0,0]=2 3497 B12R1.20 Oc1ccc(cc1)C(=O)C(O)O Amb22275904 [0,1,0,0,1,0|0,0,2]=4 3498 B12R1.20 Oc1ccc(cc1)[C@@H](O)C(O)=O Amb22745764 [0,1,0,0,1,0|0,0,2]=4 3499 B12R1.20 [O-]C(=O)C(=O)c1ccc(O)cc1 Amb19929368 [0,1,0,0,1,0|0,0,1]=3 3500 B12R1.124 C=C(F)C(=O)c1ccccc1Cl Amb25840713 [0,1,0,0,1,0|2,0,0]=4 3501 B12R1.124 CC(=C)C(=O)c1ccccc1Cl Amb25150050 [0,1,0,0,1,0|2,0,0]=4 3502 B12R1.124 CC(=O)C(=C)c1ccccc1O Amb24408394 [0,1,0,0,1,0|2,0,0]=4 3503 B12R1.124 CC(=O)C(=O)c1ccccc1Br Amb17406919 [0,1,0,0,1,0|1,0,0]=3 3504 B12R1.124 CC(=O)C(=O)c1ccccc1C Amb17400103 [0,1,0,0,1,0|1,0,0]=3 3505 B12R1.124 CC(=O)C(=O)c1ccccc1Cl Amb17400961 [0,1,0,0,1,0|1,0,0]=3 3506 B12R1.124 CC(=O)C(=O)c1ccccc1F Amb17400191 [0,1,0,0,1,0|1,0,0]=3 3507 B12R1.124 CC(=O)C(=O)c1ccccc1O Amb18645956 [0,1,0,0,1,0|1,0,0]=3 3508 B12R1.124 CC(O)C(=O)c1ccccc1Cl Amb24497518 [0,1,0,0,1,0|1,0,1]=4 3509 B12R1.124 CC(O)C(=O)c1ccccc1O Amb24432240 [0,1,0,0,1,0|1,0,1]=4 3510 B12R1.124 CC(c1ccccc1O)C(O)=O Amb22228079 [0,1,0,0,1,0|1,0,1]=4 3511 B12R1.124 CN(O)C(=O)c1ccccc1Br Amb22441618 [0,1,0,0,1,0|2,0,0]=4 3512 B12R1.124 CN(O)C(=O)c1ccccc1F Amb25209803 [0,1,0,0,1,0|2,0,0]=4 3513 B12R1.124 CN(O)C(=O)c1ccccc1I Amb22488577 [0,1,0,0,1,0|2,0,0]=4 3514 B12R1.124 CN(O)C(=O)c1ccccc1N Amb24645123 [0,1,0,0,1,0|2,0,0]=4 3515 B12R1.124 CN(O)C(=O)c1ccccc1O Amb24497359 [0,1,0,0,1,0|2,0,0]=4 3516 B12R1.124 C[C@H](C(O)=O)c1ccccc1Cl Amb25222036 [0,1,0,0,1,0|1,0,1]=4 3517 B12R1.124 C[C@H](O)C(=O)c1ccccc1F Amb24378976 [0,1,0,0,1,0|1,0,1]=4 3518 B12R1.124 Cc1ccc[n]c1C(=O)C(O)=O Amb25361904 [0,1,0,0,1,0|1,0,0]=3 3519 B12R1.124 Cc1cccc[n+]1C(=C)C(O)=O Amb24652359 [0,1,0,0,1,0|2,0,0]=4 3520 B12R1.124 Cc1ccccc1C(=O)C(=O)Cl Amb24100489 [0,1,0,0,1,0|1,0,0]=3 3521 B12R1.124 Cc1ccccc1C(=O)C(C)O Amb24577843 [0,1,0,0,1,0|1,0,1]=4 3522 B12R1.124 Cc1ccccc1C(=O)[C@@H](C)O Amb25282682 [0,1,0,0,1,0|1,0,1]=4 3523 B12R1.124 Cc1ccccc1C(=O)[C@H](C)O Amb24532517 [0,1,0,0,1,0|1,0,1]=4 3524 B12R1.124 Cc1ccccc1C(Br)C(O)=O Amb25136873 [0,1,0,0,1,0|1,0,1]=4 3525 B12R1.124 Cc1ccccc1C(Cl)C(O)=O Amb18564301 [0,1,0,0,1,0|1,0,1]=4 3526 B12R1.124 Cc1ccccc1[C@@H](C)C(O)=O Amb24426211 [0,1,0,0,1,0|1,0,1]=4 3527 B12R1.124 Cc1ccccc1[C@@H](N)C(O)=O Amb17933183 [0,1,0,0,1,0|1,0,1]=4 3528 B12R1.124 Cc1ccccc1[C@H](C)C(O)=O Amb25798862 [0,1,0,0,1,0|1,0,1]=4 3529 B12R1.124 NC(=O)C(=O)c1ccccc1Cl Amb25805251 [0,1,0,0,1,0|1,0,0]=3 3530 B12R1.124 NC(C(O)=O)c1ccccc1F Amb24331712 [0,1,0,0,1,0|1,0,1]=4 3531 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb23440362 [0,1,0,0,1,0|1,0,1]=4 3532 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb25270086 [0,1,0,0,1,0|1,0,1]=4 3533 B12R1.124 N[C@@H](C(O)=O)c1ccccc1F Amb22747759 [0,1,0,0,1,0|1,0,1]=4 3534 B12R1.124 N[C@@H](C(O)=O)c1ccccc1I Amb25055265 [0,1,0,0,1,0|1,0,1]=4 3535 B12R1.124 N[C@@H](C(O)=O)c1ccccc1S Amb24649945 [0,1,0,0,1,0|1,0,1]=4 3536 B12R1.124 N[C@@H](c1ccccc1O)C(O)=O Amb22748113 [0,1,0,0,1,0|1,0,1]=4 3537 B12R1.124 N[C@H](C(O)=O)c1ccccc1I Amb24637866 [0,1,0,0,1,0|1,0,1]=4 3538 B12R1.124 N[C@H](c1ccccc1O)C(O)=O Amb25134608 [0,1,0,0,1,0|1,0,1]=4 3539 B12R1.124 Nc1[n]cccc1C(=O)C(O)=O Amb24390875 [0,1,0,0,1,0|1,0,0]=3 3540 B12R1.124 Nc1cc[n]cc1C(=O)C(O)=O Amb24531526 [0,1,0,0,1,0|1,0,0]=3 3541 B12R1.124 Nc1ccccc1C(=O)C([O-])=O Amb21963722 [0,1,0,0,1,0|0,0,1]=3 3542 B12R1.124 Nc1ccccc1C(O)C(O)=O Amb18646669 [0,1,0,0,1,0|0,0,2]=4 3543 B12R1.124 Nc1ccccc1[C@@H](N)C(O)=O Amb25700852 [0,1,0,0,1,0|1,0,1]=4 3544 B12R1.124 Nc1ccccc1[C@H](O)C(O)=O Amb24373910 [0,1,0,0,1,0|0,0,2]=4 3545 B12R1.124 OC(=O)C(=C)c1ccccc1C Amb17322164 [0,1,0,0,1,0|1,0,0]=3 3546 B12R1.124 OC(=O)C(=C)c1ccccc1Cl Amb17322174 [0,1,0,0,1,0|1,0,0]=3 3547 B12R1.124 OC(=O)C(=C)c1ccccc1F Amb17322167 [0,1,0,0,1,0|1,0,0]=3 3548 B12R1.124 OC(=O)C(=O)c1[n]cccc1F Amb24687974 [0,1,0,0,1,0|1,0,0]=3 3549 B12R1.124 OC(=O)C(=O)c1ccc[n]c1Cl Amb25714810 [0,1,0,0,1,0|1,0,0]=3 3550 B12R1.124 OC(=O)C(=O)c1ccccc1Br Amb13883630 [0,1,0,0,1,0|0,0,0]=2 3551 B12R1.124 OC(=O)C(=O)c1ccccc1C Amb16231619 [0,1,0,0,1,0|0,0,0]=2 3552 B12R1.124 OC(=O)C(=O)c1ccccc1F Amb13883629 [0,1,0,0,1,0|0,0,0]=2 3553 B12R1.124 OC(=O)C(=O)c1ccccc1N Amb17594093 [0,1,0,0,1,0|0,0,0]=2 3554 B12R1.124 OC(=O)C(=O)c1ccccc1O Amb18646415 [0,1,0,0,1,0|0,0,0]=2 3555 B12R1.124 OC(=O)C(Cl)c1ccccc1Br Amb24060809 [0,1,0,0,1,0|1,0,1]=4 3556 B12R1.124 OC(=O)C(Cl)c1ccccc1Cl Amb18066587 [0,1,0,0,1,0|1,0,1]=4 3557 B12R1.124 OC(=O)C(Cl)c1ccccc1F Amb18564556 [0,1,0,0,1,0|1,0,1]=4 3558 B12R1.124 OC(=O)C(O)c1ccccc1I Amb25117434 [0,1,0,0,1,0|0,0,2]=4 3559 B12R1.124 OC(=O)C(c1ccccc1Br)C Amb10844025 [0,1,0,0,1,0|1,0,1]=4 3560 B12R1.124 OC(=O)C(c1ccccc1Br)N Amb2234623 [0,1,0,0,1,0|1,0,1]=4 3561 B12R1.124 OC(=O)C(c1ccccc1C)N Amb1837192 [0,1,0,0,1,0|1,0,1]=4 3562 B12R1.124 OC(=O)C(c1ccccc1Cl)N Amb1841983 [0,1,0,0,1,0|1,0,1]=4 3563 B12R1.124 OC(=O)C(c1ccccc1F)C Amb10843985 [0,1,0,0,1,0|1,0,1]=4 3564 B12R1.124 OC(=O)C(c1ccccc1F)N Amb1837738 [0,1,0,0,1,0|1,0,1]=4 3565 B12R1.124 OC(=O)[C@@H](O)c1ccccc1F Amb22745223 [0,1,0,0,1,0|0,0,2]=4 3566 B12R1.124 OC(=O)[C@H](O)c1ccccc1F Amb24428765 [0,1,0,0,1,0|0,0,2]=4 3567 B12R1.124 OC(O)C(=O)c1ccccc1F Amb24640122 [0,1,0,0,1,0|0,0,2]=4 3568 B12R1.124 Oc1ncccc1C(=O)C(=O)O Amb1084605 [0,1,0,0,1,0|1,0,0]=3 3569 B12R1.225 Brc1cccc(c1)C(=O)C(=O)C Amb17406920 [0,1,0,0,1,0|1,0,0]=3 3570 B12R1.225 CC(=C)C(=O)c1cccc(Br)c1 Amb25751514 [0,1,0,0,1,0|2,0,0]=4 3571 B12R1.225 CC(=C)C(=O)c1cccc(F)c1 Amb24368939 [0,1,0,0,1,0|2,0,0]=4 3572 B12R1.225 CC(=C)C(=O)c1cccc(N)c1 Amb25809287 [0,1,0,0,1,0|2,0,0]=4 3573 B12R1.225 CC(=O)C(=O)c1cc(Cl)[n]cc1 Amb25056360 [0,1,0,0,1,0|2,0,0]=4 3574 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb22265668 [0,1,0,0,1,0|1,0,1]=4 3575 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb24061864 [0,1,0,0,1,0|1,0,1]=4 3576 B12R1.225 CC(O)C(=O)c1cccc(Cl)c1 Amb19075147 [0,1,0,0,1,0|1,0,1]=4 3577 B12R1.225 CC(c1cc(O)ccc1)C(O)=O Amb18646445 [0,1,0,0,1,0|1,0,1]=4 3578 B12R1.225 CN(O)C(=O)c1cccc(Br)c1 Amb25248067 [0,1,0,0,1,0|2,0,0]=4 3579 B12R1.225 C[C@@H](C(O)=O)c1cccc(F)c1 Amb25108167 [0,1,0,0,1,0|1,0,1]=4 3580 B12R1.225 C[C@@H](C(O)=O)c1cccc(N)c1 Amb24182071 [0,1,0,0,1,0|1,0,1]=4 3581 B12R1.225 C[C@H](C(O)=O)c1cccc(Cl)c1 Amb25124032 [0,1,0,0,1,0|1,0,1]=4 3582 B12R1.225 C[C@H](O)C(=O)c1cccc(Cl)c1 Amb24686252 [0,1,0,0,1,0|1,0,1]=4 3583 B12R1.225 C[C@H](c1cc(O)ccc1)C(O)=O Amb24677825 [0,1,0,0,1,0|1,0,1]=4 3584 B12R1.225 Cc1c[n]cc([n]1)C(=O)C(O)=O Amb25206207 [0,1,0,0,1,0|2,0,0]=4 3585 B12R1.225 Cc1cc(ccc1)C(=O)C(C)=C Amb25696247 [0,1,0,0,1,0|2,0,0]=4 3586 B12R1.225 Cc1cc(ccc1)C(=O)C(C)O Amb24576014 [0,1,0,0,1,0|1,0,1]=4 3587 B12R1.225 Cc1cc(ccc1)C(=O)C(O)=O Amb18645964 [0,1,0,0,1,0|0,0,0]=2 3588 B12R1.225 Cc1cc(ccc1)C(=O)C(O)O Amb22491637 [0,1,0,0,1,0|0,0,2]=4 3589 B12R1.225 Cc1cc(ccc1)C(Br)C(O)=O Amb25136874 [0,1,0,0,1,0|1,0,1]=4 3590 B12R1.225 Cc1cc(ccc1)C(Cl)C(O)=O Amb18564302 [0,1,0,0,1,0|1,0,1]=4 3591 B12R1.225 Cc1cc(ccc1)[C@@H](C)C(O)=O Amb25065324 [0,1,0,0,1,0|1,0,1]=4 3592 B12R1.225 Cc1cc(ccc1)[C@@H](N)C(O)=O Amb24182070 [0,1,0,0,1,0|1,0,1]=4 3593 B12R1.225 Cc1cccc(c1)C(=C)C(=O)O Amb17322165 [0,1,0,0,1,0|1,0,0]=3 3594 B12R1.225 Cc1cccc(c1)C(=O)C(=O)C Amb17400104 [0,1,0,0,1,0|1,0,0]=3 3595 B12R1.225 Clc1cccc(c1)C(=C)C(=O)O Amb17322175 [0,1,0,0,1,0|1,0,0]=3 3596 B12R1.225 Clc1cccc(c1)C(=O)C(=O)C Amb17400962 [0,1,0,0,1,0|1,0,0]=3 3597 B12R1.225 Fc1cccc(c1)C(=C)C(=O)O Amb17322168 [0,1,0,0,1,0|1,0,0]=3 3598 B12R1.225 Fc1cccc(c1)C(=O)C(=O)C Amb17400193 [0,1,0,0,1,0|1,0,0]=3 3599 B12R1.225 NC(=O)C(=O)c1cc(Cl)ccc1 Amb24696640 [0,1,0,0,1,0|1,0,0]=3 3600 B12R1.225 NC(c1cc(O)ccc1)C(O)=O Amb21959949 [0,1,0,0,1,0|1,0,1]=4 3601 B12R1.225 N[C@@H](C(O)=O)c1cccc(Br)c1 Amb25122869 [0,1,0,0,1,0|1,0,1]=4 3602 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb22899025 [0,1,0,0,1,0|1,0,1]=4 3603 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb23399639 [0,1,0,0,1,0|1,0,1]=4 3604 B12R1.225 N[C@@H](C(O)=O)c1cccc(I)c1 Amb24342192 [0,1,0,0,1,0|1,0,1]=4 3605 B12R1.225 N[C@@H](C(O)=O)c1cccc(S)c1 Amb25361957 [0,1,0,0,1,0|1,0,1]=4 3606 B12R1.225 N[C@@H](c1cc(O)ccc1)C(O)=O Amb25294728 [0,1,0,0,1,0|1,0,1]=4 3607 B12R1.225 N[C@H](C(O)=O)c1cccc(Br)c1 Amb25150059 [0,1,0,0,1,0|1,0,1]=4 3608 B12R1.225 N[C@H](C(O)=O)c1cccc(Cl)c1 Amb19889600 [0,1,0,0,1,0|1,0,1]=4 3609 B12R1.225 Nc1cc(ccc1)C(N)C(O)=O Amb18646483 [0,1,0,0,1,0|1,0,1]=4 3610 B12R1.225 Nc1cc(ccc1)C(O)C(O)=O Amb18646668 [0,1,0,0,1,0|0,0,2]=4 3611 B12R1.225 OC(=O)C(=O)c1cc(Br)ccc1 Amb18135081 [0,1,0,0,1,0|0,0,0]=2 3612 B12R1.225 OC(=O)C(=O)c1cc(Cl)ccc1 Amb18649007 [0,1,0,0,1,0|0,0,0]=2 3613 B12R1.225 OC(=O)C(=O)c1cc(F)ccc1 Amb18646830 [0,1,0,0,1,0|0,0,0]=2 3614 B12R1.225 OC(=O)C(Br)c1cc(Br)ccc1 Amb25053820 [0,1,0,0,1,0|1,0,1]=4 3615 B12R1.225 OC(=O)C(Br)c1cccc(Cl)c1 Amb25302971 [0,1,0,0,1,0|1,0,1]=4 3616 B12R1.225 OC(=O)C(Cl)c1cc(Cl)ccc1 Amb18066588 [0,1,0,0,1,0|1,0,1]=4 3617 B12R1.225 OC(=O)C(Cl)c1cccc(Br)c1 Amb18582806 [0,1,0,0,1,0|1,0,1]=4 3618 B12R1.225 OC(=O)C(O)c1cccc(I)c1 Amb25223767 [0,1,0,0,1,0|0,0,2]=4 3619 B12R1.225 OC(=O)C(c1cccc(c1)Br)C Amb10602488 [0,1,0,0,1,0|1,0,1]=4 3620 B12R1.225 OC(=O)C(c1cccc(c1)Br)N Amb2431609 [0,1,0,0,1,0|1,0,1]=4 3621 B12R1.225 OC(=O)C(c1cccc(c1)C)C Amb17232469 [0,1,0,0,1,0|1,0,1]=4 3622 B12R1.225 OC(=O)C(c1cccc(c1)C)N Amb1840070 [0,1,0,0,1,0|1,0,1]=4 3623 B12R1.225 OC(=O)C(c1cccc(c1)Cl)N Amb1840776 [0,1,0,0,1,0|1,0,1]=4 3624 B12R1.225 OC(=O)C(c1cccc(c1)F)C Amb17232662 [0,1,0,0,1,0|1,0,1]=4 3625 B12R1.225 OC(=O)C(c1cccc(c1)F)N Amb2431604 [0,1,0,0,1,0|1,0,1]=4 3626 B12R1.225 OC(=O)[C@@H](O)c1cccc(Cl)c1 Amb22388644 [0,1,0,0,1,0|0,0,2]=4 3627 B12R1.225 OC(=O)[C@@H](O)c1cccc(F)c1 Amb24429173 [0,1,0,0,1,0|0,0,2]=4 3628 B12R1.225 OC(=O)[C@H](O)c1cccc(Br)c1 Amb24604441 [0,1,0,0,1,0|0,0,2]=4 3629 B12R1.225 OC(=O)[C@H](O)c1cccc(Cl)c1 Amb22351582 [0,1,0,0,1,0|0,0,2]=4 3630 B12R1.225 OC(O)C(=O)c1cccc(Br)c1 Amb19887409 [0,1,0,0,1,0|0,0,2]=4 3631 B12R1.225 OC(O)C(=O)c1cccc(Cl)c1 Amb20242596 [0,1,0,0,1,0|0,0,2]=4 3632 B12R1.225 OC(O)C(=O)c1cccc(F)c1 Amb19929272 [0,1,0,0,1,0|0,0,2]=4 3633 B12R1.225 Oc1cccc(c1)C(S)C(O)=O Amb25295477 [0,1,0,0,1,0|0,1,1]=4 3634 B12R1.225 Oc1cccc(c1)[C@@H](O)C(O)=O Amb25036246 [0,1,0,0,1,0|0,0,2]=4 3635 B12R1.253 CC(Br)(C(O)=O)c1ccccc1 Amb18135055 [0,1,0,0,1,0|1,0,1]=4 3636 B12R1.253 CC(C)(C(O)=O)c1ccccc1 Amb17773441 [0,1,0,0,1,0|1,0,1]=4 3637 B12R1.253 CC(Cl)(C(O)=O)c1ccccc1 Amb18649035 [0,1,0,0,1,0|1,0,1]=4 3638 B12R1.253 CC(F)(C(O)=O)c1ccccc1 Amb22547630 [0,1,0,0,1,0|1,0,1]=4 3639 B12R1.253 CC(O)(c1ccccc1)C(O)=O Amb22347941 [0,1,0,0,1,0|0,0,2]=4 3640 B12R1.253 C[C@@](F)(C(O)=O)c1ccccc1 Amb25279569 [0,1,0,0,1,0|1,0,1]=4 3641 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22225774 [0,1,0,0,1,0|1,0,1]=4 3642 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22747027 [0,1,0,0,1,0|1,0,1]=4 3643 B12R1.253 C[C@](F)(C(O)=O)c1ccccc1 Amb25100972 [0,1,0,0,1,0|1,0,1]=4 3644 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb19929597 [0,1,0,0,1,0|1,0,1]=4 3645 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb25692685 [0,1,0,0,1,0|1,0,1]=4 3646 B12R1.253 C[C@](O)(c1ccccc1)C(O)=O Amb22226510 [0,1,0,0,1,0|0,0,2]=4 3647 B12R1.253 NC(O)(c1ccccc1)C(O)=O Amb24092513 [0,1,0,0,1,0|0,0,2]=4 3648 B12R1.253 OC(=O)C(Cl)(Br)c1ccccc1 Amb25679634 [0,1,0,0,1,0|1,0,1]=4 3649 B12R1.253 OC(=O)C(Cl)(Cl)c1ccccc1 Amb25674448 [0,1,0,0,1,0|1,0,1]=4 3650 B12R1.253 OC(=O)C(F)(Cl)c1ccccc1 Amb24532752 [0,1,0,0,1,0|1,0,1]=4 3651 B12R1.253 OC(=O)C(O)(O)c1ccccc1 Amb25684790 [0,1,0,0,1,0|0,0,2]=4 3652 B12R1.253 OC(=O)C(c1ccccc1)(F)F Amb1197472 [0,1,0,0,1,0|1,0,1]=4 3653 B12R1.253 OC(=O)C(c1ccccc1)(N)C Amb10711147 [0,1,0,0,1,0|1,0,1]=4 3654 B12R1.253 [2H]C([2H])(C(O)=O)c1ccccc1 Amb22353301 [0,1,0,0,1,0|1,0,1]=4 3655 B12R1.478 C/C(O)=C(/C=O)c1ccccc1 Amb17777663 [0,1,0,0,1,0|1,0,0]=3 3656 B12R1.478 C=C=C(C(O)=O)c1ccccc1 Amb24717361 [0,1,0,0,1,0|1,0,0]=3 3657 B12R1.478 C=CC(C(O)=O)c1ccccc1 Amb18645652 [0,1,0,0,1,0|1,0,1]=4 3658 B12R1.478 C=NC(C(O)=O)c1ccccc1 Amb24068840 [0,1,0,0,1,0|1,0,1]=4 3659 B12R1.478 CC(=O)C(/c1ccccc1)=C\N Amb17777807 [0,1,0,0,1,0|2,0,0]=4 3660 B12R1.478 CC(=O)C(=C=O)c1ccccc1 Amb25730145 [0,1,0,0,1,0|1,0,0]=3 3661 B12R1.478 CC(=O)C(=[N+]=[N-])c1ccccc1 Amb17593995 [0,1,0,0,1,0|2,0,0]=4 3662 B12R1.478 CC(=O)C(C=O)c1ccccc1 Amb18126328 [0,1,0,0,1,0|1,0,1]=4 3663 B12R1.478 CC(=O)C(N=O)c1ccccc1 Amb25322912 [0,1,0,0,1,0|1,0,1]=4 3664 B12R1.478 CC(=O)\C(=C\C)\c1ccccc1 Amb24378467 [0,1,0,0,1,0|2,0,0]=4 3665 B12R1.478 CC(=O)\C(=C\N)\c1ccccc1 Amb25238332 [0,1,0,0,1,0|2,0,0]=4 3666 B12R1.478 CC(=O)\C(=N\O)\c1ccccc1 Amb24700799 [0,1,0,0,1,0|1,0,1]=4 3667 B12R1.478 CC(C)=C(C=O)c1ccccc1 Amb18645378 [0,1,0,0,1,0|2,0,0]=4 3668 B12R1.478 CNC(C(O)=O)c1ccccc1 Amb19346335 [0,1,0,0,1,0|1,0,1]=4 3669 B12R1.478 CN[C@@H](c1ccccc1)C(=O)O Amb16183859 [0,1,0,0,1,0|1,0,1]=4 3670 B12R1.478 CN[C@H](c1ccccc1)C(=O)O Amb16183947 [0,1,0,0,1,0|1,0,1]=4 3671 B12R1.478 COC(c1ccccc1)C(=O)O Amb2099459 [0,1,0,0,1,0|0,0,2]=4 3672 B12R1.478 CSC(C(O)=O)c1ccccc1 Amb18971615 [0,1,0,0,1,0|0,1,1]=4 3673 B12R1.478 C\C(\Cl)=C(\C=O)/c1ccccc1 Amb18648445 [0,1,0,0,1,0|2,0,0]=4 3674 B12R1.478 C\N=C(\C(O)=O)/c1ccccc1 Amb24652432 [0,1,0,0,1,0|1,0,0]=3 3675 B12R1.478 N#CC(c1ccccc1)C(=O)O Amb1783147 [0,1,0,0,1,0|1,0,1]=4 3676 B12R1.478 N#C\C(=C(/O)\C)\c1ccccc1 Amb2385739 [0,1,0,0,1,0|2,0,0]=4 3677 B12R1.478 NC(=O)N(N=O)c1ccccc1 Amb20000996 [0,1,0,0,1,0|2,0,0]=4 3678 B12R1.478 NC(=O)\C(=C\Cl)\c1ccccc1 Amb24538838 [0,1,0,0,1,0|2,0,0]=4 3679 B12R1.478 NC(=O)\C(=C\O)\c1ccccc1 Amb25231959 [0,1,0,0,1,0|1,0,1]=4 3680 B12R1.478 NC(=O)\C(=N/F)\c1ccccc1 Amb25708534 [0,1,0,0,1,0|2,0,0]=4 3681 B12R1.478 NC(=O)\C(=N\F)\c1ccccc1 Amb25336557 [0,1,0,0,1,0|2,0,0]=4 3682 B12R1.478 NC(=O)\C(=N\N)\c1ccccc1 Amb25785115 [0,1,0,0,1,0|2,0,0]=4 3683 B12R1.478 NC(=O)\C(=N\O)\c1ccccc1 Amb23481030 [0,1,0,0,1,0|1,0,1]=4 3684 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22756742 [0,1,0,0,1,0|1,0,1]=4 3685 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22757442 [0,1,0,0,1,0|1,0,1]=4 3686 B12R1.478 NC[C@H](C(O)=O)c1ccccc1 Amb24674068 [0,1,0,0,1,0|1,0,1]=4 3687 B12R1.478 NNC(c1ccccc1)C(=O)O Amb17400196 [0,1,0,0,1,0|1,0,1]=4 3688 B12R1.478 NN[C@@H](C(O)=O)c1ccccc1 Amb24562213 [0,1,0,0,1,0|1,0,1]=4 3689 B12R1.478 NN[C@H](C(O)=O)c1ccccc1 Amb25132135 [0,1,0,0,1,0|1,0,1]=4 3690 B12R1.478 N\N=C(/C(O)=O)\c1ccccc1 Amb24068345 [0,1,0,0,1,0|1,0,0]=3 3691 B12R1.478 N\N=C(\C(O)=O)/c1ccccc1 Amb25701762 [0,1,0,0,1,0|1,0,0]=3 3692 B12R1.478 OC(=O)C(CBr)c1ccccc1 Amb24097514 [0,1,0,0,1,0|1,0,1]=4 3693 B12R1.478 OC(=O)C(CCl)c1ccccc1 Amb24099910 [0,1,0,0,1,0|1,0,1]=4 3694 B12R1.478 OC(=O)C(CF)c1ccccc1 Amb25201999 [0,1,0,0,1,0|1,0,1]=4 3695 B12R1.478 OC(=O)C(CS)c1ccccc1 Amb18303086 [0,1,0,0,1,0|0,1,1]=4 3696 B12R1.478 OC(=O)[C@@H](CF)c1ccccc1 Amb24470137 [0,1,0,0,1,0|1,0,1]=4 3697 B12R1.478 OC(=O)[C@@H](CO)c1ccccc1 Amb25109240 [0,1,0,0,1,0|0,0,2]=4 3698 B12R1.478 OC(=O)[C@H](NO)c1ccccc1 Amb25700967 [0,1,0,0,1,0|0,0,2]=4 3699 B12R1.478 OC(=O)\C(=C\O)\c1ccccc1 Amb24598641 [0,1,0,0,1,0|0,0,1]=3 3700 B12R1.478 OC(=O)\C(=N\O)\c1ccc[n]c1 Amb24590212 [0,1,0,0,1,0|1,0,1]=4 3701 B12R1.478 OC(=O)\C(=N\O)\c1cccc[n]1 Amb25279584 [0,1,0,0,1,0|1,0,1]=4 3702 B12R1.478 OC(=O)\C(=N\O)\c1ccccc1 Amb22230611 [0,1,0,0,1,0|0,0,1]=3 3703 B12R1.478 O\N=C(\c1ccccc1)/C(=O)N Amb2153257 [0,1,0,0,1,0|1,0,1]=4 3704 B12R1.478 [C-]#[N+]C(C(O)=O)c1ccccc1 Amb25290234 [0,1,0,0,1,0|1,0,1]=4 3705 B12R1.478 [NH3+]CC(C(O)=O)c1ccccc1 Amb22546483 [0,1,0,0,1,0|1,0,1]=4 3706 B12R1.478 [O-]\C=C(\c1ccccc1)/C(=O)C Amb10553866 [0,1,0,0,1,0|1,0,1]=4 3707 B12R1.564 OP(O)(=O)C(=O)c1ccccc1 Amb22230257 [0,1,0,0,1,0|1,0,0]=3 3708 B14R1.337 CC(=O)CC(=O)Nc1ccccc1N Amb18651165 [0,1,0,0,0,1|2,0,0]=4 3709 B14R1.337 CC(=O)CC(=O)Nc1ccccc1O Amb18651406 [0,1,0,0,0,1|2,0,0]=4 3710 B14R1.337 CC(=O)NC(=O)Nc1ccccc1Cl Amb24444440 [0,1,0,0,0,1|2,0,0]=4 3711 B14R1.337 CC(Cc1ccccc1C)CC(=O)O Amb17235384 [0,1,0,0,0,1|1,0,1]=4 3712 B14R1.337 CC(Cc1ccccc1Cl)CC(=O)O Amb17241244 [0,1,0,0,0,1|1,0,1]=4 3713 B14R1.337 CC(Cc1ccccc1F)CC(=O)O Amb17236372 [0,1,0,0,0,1|1,0,1]=4 3714 B14R1.337 CN(Cc1ccccc1F)CC(=O)O Amb13948950 [0,1,0,0,0,1|2,0,0]=4 3715 B14R1.337 CN(Cc1ccccc1I)CC(O)=O Amb21861672 [0,1,0,0,0,1|2,0,0]=4 3716 B14R1.337 C\C(=C/C(=O)O)\Cc1ccccc1C Amb17234894 [0,1,0,0,0,1|1,0,0]=3 3717 B14R1.337 C\C(=C/C(=O)O)\Cc1ccccc1Cl Amb17240730 [0,1,0,0,0,1|1,0,0]=3 3718 B14R1.337 C\C(=C/C(=O)O)\Cc1ccccc1F Amb17235881 [0,1,0,0,0,1|1,0,0]=3 3719 B14R1.337 C\C(=C/C(O)=O)\Nc1ccccc1C Amb24348086 [0,1,0,0,0,1|2,0,0]=4 3720 B14R1.337 C\C(\CC(O)=O)=C/c1ccccc1O Amb25373069 [0,1,0,0,0,1|1,0,1]=4 3721 B14R1.337 C\C(\CC(O)=O)=C\c1ccccc1O Amb25063338 [0,1,0,0,0,1|1,0,1]=4 3722 B14R1.337 C\C(\CC(O)=O)=N\c1ccccc1F Amb24402481 [0,1,0,0,0,1|2,0,0]=4 3723 B14R1.337 C\C(\CN1C=CC=CC1=O)=C\C(O)=O Amb25049804 [0,1,0,0,0,1|2,0,0]=4 3724 B14R1.337 Cc1ccccc1CC(=O)NC(N)=O Amb24335874 [0,1,0,0,0,1|1,0,0]=3 3725 B14R1.337 Cc1ccccc1C[C@@H](N)CC(O)=O Amb22747177 [0,1,0,0,0,1|1,0,1]=4 3726 B14R1.337 Cc1ccccc1NC(=O)CC(N)=O Amb25322008 [0,1,0,0,0,1|2,0,0]=4 3727 B14R1.337 NC(=O)NC(=O)Nc1ccccc1S Amb24666634 [0,1,0,0,0,1|2,0,0]=4 3728 B14R1.337 NC(Cc1ccccc1Br)CC(=O)O Amb17473601 [0,1,0,0,0,1|1,0,1]=4 3729 B14R1.337 NC(Cc1ccccc1C)CC(=O)O Amb17470840 [0,1,0,0,0,1|1,0,1]=4 3730 B14R1.337 NC(Cc1ccccc1Cl)CC(=O)O Amb17471478 [0,1,0,0,0,1|1,0,1]=4 3731 B14R1.337 NC(Cc1ccccc1F)CC(=O)O Amb17470954 [0,1,0,0,0,1|1,0,1]=4 3732 B14R1.337 NC(N)=NC(=O)Cc1ccccc1Cl Amb24682839 [0,1,0,0,0,1|2,0,0]=4 3733 B14R1.337 N[C@@H](Cc1ccccc1Br)CC(O)=O Amb22746341 [0,1,0,0,0,1|1,0,1]=4 3734 B14R1.337 N[C@@H](Cc1ccccc1Cl)CC(O)=O Amb22746257 [0,1,0,0,0,1|1,0,1]=4 3735 B14R1.337 N[C@@H](Cc1ccccc1F)CC(=O)O Amb16231750 [0,1,0,0,0,1|1,0,1]=4 3736 B14R1.337 N[C@@H](Cc1ccccc1F)CC(O)=O Amb22747012 [0,1,0,0,0,1|1,0,1]=4 3737 B14R1.337 N[C@H](Cc1ccccc1C)CC(=O)O Amb16231753 [0,1,0,0,0,1|1,0,1]=4 3738 B14R1.337 N[C@H](Cc1ccccc1F)CC(O)=O Amb19929569 [0,1,0,0,0,1|1,0,1]=4 3739 B14R1.337 O=C(CC(=O)Cl)Nc1ccccc1I Amb22547436 [0,1,0,0,0,1|2,0,0]=4 3740 B14R1.337 O=C(Cc1ccccc1C)CC(=O)C Amb17234893 [0,1,0,0,0,1|1,0,0]=3 3741 B14R1.337 O=C(Cc1ccccc1Cl)CC(=O)C Amb17240729 [0,1,0,0,0,1|1,0,0]=3 3742 B14R1.337 O=C(Cc1ccccc1F)CC(=O)C Amb17235880 [0,1,0,0,0,1|1,0,0]=3 3743 B14R1.337 O=C(Nc1ccccc1Br)CC(=O)O Amb17415230 [0,1,0,0,0,1|1,0,0]=3 3744 B14R1.337 O=C(Nc1ccccc1C)CC(=O)O Amb10607901 [0,1,0,0,0,1|1,0,0]=3 3745 B14R1.337 O=C(Nc1ccccc1C)NC(=O)N Amb11032602 [0,1,0,0,0,1|2,0,0]=4 3746 B14R1.337 O=C(Nc1ccccc1Cl)CC(=O)C Amb1643784 [0,1,0,0,0,1|2,0,0]=4 3747 B14R1.337 O=C(Nc1ccccc1Cl)CC(=O)O Amb2433926 [0,1,0,0,0,1|1,0,0]=3 3748 B14R1.337 O=C(Nc1ccccc1Cl)NC(=O)N Amb16763819 [0,1,0,0,0,1|2,0,0]=4 3749 B14R1.337 O=C(Nc1ccccc1F)CC(=O)C Amb1209240 [0,1,0,0,0,1|2,0,0]=4 3750 B14R1.337 O=C(Nc1ccccc1F)CC(=O)O Amb1911680 [0,1,0,0,0,1|1,0,0]=3 3751 B14R1.337 OC(=O)CC(=O)Nc1c[n]ccc1Cl Amb24357845 [0,1,0,0,0,1|2,0,0]=4 3752 B14R1.337 OC(=O)CC(=O)Nc1cc[n]cc1F Amb24727826 [0,1,0,0,0,1|2,0,0]=4 3753 B14R1.337 OC(=O)CC(=O)Nc1ccc[n]c1Cl Amb18987404 [0,1,0,0,0,1|2,0,0]=4 3754 B14R1.337 OC(=O)CC(=O)Nc1ccccc1I Amb25663820 [0,1,0,0,0,1|1,0,0]=3 3755 B14R1.337 OC(=O)CC(=O)Nc1ccccc1O Amb24312551 [0,1,0,0,0,1|1,0,0]=3 3756 B14R1.337 OC(Cc1ccccc1C)CC(=O)O Amb17235898 [0,1,0,0,0,1|0,0,2]=4 3757 B14R1.337 OC(Cc1ccccc1Cl)CC(=O)O Amb17241781 [0,1,0,0,0,1|0,0,2]=4 3758 B14R1.337 OC(Cc1ccccc1F)CC(=O)O Amb17236718 [0,1,0,0,0,1|0,0,2]=4 3759 B14R1.417 CC(C)=CC(=O)C(O)c1ccccc1 Amb25169829 [0,1,0,0,0,1|2,0,0]=4 3760 B14R1.417 CC(c1ccccc1)C(=O)NC(N)=O Amb25359818 [0,1,0,0,0,1|1,0,0]=3 3761 B14R1.417 CC(c1ccccc1)N(CC(=O)O)C Amb17336640 [0,1,0,0,0,1|2,0,0]=4 3762 B14R1.417 CN(c1ccccc1)C(=O)CC(=O)O Amb17401705 [0,1,0,0,0,1|1,0,0]=3 3763 B14R1.417 C\C(=C/C(O)=O)\C(=O)c1ccccc1 Amb25124068 [0,1,0,0,0,1|1,0,1]=4 3764 B14R1.417 C\C(=C/C(O)=O)\C(C)c1ccccc1 Amb25074635 [0,1,0,0,0,1|1,0,0]=3 3765 B14R1.417 C\C(=C\C(O)=O)\C(=O)c1ccccc1 Amb25805702 [0,1,0,0,0,1|1,0,1]=4 3766 B14R1.417 C\C(\O)=C\C(=O)C(O)c1ccccc1 Amb24354377 [0,1,0,0,0,1|1,0,0]=3 3767 B14R1.417 ClC(c1ccccc1)C(=O)NC(=O)N Amb1210955 [0,1,0,0,0,1|1,0,0]=3 3768 B14R1.417 NC(=O)NC(=O)C(O)c1ccccc1 Amb25087809 [0,1,0,0,0,1|1,0,0]=3 3769 B14R1.417 NC(=O)NC(=O)[C@H](N)c1ccccc1 Amb25805524 [0,1,0,0,0,1|1,0,0]=3 3770 B14R1.417 NC(CC(O)=O)C(O)c1ccccc1 Amb18108613 [0,1,0,0,0,1|1,0,1]=4 3771 B14R1.417 OC(=O)\C=C(/Cl)\C(=O)c1ccccc1 Amb25835651 [0,1,0,0,0,1|1,0,1]=4 3772 B14R1.417 OC(=O)\C=C(\Cl)/C(=O)c1ccccc1 Amb24512928 [0,1,0,0,0,1|1,0,1]=4 3773 B14R1.425 CC(=O)C(=O)C(=O)Nc1ccccc1 Amb24425068 [0,1,0,0,0,1|2,0,0]=4 3774 B14R1.425 CC(=O)C(Br)C(=O)Nc1ccccc1 Amb23533866 [0,1,0,0,0,1|2,0,0]=4 3775 B14R1.425 CC(=O)C(O)C(=O)Nc1ccccc1 Amb24369197 [0,1,0,0,0,1|2,0,0]=4 3776 B14R1.425 CC(=O)N(C)C(=O)Nc1ccccc1 Amb25703684 [0,1,0,0,0,1|2,0,0]=4 3777 B14R1.425 CC(=O)N(O)C(=O)Cc1ccccc1 Amb22754381 [0,1,0,0,0,1|1,0,0]=3 3778 B14R1.425 CC(=O)N(O)C(=O)Nc1ccccc1 Amb25137192 [0,1,0,0,0,1|2,0,0]=4 3779 B14R1.425 CC(C(N)=O)C(=O)Nc1ccccc1 Amb25053958 [0,1,0,0,0,1|2,0,0]=4 3780 B14R1.425 CC(C(O)=O)C(=O)Nc1ccccc1 Amb25100996 [0,1,0,0,0,1|1,0,0]=3 3781 B14R1.425 CC(C(O)=O)C(=S)Nc1ccccc1 Amb25313155 [0,1,0,0,0,1|1,1,0]=4 3782 B14R1.425 CC(C(O)=O)N(O)Cc1ccccc1 Amb24374587 [0,1,0,0,0,1|1,0,1]=4 3783 B14R1.425 CN(C(=O)Cl)C(=O)Nc1ccccc1 Amb24452168 [0,1,0,0,0,1|2,0,0]=4 3784 B14R1.425 CN(C(N)=O)C(=O)Nc1ccccc1 Amb24498078 [0,1,0,0,0,1|2,0,0]=4 3785 B14R1.425 CN(Cc1ccccc1)[C@H](C)C(O)=O Amb25299435 [0,1,0,0,0,1|2,0,0]=4 3786 B14R1.425 C\C(=C/c1ccccc1)\[C@@H](O)C(O)=O Amb24433903 [0,1,0,0,0,1|1,0,1]=4 3787 B14R1.425 C\C(\O)=C(/Cl)\C(=O)Nc1ccccc1 Amb22330449 [0,1,0,0,0,1|2,0,0]=4 3788 B14R1.425 C\C(\O)=C(\Cl)/C(=O)Nc1ccccc1 Amb24561283 [0,1,0,0,0,1|2,0,0]=4 3789 B14R1.425 ClC(C(=O)C)C(=O)Nc1ccccc1 Amb1643690 [0,1,0,0,0,1|2,0,0]=4 3790 B14R1.425 NC(=O)N(O)C(=O)Nc1ccccc1 Amb24595360 [0,1,0,0,0,1|2,0,0]=4 3791 B14R1.425 NC(Cc1ccccc1)C(O)C(O)=O Amb18652122 [0,1,0,0,0,1|1,0,1]=4 3792 B14R1.425 N[C@@H](Cc1ccccc1)[C@@H](O)C(O)=O Amb22744925 [0,1,0,0,0,1|1,0,1]=4 3793 B14R1.425 N[C@@H](Cc1ccccc1)[C@@H](O)C(O)=O Amb22750622 [0,1,0,0,0,1|1,0,1]=4 3794 B14R1.425 N[C@@H](Cc1ccccc1)[C@H](O)C(O)=O Amb22746338 [0,1,0,0,0,1|1,0,1]=4 3795 B14R1.425 N[C@@H](Cc1ccccc1)[C@H](O)C(O)=O Amb22747652 [0,1,0,0,0,1|1,0,1]=4 3796 B14R1.425 OC(=O)C(=O)C(=O)Nc1c[n]ccc1 Amb25216008 [0,1,0,0,0,1|2,0,0]=4 3797 B14R1.425 OC(=O)C(=O)C(=O)Nc1cccc[n]1 Amb24421387 [0,1,0,0,0,1|2,0,0]=4 3798 B14R1.433 OP(O)(=O)OC(=O)Nc1ccccc1 Amb25775823 [0,1,0,0,0,1|2,0,0]=4 3799 B14R1.433 OS(=O)(=O)NC(=O)Nc1ccccc1 Amb25760034 [0,1,0,0,0,1|2,0,0]=4 3800 B14R1.549 C\N=C(\Cc1ccccc1)/NC(N)=O Amb24737594 [0,1,0,0,0,1|2,0,0]=4 3801 B14R1.549 N#CC(Cc1ccccc1)CC(=O)O Amb17336081 [0,1,0,0,0,1|1,0,1]=4 3802 B14R1.549 O=NN(Cc1ccccc1)CC(=O)O Amb17595089 [0,1,0,0,0,1|1,0,0]=3 3803 B14R1.549 OC(=O)CN(Cc1ccccc1)C=O Amb18651419 [0,1,0,0,0,1|1,0,0]=3 3804 B14R1.698 CC(=O)CC(=O)Nc1ccc(O)cc1 Amb19041964 [0,1,0,0,0,1|2,0,0]=4 3805 B14R1.698 CC(=O)NC(=O)Cc1ccc(Cl)cc1 Amb25119239 [0,1,0,0,0,1|1,0,0]=3 3806 B14R1.698 CC(C)=CC(=O)Cc1ccc(Br)cc1 Amb25702914 [0,1,0,0,0,1|2,0,0]=4 3807 B14R1.698 CC(C)=CC(=O)Cc1ccc(Cl)cc1 Amb25193459 [0,1,0,0,0,1|2,0,0]=4 3808 B14R1.698 CC(C)=CC(=O)Cc1ccc(I)cc1 Amb24414345 [0,1,0,0,0,1|2,0,0]=4 3809 B14R1.698 CC(C)=CC(=O)Cc1ccc(N)cc1 Amb24460147 [0,1,0,0,0,1|2,0,0]=4 3810 B14R1.698 CC(Cc1ccc(Cl)cc1)OC(O)=O Amb24063646 [0,1,0,0,0,1|1,0,1]=4 3811 B14R1.698 CC(Cc1ccc(cc1)Br)CC(=O)O Amb17265523 [0,1,0,0,0,1|1,0,1]=4 3812 B14R1.698 CC(Cc1ccc(cc1)F)CC(=O)O Amb17236375 [0,1,0,0,0,1|1,0,1]=4 3813 B14R1.698 CC(Cc1ccc(cc1)O)CC(=O)O Amb17336807 [0,1,0,0,0,1|1,0,1]=4 3814 B14R1.698 CN(Cc1ccc(I)cc1)CC(O)=O Amb22032587 [0,1,0,0,0,1|2,0,0]=4 3815 B14R1.698 CN(Cc1ccc(cc1)F)CC(=O)O Amb13948951 [0,1,0,0,0,1|2,0,0]=4 3816 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)Br Amb17264237 [0,1,0,0,0,1|1,0,0]=3 3817 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)C Amb17234900 [0,1,0,0,0,1|1,0,0]=3 3818 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)Cl Amb17240736 [0,1,0,0,0,1|1,0,0]=3 3819 B14R1.698 C\C(=C/C(=O)O)\Cc1ccc(cc1)F Amb17235884 [0,1,0,0,0,1|1,0,0]=3 3820 B14R1.698 C\C(\CC(O)=O)=C/c1ccc(Cl)cc1 Amb18656985 [0,1,0,0,0,1|1,0,1]=4 3821 B14R1.698 C\C(\CC(O)=O)=C\c1ccc(O)cc1 Amb24739773 [0,1,0,0,0,1|1,0,1]=4 3822 B14R1.698 C\C(\Cc1ccc(Br)cc1)=C\C(C)=O Amb24409214 [0,1,0,0,0,1|2,0,0]=4 3823 B14R1.698 Cc1ccc(CC(=O)NC(N)=O)cc1 Amb22446941 [0,1,0,0,0,1|1,0,0]=3 3824 B14R1.698 Cc1ccc(CC(Br)CC(O)=O)cc1 Amb18108429 [0,1,0,0,0,1|1,0,1]=4 3825 B14R1.698 Cc1ccc(CC(Cl)CC(O)=O)cc1 Amb18627988 [0,1,0,0,0,1|1,0,1]=4 3826 B14R1.698 Cc1ccc(CN(C)CC(O)=O)cc1 Amb22587218 [0,1,0,0,0,1|2,0,0]=4 3827 B14R1.698 Cc1ccc(cc1)N\C(\C)=C/C(O)=O Amb25794283 [0,1,0,0,0,1|2,0,0]=4 3828 B14R1.698 Cc1ccc(cc1)OC(=O)NC(N)=O Amb24711384 [0,1,0,0,0,1|2,0,0]=4 3829 B14R1.698 Cc1ccc(cc1)O\C(\C)=C/C(O)=O Amb24634072 [0,1,0,0,0,1|2,0,0]=4 3830 B14R1.698 Cc1ccc(cc1)S\C(\C)=C/C(O)=O Amb25254146 [0,1,0,0,0,1|2,0,0]=4 3831 B14R1.698 Cc1ccc(cc1)S\C(\C)=C\C(O)=O Amb18656294 [0,1,0,0,0,1|2,0,0]=4 3832 B14R1.698 NC(=O)CC(=O)Nc1ccc(Cl)cc1 Amb24666656 [0,1,0,0,0,1|2,0,0]=4 3833 B14R1.698 NC(=O)CC(=O)Nc1ccc(N)cc1 Amb25827415 [0,1,0,0,0,1|2,0,0]=4 3834 B14R1.698 NC(=O)CC(=O)Nc1ccc(O)cc1 Amb25111059 [0,1,0,0,0,1|2,0,0]=4 3835 B14R1.698 NC(=O)NC(=O)Cc1ccc(Cl)cc1 Amb22446935 [0,1,0,0,0,1|1,0,0]=3 3836 B14R1.698 NC(=O)NC(=O)Cc1ccc(N)c[n]1 Amb25100612 [0,1,0,0,0,1|2,0,0]=4 3837 B14R1.698 NC(=O)NC(=O)Cc1ccc(N)cc1 Amb18938593 [0,1,0,0,0,1|1,0,0]=3 3838 B14R1.698 NC(=O)NC(=O)Nc1ccc(F)cc1 Amb22482720 [0,1,0,0,0,1|2,0,0]=4 3839 B14R1.698 NC(Cc1ccc(O)cc1)CC(O)=O Amb18814153 [0,1,0,0,0,1|1,0,1]=4 3840 B14R1.698 NC(Cc1ccc(cc1)Br)CC(=O)O Amb17473597 [0,1,0,0,0,1|1,0,1]=4 3841 B14R1.698 NC(Cc1ccc(cc1)Cl)CC(=O)O Amb17471486 [0,1,0,0,0,1|1,0,1]=4 3842 B14R1.698 NC(N)=NC(=O)Cc1ccc(Cl)cc1 Amb24530645 [0,1,0,0,0,1|2,0,0]=4 3843 B14R1.698 NC(N)=NC(=O)Cc1ccc(O)cc1 Amb24535333 [0,1,0,0,0,1|2,0,0]=4 3844 B14R1.698 N[C@@H](CC(O)=O)Cc1ccc(F)cc1 Amb17678831 [0,1,0,0,0,1|1,0,1]=4 3845 B14R1.698 N[C@@H](Cc1ccc(Cl)cc1)CC(O)=O Amb22745372 [0,1,0,0,0,1|1,0,1]=4 3846 B14R1.698 N[C@@H](Cc1ccc(I)cc1)CC(O)=O Amb22746264 [0,1,0,0,0,1|1,0,1]=4 3847 B14R1.698 N[C@@H](Cc1ccc(O)cc1)CC(O)=O Amb22369425 [0,1,0,0,0,1|1,0,1]=4 3848 B14R1.698 N[C@@H](Cc1ccc(cc1)Br)CC(=O)O Amb16231755 [0,1,0,0,0,1|1,0,1]=4 3849 B14R1.698 N[C@@H](Cc1ccc(cc1)Cl)CC(=O)O Amb10603271 [0,1,0,0,0,1|1,0,1]=4 3850 B14R1.698 N[C@@H](Cc1ccc(cc1)F)CC(=O)O Amb16231675 [0,1,0,0,0,1|1,0,1]=4 3851 B14R1.698 N[C@H](Cc1ccc(cc1)C)CC(=O)O Amb16231749 [0,1,0,0,0,1|1,0,1]=4 3852 B14R1.698 O=C(C[N+](=O)[O-])Cc1ccc(cc1)F Amb1107861 [0,1,0,0,0,1|1,0,1]=4 3853 B14R1.698 O=C(Cc1ccc(cc1)Br)CC(=O)C Amb17264236 [0,1,0,0,0,1|1,0,0]=3 3854 B14R1.698 O=C(Cc1ccc(cc1)C)CC(=O)C Amb17234899 [0,1,0,0,0,1|1,0,0]=3 3855 B14R1.698 O=C(Cc1ccc(cc1)Cl)CC(=O)C Amb17240735 [0,1,0,0,0,1|1,0,0]=3 3856 B14R1.698 O=C(Cc1ccc(cc1)F)CC(=O)C Amb17235883 [0,1,0,0,0,1|1,0,0]=3 3857 B14R1.698 O=C(Nc1ccc(cc1)Br)CC(=O)O Amb2414342 [0,1,0,0,0,1|1,0,0]=3 3858 B14R1.698 O=C(Nc1ccc(cc1)C)CC(=O)C Amb1207074 [0,1,0,0,0,1|2,0,0]=4 3859 B14R1.698 O=C(Nc1ccc(cc1)C)CC(=O)O Amb1292845 [0,1,0,0,0,1|1,0,0]=3 3860 B14R1.698 O=C(Nc1ccc(cc1)Cl)CC(=O)C Amb2405275 [0,1,0,0,0,1|2,0,0]=4 3861 B14R1.698 O=C(Nc1ccc(cc1)Cl)CC(=O)O Amb2405270 [0,1,0,0,0,1|1,0,0]=3 3862 B14R1.698 O=C(Nc1ccc(cc1)F)CC(=O)C Amb1103489 [0,1,0,0,0,1|2,0,0]=4 3863 B14R1.698 O=C(Nc1ccc(cc1)F)CC(=O)O Amb2430990 [0,1,0,0,0,1|1,0,0]=3 3864 B14R1.698 O=C(Oc1ccc(cc1)Cl)CC(=O)O Amb2417335 [0,1,0,0,0,1|1,0,0]=3 3865 B14R1.698 O=C(Oc1ccc(cc1)F)CC(=O)O Amb2420475 [0,1,0,0,0,1|1,0,0]=3 3866 B14R1.698 OC(=O)CC(=O)NC=1C=CC(=O)NC1 Amb25038620 [0,1,0,0,0,1|2,0,0]=4 3867 B14R1.698 OC(=O)CC(=O)Nc1ccc(Br)c[n]1 Amb24183670 [0,1,0,0,0,1|2,0,0]=4 3868 B14R1.698 OC(=O)CC(=O)Nc1ccc(Cl)c[n]1 Amb25218832 [0,1,0,0,0,1|2,0,0]=4 3869 B14R1.698 OC(=O)CC(=O)Nc1ccc(F)[n]c1 Amb25129165 [0,1,0,0,0,1|2,0,0]=4 3870 B14R1.698 OC(=O)CC(Br)Cc1ccc(Cl)cc1 Amb18628161 [0,1,0,0,0,1|1,0,1]=4 3871 B14R1.698 OC(=O)CC(Br)Cc1ccc(F)cc1 Amb18629098 [0,1,0,0,0,1|1,0,1]=4 3872 B14R1.698 OC(=O)CC(Cl)Cc1ccc(Br)cc1 Amb18111139 [0,1,0,0,0,1|1,0,1]=4 3873 B14R1.698 OC(=O)CC(Cl)Cc1ccc(Cl)cc1 Amb18111140 [0,1,0,0,0,1|1,0,1]=4 3874 B14R1.698 OC(=O)CC(Cl)Cc1ccc(F)cc1 Amb18628471 [0,1,0,0,0,1|1,0,1]=4 3875 B14R1.698 OC(=O)CS(=O)Cc1ccc(Br)cc1 Amb22058852 [0,1,0,0,0,1|1,0,0]=3 3876 B14R1.698 OC(Cc1ccc(cc1)Br)CC(=O)O Amb17266777 [0,1,0,0,0,1|0,0,2]=4 3877 B14R1.698 OC(Cc1ccc(cc1)C)CC(=O)O Amb17235900 [0,1,0,0,0,1|0,0,2]=4 3878 B14R1.698 OC(Cc1ccc(cc1)Cl)CC(=O)O Amb17241783 [0,1,0,0,0,1|0,0,2]=4 3879 B14R1.698 OC(Cc1ccc(cc1)F)CC(=O)O Amb17236719 [0,1,0,0,0,1|0,0,2]=4 3880 B14R1.743 C=CC(=O)NC(=O)Nc1ccccc1 Amb19372540 [0,1,0,0,0,1|2,0,0]=4 3881 B14R1.743 CCC(=O)NC(=O)Cc1ccccc1 Amb10563533 [0,1,0,0,0,1|1,0,0]=3 3882 B14R1.743 CNC(=O)CC(=O)Nc1ccccc1 Amb24506382 [0,1,0,0,0,1|2,0,0]=4 3883 B14R1.743 COC(=N)NC(=O)Cc1ccccc1 Amb25686037 [0,1,0,0,0,1|1,0,0]=3 3884 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,1,0,0,0,1|1,0,1]=4 3885 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,1,0,0,0,1|1,0,1]=4 3886 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,1,0,0,0,1|1,0,1]=4 3887 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,1,0,0,0,1|1,0,1]=4 3888 B14R1.743 COC(=O)NC(=N)Nc1ccccc1 Amb25338054 [0,1,0,0,0,1|2,0,0]=4 3889 B14R1.743 COC(=O)\C=C(/Nc1ccccc1)\C Amb2386652 [0,1,0,0,0,1|2,0,0]=4 3890 B14R1.743 COC(=O)\C=C(\N)/Nc1ccccc1 Amb25843964 [0,1,0,0,0,1|2,0,0]=4 3891 B14R1.743 COC(=S)NC(=O)Nc1ccccc1 Amb24342895 [0,1,0,0,0,1|1,1,0]=4 3892 B14R1.743 CSC(=O)NC(=O)Nc1ccccc1 Amb24639071 [0,1,0,0,0,1|1,1,0]=4 3893 B14R1.743 C\C(=C/C(=O)Nc1ccccc1)\OC Amb24558304 [0,1,0,0,0,1|2,0,0]=4 3894 B14R1.743 ClCC(=O)NC(=O)Cc1ccccc1 Amb1107213 [0,1,0,0,0,1|1,0,0]=3 3895 B14R1.743 ClCC(=O)NC(=O)Nc1ccccc1 Amb2346398 [0,1,0,0,0,1|2,0,0]=4 3896 B14R1.743 NNC(=O)CC(=O)Nc1ccccc1 Amb1829756 [0,1,0,0,0,1|2,0,0]=4 3897 B14R1.743 N\C(\CC(=O)Nc1ccccc1)=N\O Amb22358076 [0,1,0,0,0,1|2,0,0]=4 3898 B14R1.743 O=C(CCl)CC(=O)Nc1ccccc1 Amb25778115 [0,1,0,0,0,1|2,0,0]=4 3899 B14R1.743 O=C(NC(=O)CF)Oc1ccccc1 Amb25054678 [0,1,0,0,0,1|2,0,0]=4 3900 B14R1.743 O=C(Nc1ccccc1)NC(=O)CF Amb22487155 [0,1,0,0,0,1|2,0,0]=4 3901 B14R1.743 OCC(=O)NC(=O)Nc1ccccc1 Amb1109851 [0,1,0,0,0,1|1,0,0]=3 3902 B14R1.743 ONC(=O)CC(=O)Nc1ccccc1 Amb24757589 [0,1,0,0,0,1|1,0,0]=3 3903 B14R1.743 O\N=C(\CC(=O)Nc1ccccc1)/N Amb1093898 [0,1,0,0,0,1|2,0,0]=4 3904 B14R1.1485 NC(=O)NS(=O)(=O)Cc1ccccc1 Amb25378911 [0,1,0,0,0,1|2,0,0]=4 3905 B14R1.1485 OC(=O)CC(Cc1ccccc1)(C)C Amb17336451 [0,1,0,0,0,1|1,0,1]=4 3906 B14R1.1485 OC(=O)CS(=O)(=O)Cc1ccccc1 Amb1928151 [0,1,0,0,0,1|1,0,0]=3 3907 B14R1.5978 CC(=O)NC(=O)Nc1cc(C)ccc1 Amb24452571 [0,1,0,0,0,1|2,0,0]=4 3908 B14R1.5978 CC(=O)NC(=O)Oc1cccc(Cl)c1 Amb24404882 [0,1,0,0,0,1|2,0,0]=4 3909 B14R1.5978 CC(C)=CC(=O)Cc1cccc(Br)c1 Amb25683858 [0,1,0,0,0,1|2,0,0]=4 3910 B14R1.5978 CC(C)=CC(=O)Cc1cccc(N)c1 Amb25754002 [0,1,0,0,0,1|2,0,0]=4 3911 B14R1.5978 CC(Cc1cccc(F)c1)CC(O)=O Amb19149363 [0,1,0,0,0,1|1,0,1]=4 3912 B14R1.5978 CC(Cc1cccc(c1)Br)CC(=O)O Amb17265519 [0,1,0,0,0,1|1,0,1]=4 3913 B14R1.5978 CC(Cc1cccc(c1)Cl)CC(=O)O Amb17241247 [0,1,0,0,0,1|1,0,1]=4 3914 B14R1.5978 CC(Cc1cccc(c1)O)CC(=O)O Amb17336809 [0,1,0,0,0,1|1,0,1]=4 3915 B14R1.5978 CN(Cc1cccc(I)c1)CC(O)=O Amb25386961 [0,1,0,0,0,1|2,0,0]=4 3916 B14R1.5978 C\C(=C/C(=O)O)\Cc1cccc(c1)Br Amb17264234 [0,1,0,0,0,1|1,0,0]=3 3917 B14R1.5978 C\C(=C/C(=O)O)\Cc1cccc(c1)C Amb17234897 [0,1,0,0,0,1|1,0,0]=3 3918 B14R1.5978 C\C(=C/C(=O)O)\Cc1cccc(c1)Cl Amb17240733 [0,1,0,0,0,1|1,0,0]=3 3919 B14R1.5978 C\C(\Cc1cccc(Br)c1)=C\C(O)=O Amb25338453 [0,1,0,0,0,1|1,0,0]=3 3920 B14R1.5978 C\C(\Cc1cccc(Cl)c1)=C\C(O)=O Amb25209527 [0,1,0,0,0,1|1,0,0]=3 3921 B14R1.5978 C\C(\Cc1cccc(F)c1)=C\C(C)=O Amb24638510 [0,1,0,0,0,1|2,0,0]=4 3922 B14R1.5978 Cc1c[n]cc(c1)NC(=O)CC(O)=O Amb24683420 [0,1,0,0,0,1|2,0,0]=4 3923 B14R1.5978 Cc1cc(C\C(\C)=C/C(O)=O)ccc1 Amb25227689 [0,1,0,0,0,1|1,0,0]=3 3924 B14R1.5978 Cc1cc(cc[n]1)NC(=O)CC(O)=O Amb24544540 [0,1,0,0,0,1|2,0,0]=4 3925 B14R1.5978 Cc1cc(ccc1)NC(=O)CC(N)=O Amb24443021 [0,1,0,0,0,1|2,0,0]=4 3926 B14R1.5978 Cc1cc(ccc1)S\C(\C)=C\C(O)=O Amb18656293 [0,1,0,0,0,1|2,0,0]=4 3927 B14R1.5978 NC(=O)NC(=N)Cc1cccc(Cl)c1 Amb25137298 [0,1,0,0,0,1|2,0,0]=4 3928 B14R1.5978 NC(=O)NC(=O)Cc1cccc(Br)c1 Amb24335873 [0,1,0,0,0,1|1,0,0]=3 3929 B14R1.5978 NC(=O)NC(=O)Cc1cccc(Cl)c1 Amb25089076 [0,1,0,0,0,1|1,0,0]=3 3930 B14R1.5978 NC(=O)NC(=O)Nc1cc(Cl)ccc1 Amb22462837 [0,1,0,0,0,1|2,0,0]=4 3931 B14R1.5978 NC(=O)NC(=O)Nc1cc(F)ccc1 Amb22462831 [0,1,0,0,0,1|2,0,0]=4 3932 B14R1.5978 NC(=O)NC(=O)Oc1cccc(Cl)c1 Amb22468839 [0,1,0,0,0,1|2,0,0]=4 3933 B14R1.5978 NC(=S)NC(=O)Cc1cccc(O)c1 Amb25324564 [0,1,0,0,0,1|1,1,0]=4 3934 B14R1.5978 NC(Cc1cc(O)ccc1)CC(O)=O Amb18814152 [0,1,0,0,0,1|1,0,1]=4 3935 B14R1.5978 NC(Cc1cccc(c1)Br)CC(=O)O Amb17473593 [0,1,0,0,0,1|1,0,1]=4 3936 B14R1.5978 NC(Cc1cccc(c1)C)CC(=O)O Amb17470844 [0,1,0,0,0,1|1,0,1]=4 3937 B14R1.5978 NC(Cc1cccc(c1)Cl)CC(=O)O Amb17471482 [0,1,0,0,0,1|1,0,1]=4 3938 B14R1.5978 NC(Cc1cccc(c1)F)CC(=O)O Amb17470961 [0,1,0,0,0,1|1,0,1]=4 3939 B14R1.5978 N[C@@H](Cc1cccc(Br)c1)CC(O)=O Amb22757443 [0,1,0,0,0,1|1,0,1]=4 3940 B14R1.5978 N[C@@H](Cc1cccc(Cl)c1)CC(O)=O Amb22747011 [0,1,0,0,0,1|1,0,1]=4 3941 B14R1.5978 N[C@@H](Cc1cccc(c1)Cl)CC(=O)O Amb16231757 [0,1,0,0,0,1|1,0,1]=4 3942 B14R1.5978 N[C@@H](Cc1cccc(c1)F)CC(=O)O Amb16231652 [0,1,0,0,0,1|1,0,1]=4 3943 B14R1.5978 N[C@H](Cc1cccc(c1)C)CC(=O)O Amb16231754 [0,1,0,0,0,1|1,0,1]=4 3944 B14R1.5978 O=C(Cc1cccc(c1)Br)CC(=O)C Amb17264233 [0,1,0,0,0,1|1,0,0]=3 3945 B14R1.5978 O=C(Cc1cccc(c1)C)CC(=O)C Amb17234896 [0,1,0,0,0,1|1,0,0]=3 3946 B14R1.5978 O=C(Cc1cccc(c1)Cl)CC(=O)C Amb17240732 [0,1,0,0,0,1|1,0,0]=3 3947 B14R1.5978 O=C(Nc1cccc(c1)Br)CC(=O)O Amb17415231 [0,1,0,0,0,1|1,0,0]=3 3948 B14R1.5978 O=C(Nc1cccc(c1)C)CC(=O)C Amb1206870 [0,1,0,0,0,1|2,0,0]=4 3949 B14R1.5978 O=C(Nc1cccc(c1)C)CC(=O)O Amb10607902 [0,1,0,0,0,1|1,0,0]=3 3950 B14R1.5978 O=C(Nc1cccc(c1)Cl)CC(=O)C Amb1035894 [0,1,0,0,0,1|2,0,0]=4 3951 B14R1.5978 O=C(Nc1cccc(c1)Cl)CC(=O)O Amb2433924 [0,1,0,0,0,1|1,0,0]=3 3952 B14R1.5978 O=C(Nc1cccc(c1)F)CC(=O)C Amb2430911 [0,1,0,0,0,1|2,0,0]=4 3953 B14R1.5978 O=C(Nc1cccc(c1)F)CC(=O)O Amb17402173 [0,1,0,0,0,1|1,0,0]=3 3954 B14R1.5978 OC(=O)CC(=O)Nc1cc(Br)cc[n]1 Amb25172637 [0,1,0,0,0,1|2,0,0]=4 3955 B14R1.5978 OC(=O)CC(=O)Nc1cc(O)ccc1 Amb18987445 [0,1,0,0,0,1|1,0,0]=3 3956 B14R1.5978 OC(=O)CC(=O)Nc1cc[n]c(Cl)c1 Amb25668457 [0,1,0,0,0,1|2,0,0]=4 3957 B14R1.5978 OC(=O)CC(=O)Nc1cccc(I)c1 Amb24526027 [0,1,0,0,0,1|1,0,0]=3 3958 B14R1.5978 OC(Cc1cccc(c1)Br)CC(=O)O Amb17266776 [0,1,0,0,0,1|0,0,2]=4 3959 B14R1.5978 OC(Cc1cccc(c1)C)CC(=O)O Amb17235899 [0,1,0,0,0,1|0,0,2]=4 3960 B14R1.5978 OC(Cc1cccc(c1)Cl)CC(=O)O Amb17241782 [0,1,0,0,0,1|0,0,2]=4 3961 B14R1.161 C=C(CNc1ccccc1Br)C(O)=O Amb25714922 [0,1,0,0,0,1|1,0,0]=3 3962 B14R1.161 C=C(CNc1ccccc1Cl)C(O)=O Amb25169854 [0,1,0,0,0,1|1,0,0]=3 3963 B14R1.161 CC(=NNc1ccccc1F)C(O)=O Amb22486334 [0,1,0,0,0,1|2,0,0]=4 3964 B14R1.161 CC(CNc1ccccc1N)C(O)=O Amb18651898 [0,1,0,0,0,1|1,0,1]=4 3965 B14R1.161 C\C(=C\CN1C=CC=CC1=O)\C(O)=O Amb24336059 [0,1,0,0,0,1|2,0,0]=4 3966 B14R1.161 C\C(=N\Nc1ccccc1Cl)\C(O)=O Amb22481002 [0,1,0,0,0,1|2,0,0]=4 3967 B14R1.161 Cc1cc[n]cc1CNC(=O)C(O)=O Amb25849714 [0,1,0,0,0,1|1,0,0]=3 3968 B14R1.161 Cc1ccc[n]c1CNC(=O)C(O)=O Amb24465506 [0,1,0,0,0,1|1,0,0]=3 3969 B14R1.161 Cc1ccccc1NCC(N)C(O)=O Amb24345651 [0,1,0,0,0,1|1,0,1]=4 3970 B14R1.161 NC(=O)C(=O)NCc1ccccc1O Amb21953014 [0,1,0,0,0,1|1,0,0]=3 3971 B14R1.161 NC(CNc1ccccc1Br)C(O)=O Amb25204064 [0,1,0,0,0,1|1,0,1]=4 3972 B14R1.161 NC(CNc1ccccc1Cl)C(O)=O Amb25169853 [0,1,0,0,0,1|1,0,1]=4 3973 B14R1.161 NC(CNc1ccccc1F)C(O)=O Amb24454221 [0,1,0,0,0,1|1,0,1]=4 3974 B14R1.161 Nc1ccccc1NCC(N)C(O)=O Amb24563418 [0,1,0,0,0,1|1,0,1]=4 3975 B14R1.161 Nc1ccccc1SCC(N)C(O)=O Amb22466326 [0,1,0,0,0,1|1,0,1]=4 3976 B14R1.161 OC(=O)C(=O)NCc1ccccc1Br Amb25800289 [0,1,0,0,0,1|0,0,0]=2 3977 B14R1.161 OC(=O)C(=O)NCc1ccccc1C Amb17048336 [0,1,0,0,0,1|0,0,0]=2 3978 B14R1.161 OC(=O)C(=O)NCc1ccccc1O Amb24498211 [0,1,0,0,0,1|0,0,0]=2 3979 B14R1.161 OC(=O)C(=O)NNc1cc[n]cc1Cl Amb25814178 [0,1,0,0,0,1|2,0,0]=4 3980 B14R1.161 OC(=O)C(=O)NNc1ccc[n]c1Cl Amb24632460 [0,1,0,0,0,1|2,0,0]=4 3981 B14R1.161 OC(=O)C(=O)\C=C/c1ccccc1O Amb25068429 [0,1,0,0,0,1|0,0,1]=3 3982 B14R1.161 OC(=O)C(=O)\C=C\c1ccccc1Br Amb17473510 [0,1,0,0,0,1|0,0,1]=3 3983 B14R1.161 OC(=O)C(=O)\C=C\c1ccccc1C Amb17470738 [0,1,0,0,0,1|0,0,1]=3 3984 B14R1.161 OC(=O)C(=O)\C=C\c1ccccc1Cl Amb17471417 [0,1,0,0,0,1|0,0,1]=3 3985 B14R1.161 OC(=O)C(=O)\C=C\c1ccccc1F Amb17470866 [0,1,0,0,0,1|0,0,1]=3 3986 B14R1.161 OC(=O)C(=O)\C=C\c1ccccc1O Amb17508618 [0,1,0,0,0,1|0,0,1]=3 3987 B14R1.161 OC(=O)C(CCc1ccccc1Br)N Amb17473600 [0,1,0,0,0,1|1,0,1]=4 3988 B14R1.161 OC(=O)C(CCc1ccccc1C)C Amb17235378 [0,1,0,0,0,1|1,0,1]=4 3989 B14R1.161 OC(=O)C(CCc1ccccc1C)N Amb17470839 [0,1,0,0,0,1|1,0,1]=4 3990 B14R1.161 OC(=O)C(CCc1ccccc1Cl)C Amb17241241 [0,1,0,0,0,1|1,0,1]=4 3991 B14R1.161 OC(=O)C(CCc1ccccc1Cl)N Amb17471477 [0,1,0,0,0,1|1,0,1]=4 3992 B14R1.161 OC(=O)C(CCc1ccccc1F)C Amb17236370 [0,1,0,0,0,1|1,0,1]=4 3993 B14R1.161 OC(=O)C(CCc1ccccc1F)N Amb17470953 [0,1,0,0,0,1|1,0,1]=4 3994 B14R1.161 OC(=O)C(NCc1ccccc1Cl)C Amb10199865 [0,1,0,0,0,1|1,0,1]=4 3995 B14R1.161 OC(=O)C(NCc1ccccc1Cl)C Amb1110092 [0,1,0,0,0,1|1,0,1]=4 3996 B14R1.161 OC(=O)C(O)CNc1ccccc1Br Amb24658872 [0,1,0,0,0,1|0,0,2]=4 3997 B14R1.161 OC(=O)C(O)CNc1ccccc1F Amb25819492 [0,1,0,0,0,1|0,0,2]=4 3998 B14R1.161 OC(=O)\C(=N\Nc1ccccc1C)\C Amb17595037 [0,1,0,0,0,1|2,0,0]=4 3999 B14R1.415 C=C(NC(=O)c1ccccc1)C(O)=O Amb18650727 [0,1,0,0,0,1|1,0,1]=4 4000 B14R1.415 CC(=C)C(=O)NC(C)c1ccccc1 Amb17934132 [0,1,0,0,0,1|2,0,0]=4 4001 B14R1.415 CC(=C)C(=O)N[C@@H](C)c1ccccc1 Amb17934133 [0,1,0,0,0,1|2,0,0]=4 4002 B14R1.415 CC(=C)C(=O)N[C@H](C)c1ccccc1 Amb25800393 [0,1,0,0,0,1|2,0,0]=4 4003 B14R1.415 CC(=O)C(=O)N[C@@H](C)c1ccccc1 Amb24452606 [0,1,0,0,0,1|1,0,0]=3 4004 B14R1.415 CC(=O)C(=O)N[C@H](C)c1ccccc1 Amb25371972 [0,1,0,0,0,1|1,0,0]=3 4005 B14R1.415 CC(C(=O)O)CN(c1ccccc1)C Amb17336619 [0,1,0,0,0,1|1,0,1]=4 4006 B14R1.415 CC(C[C@@H](N)C(O)=O)c1ccccc1 Amb17933184 [0,1,0,0,0,1|1,0,1]=4 4007 B14R1.415 CC(NC(=O)C(N)=S)c1ccccc1 Amb24462775 [0,1,0,0,0,1|1,1,0]=4 4008 B14R1.415 CC(NC(=O)C(O)=O)c1cc[n]cc1 Amb18981241 [0,1,0,0,0,1|1,0,0]=3 4009 B14R1.415 CC(NC(C)c1ccccc1)C(O)=O Amb24271459 [0,1,0,0,0,1|1,0,1]=4 4010 B14R1.415 CC(\C=C(/Cl)\C(O)=O)c1ccccc1 Amb25827178 [0,1,0,0,0,1|1,0,0]=3 4011 B14R1.415 CC(\C=C(\Cl)/C(O)=O)c1ccccc1 Amb24630828 [0,1,0,0,0,1|1,0,0]=3 4012 B14R1.415 CC(c1ccccc1)NC(=O)C(=O)C Amb17401498 [0,1,0,0,0,1|1,0,0]=3 4013 B14R1.415 CC(c1ccccc1)NC(=O)C(O)C Amb17401756 [0,1,0,0,0,1|1,0,1]=4 4014 B14R1.415 CC(c1ccccc1)SC(C(=O)O)C Amb17501620 [0,1,0,0,0,1|1,0,1]=4 4015 B14R1.415 CN(CC(N)C(O)=O)c1ccccc1 Amb19079990 [0,1,0,0,0,1|1,0,1]=4 4016 B14R1.415 C[C@@H](NC(=O)C(O)=O)c1c[n]ccc1 Amb25106747 [0,1,0,0,0,1|1,0,0]=3 4017 B14R1.415 C[C@@H](NC(=O)C(O)=O)c1ccccc1 Amb25765711 [0,1,0,0,0,1|0,0,0]=2 4018 B14R1.415 C[C@@H](NC(=O)[C@H](C)O)c1ccccc1 Amb25123885 [0,1,0,0,0,1|1,0,1]=4 4019 B14R1.415 C[C@H](NC(=O)C(=C)Cl)c1ccccc1 Amb25213704 [0,1,0,0,0,1|2,0,0]=4 4020 B14R1.415 C[C@H](NC(=O)C(O)=O)c1c[n]ccc1 Amb24676120 [0,1,0,0,0,1|1,0,0]=3 4021 B14R1.415 C[C@H](NC(=O)C(O)=O)c1cccc[n]1 Amb25099261 [0,1,0,0,0,1|1,0,0]=3 4022 B14R1.415 C[C@H](NC(=O)C(O)=O)c1ccccc1 Amb25200975 [0,1,0,0,0,1|0,0,0]=2 4023 B14R1.415 C[C@H](NC(=O)[C@@H](C)O)c1ccccc1 Amb25119221 [0,1,0,0,0,1|1,0,1]=4 4024 B14R1.415 C[C@H](NC(=O)[C@H](C)O)c1ccccc1 Amb25186077 [0,1,0,0,0,1|1,0,1]=4 4025 B14R1.415 C\C(=C/C(=O)c1ccccc1)\C(O)=O Amb18650379 [0,1,0,0,0,1|1,0,1]=4 4026 B14R1.415 C\C(=C/C(C)c1ccccc1)\C(O)=O Amb24652552 [0,1,0,0,0,1|1,0,0]=3 4027 B14R1.415 C\C(=C/C(O)c1ccccc1)\C(O)=O Amb25321964 [0,1,0,0,0,1|1,0,0]=3 4028 B14R1.415 C\C(=C\C(=O)C(O)=O)\c1ccccc1 Amb24617870 [0,1,0,0,0,1|0,0,1]=3 4029 B14R1.415 C\C(=N/N(C)c1ccccc1)\C(O)=O Amb22524400 [0,1,0,0,0,1|2,0,0]=4 4030 B14R1.415 C\C(=N\C(C)c1ccccc1)\C(N)=O Amb25814779 [0,1,0,0,0,1|2,0,0]=4 4031 B14R1.415 NC(=O)C(=O)\C=C(\N)/c1ccccc1 Amb24467921 [0,1,0,0,0,1|1,0,1]=4 4032 B14R1.415 NC(C(=O)O)CC(=O)c1ccccc1 Amb17470829 [0,1,0,0,0,1|1,0,1]=4 4033 B14R1.415 N[C@@H](CC(=O)c1ccccc1)C(O)=O Amb23403688 [0,1,0,0,0,1|1,0,1]=4 4034 B14R1.415 O=C(NC(=O)c1ccccc1)C(=O)Cl Amb25207659 [0,1,0,0,0,1|1,0,1]=4 4035 B14R1.415 O=C(c1ccccc1)CC(=C)C(=O)O Amb17594937 [0,1,0,0,0,1|1,0,0]=3 4036 B14R1.415 O=C(c1ccccc1)CC(=O)C(=O)O Amb1102273 [0,1,0,0,0,1|0,0,0]=2 4037 B14R1.415 O=C(c1ccccc1)\C=C(\C(=O)O)/O Amb1980824 [0,1,0,0,0,1|0,0,2]=4 4038 B14R1.415 O=C(c1ccncc1)CC(=O)C(=O)O Amb10070115 [0,1,0,0,0,1|1,0,0]=3 4039 B14R1.415 OC(=O)C(=O)CC(=O)c1cccnc1 Amb10070116 [0,1,0,0,0,1|1,0,0]=3 4040 B14R1.415 OC(=O)C(O)CC(=O)c1ccccc1 Amb18651699 [0,1,0,0,0,1|0,0,2]=4 4041 B14R1.415 O[C@H](C(=O)O)CC(=O)c1ccccc1 Amb17615662 [0,1,0,0,0,1|0,0,2]=4 4042 B14R1.679 C=C(CNc1ccc(I)cc1)C(O)=O Amb24405269 [0,1,0,0,0,1|1,0,0]=3 4043 B14R1.679 C=C(CSc1ccc(Cl)cc1)C(O)=O Amb22479405 [0,1,0,0,0,1|1,0,0]=3 4044 B14R1.679 C=C(CSc1ccc(Cl)cc1)C([O-])=O Amb22470153 [0,1,0,0,0,1|1,0,1]=4 4045 B14R1.679 C=C(Cl)C(=O)NCc1ccc(O)cc1 Amb24630235 [0,1,0,0,0,1|2,0,0]=4 4046 B14R1.679 CC(=C)C(=O)NCc1ccc(Cl)cc1 Amb24393409 [0,1,0,0,0,1|2,0,0]=4 4047 B14R1.679 CC(=C=Cc1ccc(Cl)cc1)C(O)=O Amb25733543 [0,1,0,0,0,1|1,0,1]=4 4048 B14R1.679 CC(=C=Cc1ccc(F)cc1)C(O)=O Amb25363359 [0,1,0,0,0,1|1,0,1]=4 4049 B14R1.679 CC(=NNc1ccc(Cl)cc1)C(O)=O Amb24080695 [0,1,0,0,0,1|2,0,0]=4 4050 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)Br Amb17265518 [0,1,0,0,0,1|1,0,1]=4 4051 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)C Amb17235380 [0,1,0,0,0,1|1,0,1]=4 4052 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)Cl Amb17241243 [0,1,0,0,0,1|1,0,1]=4 4053 B14R1.679 CC(C(=O)O)CCc1ccc(cc1)F Amb17236371 [0,1,0,0,0,1|1,0,1]=4 4054 B14R1.679 CC(C(=O)O)NCc1ccc(cc1)F Amb1110539 [0,1,0,0,0,1|1,0,1]=4 4055 B14R1.679 CC(C(=O)O)SCc1ccc(cc1)Cl Amb2101263 [0,1,0,0,0,1|1,0,1]=4 4056 B14R1.679 CC(C(=O)O)SCc1ccc(cc1)N Amb17497539 [0,1,0,0,0,1|1,0,1]=4 4057 B14R1.679 CC(CNc1ccc(O)cc1)C(O)=O Amb24498328 [0,1,0,0,0,1|1,0,1]=4 4058 B14R1.679 C\C(=C/Sc1ccc(F)cc1)\C(O)=O Amb25290153 [0,1,0,0,0,1|1,0,1]=4 4059 B14R1.679 C\C(=C\CN1C=CC(=O)C=C1)\C(O)=O Amb24336323 [0,1,0,0,0,1|2,0,0]=4 4060 B14R1.679 C\C(=C\Sc1ccc(F)cc1)\C(O)=O Amb25224387 [0,1,0,0,0,1|1,0,1]=4 4061 B14R1.679 C\C(=N/Nc1ccc(Cl)cc1)\C(O)=O Amb24444831 [0,1,0,0,0,1|2,0,0]=4 4062 B14R1.679 C\C(=N\Nc1ccc(O)cc1)\C(O)=O Amb24358016 [0,1,0,0,0,1|2,0,0]=4 4063 B14R1.679 Cc1c[n]c(CNC(=O)C(O)=O)c[n]1 Amb18998674 [0,1,0,0,0,1|2,0,0]=4 4064 B14R1.679 Cc1c[n]c(CNC(=O)C(O)=O)cc1 Amb24539127 [0,1,0,0,0,1|1,0,0]=3 4065 B14R1.679 Cc1ccc(CNC(=O)C(=C)Cl)cc1 Amb24630628 [0,1,0,0,0,1|2,0,0]=4 4066 B14R1.679 Cc1ccc(CNC(=O)C(O)=O)c[n]1 Amb19001247 [0,1,0,0,0,1|1,0,0]=3 4067 B14R1.679 Cc1ccc(COC(=O)C(C)=C)cc1 Amb24063687 [0,1,0,0,0,1|2,0,0]=4 4068 B14R1.679 Cc1ccc(\C=C\C(=O)C(O)=O)c[n]1 Amb25754433 [0,1,0,0,0,1|1,0,1]=4 4069 B14R1.679 Cc1ccc(cc1)CNC(=O)C(=O)C Amb17401497 [0,1,0,0,0,1|1,0,0]=3 4070 B14R1.679 Cc1ccc(cc1)NCC(O)C(O)=O Amb25102280 [0,1,0,0,0,1|0,0,2]=4 4071 B14R1.679 Cc1ccc(cc1)NNC(=O)C(O)=O Amb18651754 [0,1,0,0,0,1|1,0,0]=3 4072 B14R1.679 Cc1ccc(cc1)N\N=C(\Cl)/C(O)=O Amb24444372 [0,1,0,0,0,1|2,0,0]=4 4073 B14R1.679 Cc1ccc(cc1)O\C=C(/C)\C(O)=O Amb24745182 [0,1,0,0,0,1|1,0,1]=4 4074 B14R1.679 Cc1ccc(cc1)O\C=C(\C)/C(O)=O Amb24693847 [0,1,0,0,0,1|1,0,1]=4 4075 B14R1.679 Cc1ccc(cc1)SCC(=C)C(O)=O Amb18656286 [0,1,0,0,0,1|1,0,0]=3 4076 B14R1.679 Cc1ccc(cc1)SCC(O)C(O)=O Amb22466689 [0,1,0,0,0,1|0,0,2]=4 4077 B14R1.679 Cc1ccc(cc1)SC[C@H](N)C(O)=O Amb22351164 [0,1,0,0,0,1|1,0,1]=4 4078 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)Br Amb17473596 [0,1,0,0,0,1|1,0,1]=4 4079 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)C Amb17470847 [0,1,0,0,0,1|1,0,1]=4 4080 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)Cl Amb17471485 [0,1,0,0,0,1|1,0,1]=4 4081 B14R1.679 NC(C(=O)O)CCc1ccc(cc1)F Amb17470957 [0,1,0,0,0,1|1,0,1]=4 4082 B14R1.679 NC(CCc1ccc(O)cc1)C(O)=O Amb24087709 [0,1,0,0,0,1|1,0,1]=4 4083 B14R1.679 N[C@@H](CSc1ccc(Cl)cc1)C(O)=O Amb22466318 [0,1,0,0,0,1|1,0,1]=4 4084 B14R1.679 N[C@@H](CSc1ccc(F)cc1)C(O)=O Amb22351165 [0,1,0,0,0,1|1,0,1]=4 4085 B14R1.679 N[C@H](CCc1ccc(O)cc1)C(O)=O Amb24099406 [0,1,0,0,0,1|1,0,1]=4 4086 B14R1.679 N[C@H](CSc1ccc(Cl)cc1)C(O)=O Amb22472009 [0,1,0,0,0,1|1,0,1]=4 4087 B14R1.679 Nc1ccc(CCC(O)C(O)=O)cc1 Amb22473017 [0,1,0,0,0,1|0,0,2]=4 4088 B14R1.679 O=C(C(=O)O)NCc1ccc(cc1)Br Amb17415233 [0,1,0,0,0,1|0,0,0]=2 4089 B14R1.679 O=C(C(=O)O)\C=C\c1ccc(cc1)Br Amb17473509 [0,1,0,0,0,1|0,0,1]=3 4090 B14R1.679 O=C(C(=O)O)\C=C\c1ccc(cc1)C Amb17470740 [0,1,0,0,0,1|0,0,1]=3 4091 B14R1.679 O=C(C(=O)O)\C=C\c1ccc(cc1)Cl Amb2444591 [0,1,0,0,0,1|0,0,1]=3 4092 B14R1.679 O=C(C(=O)O)\C=C\c1ccc(cc1)F Amb17470867 [0,1,0,0,0,1|0,0,1]=3 4093 B14R1.679 O=C(C(O)C)NCc1ccc(cc1)C Amb17401755 [0,1,0,0,0,1|1,0,1]=4 4094 B14R1.679 OC(=O)C(=O)NCc1ccc(Cl)[n]c1 Amb25038488 [0,1,0,0,0,1|1,0,0]=3 4095 B14R1.679 OC(=O)C(=O)NCc1ccc(Cl)c[n]1 Amb24387521 [0,1,0,0,0,1|1,0,0]=3 4096 B14R1.679 OC(=O)C(=O)\C=C\c1ccc(Br)c[n]1 Amb25133186 [0,1,0,0,0,1|1,0,1]=4 4097 B14R1.679 OC(=O)C(=O)\C=C\c1ccc(I)cc1 Amb24648526 [0,1,0,0,0,1|0,0,1]=3 4098 B14R1.679 OC(=O)C(=O)\C=C\c1ccc(O)cc1 Amb24730165 [0,1,0,0,0,1|0,0,1]=3 4099 B14R1.679 OC(=O)C(CCc1ccc(cc1)O)C Amb17336808 [0,1,0,0,0,1|1,0,1]=4 4100 B14R1.679 OC(=O)C(O)CNc1ccc(Br)cc1 Amb24555880 [0,1,0,0,0,1|0,0,2]=4 4101 B14R1.679 OC(=O)C(O)CNc1ccc(F)cc1 Amb24700585 [0,1,0,0,0,1|0,0,2]=4 4102 B14R1.679 OC(=O)\C(\Cl)=N\Nc1ccc(Cl)cc1 Amb25191169 [0,1,0,0,0,1|2,0,0]=4 4103 B14R1.679 OC(=O)\C(\F)=C\Sc1ccc(F)cc1 Amb24418385 [0,1,0,0,0,1|1,0,1]=4 4104 B14R1.679 Oc1ccc(CCC(O)C(O)=O)cc1 Amb19928328 [0,1,0,0,0,1|0,0,2]=4 4105 B14R1.679 [O-]C(=O)C(=O)\C=C\c1ccc(Cl)cc1 Amb22434319 [0,1,0,0,0,1|0,0,2]=4 4106 B14R1.756 C=C(CO)C(=O)OCc1ccccc1 Amb20671610 [0,1,0,0,0,1|1,0,0]=3 4107 B14R1.756 CC(=C=C)C(=O)NCc1ccccc1 Amb25668110 [0,1,0,0,0,1|2,0,0]=4 4108 B14R1.756 CC(=CC)C(=O)NCc1ccccc1 Amb22433198 [0,1,0,0,0,1|2,0,0]=4 4109 B14R1.756 CC(CO)C(=O)NCc1ccccc1 Amb25709712 [0,1,0,0,0,1|1,0,1]=4 4110 B14R1.756 CC(CO)C(=O)OCc1ccccc1 Amb25235213 [0,1,0,0,0,1|1,0,1]=4 4111 B14R1.756 CCC(=C)C(=O)OCc1ccccc1 Amb22347956 [0,1,0,0,0,1|2,0,0]=4 4112 B14R1.756 CCN(O)C(=O)OCc1ccccc1 Amb25259905 [0,1,0,0,0,1|2,0,0]=4 4113 B14R1.756 CC[C@H](O)C(=O)OCc1ccccc1 Amb25087788 [0,1,0,0,0,1|1,0,1]=4 4114 B14R1.756 CN(OC)C(=O)NCc1ccccc1 Amb25832209 [0,1,0,0,0,1|2,0,0]=4 4115 B14R1.756 CNC(=O)C(=O)CCc1c[n]ccc1 Amb22734372 [0,1,0,0,0,1|2,0,0]=4 4116 B14R1.756 CNC(=O)C(=O)NCc1ccccc1 Amb2422863 [0,1,0,0,0,1|1,0,0]=3 4117 B14R1.756 CNC(=O)C(=O)NNc1ccccc1 Amb24574715 [0,1,0,0,0,1|2,0,0]=4 4118 B14R1.756 COC(=O)C(=O)CCc1ccccc1 Amb10069228 [0,1,0,0,0,1|0,0,0]=2 4119 B14R1.756 COC(=O)C(=O)NCc1ccccc1 Amb24444903 [0,1,0,0,0,1|0,0,0]=2 4120 B14R1.756 COC(=O)C(Br)CCc1ccccc1 Amb22500039 [0,1,0,0,0,1|1,0,1]=4 4121 B14R1.756 COC(=O)C(C)CCc1ccccc1 Amb17844109 [0,1,0,0,0,1|1,0,1]=4 4122 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb20625132 [0,1,0,0,0,1|1,0,1]=4 4123 B14R1.756 COC(=O)C(C)NCc1ccccc1 Amb22741033 [0,1,0,0,0,1|1,0,1]=4 4124 B14R1.756 COC(=O)C(N)CCc1ccccc1 Amb23439021 [0,1,0,0,0,1|1,0,1]=4 4125 B14R1.756 COC(=O)[C@@H](C)NCc1ccccc1 Amb22746683 [0,1,0,0,0,1|1,0,1]=4 4126 B14R1.756 COC(=O)[C@@H](N)CCc1ccccc1 Amb23439002 [0,1,0,0,0,1|1,0,1]=4 4127 B14R1.756 COC(=O)[C@H](C)OCc1ccccc1 Amb25833053 [0,1,0,0,0,1|1,0,1]=4 4128 B14R1.756 COC(=O)[C@H](NCc1ccccc1)C Amb16183003 [0,1,0,0,0,1|1,0,1]=4 4129 B14R1.756 COC(=O)[C@H](OCc1ccccc1)C Amb17617220 [0,1,0,0,0,1|1,0,1]=4 4130 B14R1.756 COC(=O)\C(\Cl)=N\Nc1ccccc1 Amb24277024 [0,1,0,0,0,1|2,0,0]=4 4131 B14R1.756 COC(O)C(=O)OCc1ccccc1 Amb25813767 [0,1,0,0,0,1|0,0,2]=4 4132 B14R1.756 CON(C)C(=O)COc1ccccc1 Amb20673753 [0,1,0,0,0,1|2,0,0]=4 4133 B14R1.756 CON(C)C(=O)OCc1ccccc1 Amb23597418 [0,1,0,0,0,1|2,0,0]=4 4134 B14R1.756 CSC(=C)C(=O)NCc1ccccc1 Amb25378900 [0,1,0,0,0,1|1,1,0]=4 4135 B14R1.756 C[C@@H](CO)C(=O)OCc1ccccc1 Amb25071680 [0,1,0,0,0,1|1,0,1]=4 4136 B14R1.756 C\C(=C/C)\C(=O)NCc1ccccc1 Amb25103689 [0,1,0,0,0,1|2,0,0]=4 4137 B14R1.756 C\C(=N\Nc1ccccc1)\C(=O)OC Amb22551092 [0,1,0,0,0,1|2,0,0]=4 4138 B14R1.756 C\C(\CO)=C(\C)/CNc1ccccc1 Amb24695428 [0,1,0,0,0,1|2,0,0]=4 4139 B14R1.756 C\C=C(\N)/C(=O)OCc1ccccc1 Amb25252170 [0,1,0,0,0,1|2,0,0]=4 4140 B14R1.756 NCC(O)C(=O)OCc1ccccc1 Amb22059738 [0,1,0,0,0,1|1,0,1]=4 4141 B14R1.756 NC[C@H](O)C(=O)OCc1ccccc1 Amb25279330 [0,1,0,0,0,1|1,0,1]=4 4142 B14R1.756 N[C@H](CO)C(=O)OCc1ccccc1 Amb22230607 [0,1,0,0,0,1|1,0,1]=4 4143 B14R1.756 N[C@H](CO)C(=O)OCc1ccccc1 Amb22337068 [0,1,0,0,0,1|1,0,1]=4 4144 B14R1.756 O=C(CBr)C(=O)NCc1ccccc1 Amb24468687 [0,1,0,0,0,1|1,0,0]=3 4145 B14R1.756 O=C(CCl)C(=O)NCc1ccccc1 Amb25828359 [0,1,0,0,0,1|1,0,0]=3 4146 B14R1.756 O=C(OCc1ccccc1)C(Cl)C=O Amb25664769 [0,1,0,0,0,1|1,0,1]=4 4147 B14R1.756 OCC(=O)N(CCc1ccccc1)C Amb17401768 [0,1,0,0,0,1|2,0,0]=4 4148 B14R1.756 OCC(O)C(=O)OCc1ccccc1 Amb22899015 [0,1,0,0,0,1|0,0,2]=4 4149 B14R1.756 OC[C@@H](C(=O)OCc1ccccc1)N Amb16231701 [0,1,0,0,0,1|1,0,1]=4 4150 B14R1.756 OC[C@@H](C(=O)OCc1ccccc1)N Amb17609326 [0,1,0,0,0,1|1,0,1]=4 4151 B14R1.756 OC[C@@H](O)C(=O)NCc1ccccc1 Amb25766512 [0,1,0,0,0,1|0,0,2]=4 4152 B14R1.756 OC[C@H](O)C(=O)NCc1ccccc1 Amb25725928 [0,1,0,0,0,1|0,0,2]=4 4153 B14R1.756 O\C=C(\Cl)/C(=O)NCc1ccccc1 Amb25695515 [0,1,0,0,0,1|1,0,0]=3 4154 B14R1.756 O\N=C(/Cl)\C(=O)OCc1ccccc1 Amb22360357 [0,1,0,0,0,1|1,0,0]=3 4155 B14R1.756 O\N=C(\C(=O)NCc1ccccc1)/C Amb1951251 [0,1,0,0,0,1|1,0,0]=3 4156 B14R1.756 O\N=C(\C(=O)NCc1ccccn1)/C Amb1933249 [0,1,0,0,0,1|2,0,0]=4 4157 B14R1.756 O\N=C(\C(=O)NCc1cccnc1)/C Amb1782218 [0,1,0,0,0,1|2,0,0]=4 4158 B14R1.756 O\N=C(\C(=O)NCc1ccncc1)/C Amb1933246 [0,1,0,0,0,1|2,0,0]=4 4159 B14R1.3099 C=C(CCc1ccccc1)S(O)(=O)=O Amb22364616 [0,1,0,0,0,1|2,0,0]=4 4160 B14R1.3099 CC(C)(O)C(=O)NCc1ccccc1 Amb25183473 [0,1,0,0,0,1|1,0,1]=4 4161 B14R1.3099 CC(C)(O)C(=O)OCc1ccccc1 Amb22497203 [0,1,0,0,0,1|1,0,1]=4 4162 B14R1.3099 N=C(NCc1ccccc1)S(O)(=O)=O Amb24471288 [0,1,0,0,0,1|2,0,0]=4 4163 B14R1.3099 OP(O)(=O)C(=O)NCc1ccccc1 Amb25817803 [0,1,0,0,0,1|1,0,0]=3 4164 B14R1.4194 C=CC(OCc1ccccc1)C(O)=O Amb24507538 [0,1,0,0,0,1|1,0,1]=4 4165 B14R1.4194 CC(=O)\C(=C/C)\NCc1ccccc1 Amb24498103 [0,1,0,0,0,1|2,0,0]=4 4166 B14R1.4194 CC(=O)\C(=C/Nc1ccccc1)\C=O Amb24440185 [0,1,0,0,0,1|1,0,1]=4 4167 B14R1.4194 CC(=O)\C(=C\Nc1ccccc1)\C=O Amb18650142 [0,1,0,0,0,1|1,0,1]=4 4168 B14R1.4194 CC(=O)\C(\C=O)=N\Nc1ccccc1 Amb24728365 [0,1,0,0,0,1|2,0,0]=4 4169 B14R1.4194 CCC(=C=Cc1ccccc1)C(O)=O Amb25224768 [0,1,0,0,0,1|1,0,1]=4 4170 B14R1.4194 CCC(NCc1ccccc1)C(O)=O Amb19050997 [0,1,0,0,0,1|1,0,1]=4 4171 B14R1.4194 CNC(CCc1ccccc1)C(O)=O Amb19042064 [0,1,0,0,0,1|1,0,1]=4 4172 B14R1.4194 CO\C(=N\Nc1ccccc1)\C(O)=O Amb24498262 [0,1,0,0,0,1|1,0,1]=4 4173 B14R1.4194 N#C\C(=C/Nc1ccccc1)\C(O)=O Amb18649772 [0,1,0,0,0,1|1,0,1]=4 4174 B14R1.4194 N#C\C(=N/Nc1ccccc1)\C(O)=O Amb24365370 [0,1,0,0,0,1|2,0,0]=4 4175 B14R1.4194 NCC(OCc1ccccc1)C(O)=O Amb24507733 [0,1,0,0,0,1|1,0,1]=4 4176 B14R1.4194 OC(=O)[C@@H](CS)NCc1ccccc1 Amb25752825 [0,1,0,0,0,1|0,1,1]=4 4177 B14R1.4194 OC(=O)[C@H](CS)NCc1ccccc1 Amb24574718 [0,1,0,0,0,1|0,1,1]=4 4178 B14R1.4194 OCC(NCc1ccccc1)C(O)=O Amb17935753 [0,1,0,0,0,1|0,0,2]=4 4179 B14R1.4194 OC[C@@H](NCc1ccccc1)C(O)=O Amb17739825 [0,1,0,0,0,1|0,0,2]=4 4180 B14R1.5956 Brc1cccc(c1)CNC(=O)C(=O)O Amb17415232 [0,1,0,0,0,1|0,0,0]=2 4181 B14R1.5956 Brc1cccc(c1)\C=C\C(=O)C(=O)O Amb17473508 [0,1,0,0,0,1|0,0,1]=3 4182 B14R1.5956 C=C(CNc1cccc(Br)c1)C(O)=O Amb25849575 [0,1,0,0,0,1|1,0,0]=3 4183 B14R1.5956 C=C(CNc1cccc(Cl)c1)C(O)=O Amb25853720 [0,1,0,0,0,1|1,0,0]=3 4184 B14R1.5956 C=C(Cl)C(=O)NCc1cccc(O)c1 Amb25213715 [0,1,0,0,0,1|2,0,0]=4 4185 B14R1.5956 CC(=C=Cc1cccc(Cl)c1)C(O)=O Amb24640238 [0,1,0,0,0,1|1,0,1]=4 4186 B14R1.5956 CC(CCc1cccc(F)c1)C(O)=O Amb19337858 [0,1,0,0,0,1|1,0,1]=4 4187 B14R1.5956 CC(CNc1cc(O)ccc1)C(O)=O Amb18095613 [0,1,0,0,0,1|1,0,1]=4 4188 B14R1.5956 C\C(=N/Nc1cccc(C)c1)\C(O)=O Amb24366074 [0,1,0,0,0,1|2,0,0]=4 4189 B14R1.5956 C\C(=N/Nc1cccc(Cl)c1)\C(O)=O Amb18657380 [0,1,0,0,0,1|2,0,0]=4 4190 B14R1.5956 C\C(=N\Nc1cccc(Cl)c1)\C(O)=O Amb24603446 [0,1,0,0,0,1|2,0,0]=4 4191 B14R1.5956 Cc1[n]c(CNC(=O)C(O)=O)cc[n]1 Amb18294261 [0,1,0,0,0,1|2,0,0]=4 4192 B14R1.5956 Cc1c[n]cc(CNC(=O)C(O)=O)c1 Amb24720364 [0,1,0,0,0,1|1,0,0]=3 4193 B14R1.5956 Cc1cc(CNC(=O)C(O)=O)[n]c[n]1 Amb25802765 [0,1,0,0,0,1|2,0,0]=4 4194 B14R1.5956 Cc1cc(NNC(=O)C(O)=O)[n]cc1 Amb25334334 [0,1,0,0,0,1|2,0,0]=4 4195 B14R1.5956 Cc1cc(ccc1)NCC(=C)C(O)=O Amb25715643 [0,1,0,0,0,1|1,0,0]=3 4196 B14R1.5956 Cc1cc(ccc1)NCC(N)C(O)=O Amb24361197 [0,1,0,0,0,1|1,0,1]=4 4197 B14R1.5956 Cc1cc(ccc1)NNC(=O)C(O)=O Amb25164395 [0,1,0,0,0,1|1,0,0]=3 4198 B14R1.5956 Cc1cc(ccc1)N\N=C(\Cl)/C(O)=O Amb25770053 [0,1,0,0,0,1|2,0,0]=4 4199 B14R1.5956 Cc1cc[n]c(CNC(=O)C(O)=O)[n]1 Amb25723036 [0,1,0,0,0,1|2,0,0]=4 4200 B14R1.5956 Cc1cccc(CNC(=O)C(N)=O)[n]1 Amb21953017 [0,1,0,0,0,1|2,0,0]=4 4201 B14R1.5956 Cc1cccc(CNC(=O)C(N)=O)[n]1 Amb21953021 [0,1,0,0,0,1|2,0,0]=4 4202 B14R1.5956 Cc1cccc(CNC(=O)C(O)=O)[n]1 Amb18988174 [0,1,0,0,0,1|1,0,0]=3 4203 B14R1.5956 Cc1cccc(c1)CNC(=O)C(=O)O Amb17048337 [0,1,0,0,0,1|0,0,0]=2 4204 B14R1.5956 Cc1cccc(c1)\C=C\C(=O)C(=O)O Amb17470739 [0,1,0,0,0,1|0,0,1]=3 4205 B14R1.5956 Clc1cccc(c1)CNC(=O)C(=O)O Amb17404277 [0,1,0,0,0,1|0,0,0]=2 4206 B14R1.5956 Clc1cccc(c1)\C=C\C(=O)C(=O)O Amb17471418 [0,1,0,0,0,1|0,0,1]=3 4207 B14R1.5956 Fc1cccc(c1)\C=C\C(=O)C(=O)O Amb17470868 [0,1,0,0,0,1|0,0,1]=3 4208 B14R1.5956 OC(=O)C(=O)NCC1=CC=CC(=O)N1 Amb25077868 [0,1,0,0,0,1|1,0,0]=3 4209 B14R1.5956 OC(=O)C(=O)NCc1cccc(F)[n]1 Amb25065945 [0,1,0,0,0,1|1,0,0]=3 4210 B14R1.5956 OC(=O)C(=O)NNc1cc(Br)c[n]c1 Amb25814179 [0,1,0,0,0,1|2,0,0]=4 4211 B14R1.5956 OC(=O)C(=O)NNc1cc(F)ccc1 Amb24448587 [0,1,0,0,0,1|1,0,0]=3 4212 B14R1.5956 OC(=O)C(=O)\C=C\c1cc(O)ccc1 Amb24643279 [0,1,0,0,0,1|0,0,1]=3 4213 B14R1.5956 OC(=O)C(CCc1cccc(c1)Br)C Amb17265517 [0,1,0,0,0,1|1,0,1]=4 4214 B14R1.5956 OC(=O)C(CCc1cccc(c1)Br)N Amb17473592 [0,1,0,0,0,1|1,0,1]=4 4215 B14R1.5956 OC(=O)C(CCc1cccc(c1)C)C Amb17235379 [0,1,0,0,0,1|1,0,1]=4 4216 B14R1.5956 OC(=O)C(CCc1cccc(c1)C)N Amb17470843 [0,1,0,0,0,1|1,0,1]=4 4217 B14R1.5956 OC(=O)C(CCc1cccc(c1)Cl)C Amb17241242 [0,1,0,0,0,1|1,0,1]=4 4218 B14R1.5956 OC(=O)C(CCc1cccc(c1)Cl)N Amb17471481 [0,1,0,0,0,1|1,0,1]=4 4219 B14R1.5956 OC(=O)C(CCc1cccc(c1)F)N Amb17470960 [0,1,0,0,0,1|1,0,1]=4 4220 B14R1.5956 OC(=O)C(CCc1cccc(c1)O)C Amb17336810 [0,1,0,0,0,1|1,0,1]=4 4221 B14R1.5956 OC(=O)C(NCc1cccc(c1)Cl)C Amb1111448 [0,1,0,0,0,1|1,0,1]=4 4222 B14R1.5956 OC(=O)C(NCc1cccc(c1)F)C Amb10199860 [0,1,0,0,0,1|1,0,1]=4 4223 B14R1.5956 OC(=O)C(NCc1cccc(c1)F)C Amb1109690 [0,1,0,0,0,1|1,0,1]=4 4224 B14R1.5956 OC(=O)C(O)CNc1cccc(Cl)c1 Amb25140461 [0,1,0,0,0,1|0,0,2]=4 4225 B14R1.5956 [O-]C(=O)C(=O)C=Cc1cccc(Cl)c1 Amb22484595 [0,1,0,0,0,1|0,0,2]=4 4226 B14R1.6395 CC(C)(OCc1ccccc1)C(O)=O Amb19014785 [0,1,0,0,0,1|1,0,1]=4 4227 B14R1.6395 CC(N)(COc1ccccc1)C(O)=O Amb19042938 [0,1,0,0,0,1|1,0,1]=4 4228 B14R1.6395 C[C@@](N)(CCc1ccccc1)C(O)=O Amb22229869 [0,1,0,0,0,1|1,0,1]=4 4229 B14R1.6395 OC(=O)C(CCc1ccccc1)(C)C Amb17235442 [0,1,0,0,0,1|1,0,1]=4 4230 B14R1.6395 OC(=O)C(CCc1ccccc1)(N)C Amb10609240 [0,1,0,0,0,1|1,0,1]=4 4231 B14R1.6395 OC(=O)C(F)(F)SCc1ccccc1 Amb23586516 [0,1,0,0,0,1|1,0,1]=4 4232 B14R1.6395 OC(=O)C(SCc1ccccc1)(C)C Amb17501463 [0,1,0,0,0,1|1,0,1]=4 4233 B14R1.3 C#Cc1ccc(CC(N)C(O)=O)cc1 Amb25828354 [0,2,0,0,0,0|1,0,1]=4 4234 B14R1.3 C#Cc1ccc(C[C@@H](N)C(O)=O)cc1 Amb22831206 [0,2,0,0,0,0|1,0,1]=4 4235 B14R1.3 C#Cc1ccc(C[C@H](N)C(O)=O)cc1 Amb25114223 [0,2,0,0,0,0|1,0,1]=4 4236 B14R1.3 C=Cc1ccc(C[C@@H](N)C(O)=O)cc1 Amb23440413 [0,2,0,0,0,0|1,0,1]=4 4237 B14R1.3 C=Nc1ccc(cc1)NC(=S)C(O)=O Amb25325057 [0,2,0,0,0,0|1,1,0]=4 4238 B14R1.3 CC(=O)C(=O)Cc1ccc(cc1)OC Amb23603625 [0,2,0,0,0,0|1,0,0]=3 4239 B14R1.3 CC(C(=O)O)Cc1ccc(cc1)C#N Amb17605814 [0,2,0,0,0,0|1,0,1]=4 4240 B14R1.3 CCc1ccc(CC(Br)C(O)=O)cc1 Amb23320612 [0,2,0,0,0,0|1,0,1]=4 4241 B14R1.3 CCc1ccc(C[C@@H](N)C(O)=O)cc1 Amb19061740 [0,2,0,0,0,0|1,0,1]=4 4242 B14R1.3 CCc1ccc(C[C@H](N)C(O)=O)cc1 Amb24087706 [0,2,0,0,0,0|1,0,1]=4 4243 B14R1.3 CCc1ccc(\C=C(\F)/C(O)=O)cc1 Amb25832205 [0,2,0,0,0,0|1,0,1]=4 4244 B14R1.3 CCc1ccc(cc1)CC(=O)C(=O)O Amb1129594 [0,2,0,0,0,0|0,0,0]=2 4245 B14R1.3 CCc1ccc(cc1)CC(C(=O)O)Cl Amb17204445 [0,2,0,0,0,0|1,0,1]=4 4246 B14R1.3 CCc1ccc(cc1)CC(C(=O)O)O Amb17139447 [0,2,0,0,0,0|0,0,2]=4 4247 B14R1.3 CCc1ccc(cc1)NC(=O)C(=O)C Amb17401507 [0,2,0,0,0,0|2,0,0]=4 4248 B14R1.3 CNc1ccc(CC(N)C(O)=O)cc1 Amb24347208 [0,2,0,0,0,0|1,0,1]=4 4249 B14R1.3 CNc1ccc(C[C@@H](N)C(O)=O)cc1 Amb24499178 [0,2,0,0,0,0|1,0,1]=4 4250 B14R1.3 CNc1ccc(C[C@H](N)C(O)=O)cc1 Amb24498999 [0,2,0,0,0,0|1,0,1]=4 4251 B14R1.3 COc1ccc(C=C(Br)C(O)=O)cc1 Amb24061146 [0,2,0,0,0,0|1,0,1]=4 4252 B14R1.3 COc1ccc(CC(Br)C(O)=O)cc1 Amb18668075 [0,2,0,0,0,0|1,0,1]=4 4253 B14R1.3 COc1ccc(CC(Br)C(O)=O)cc1 Amb22339388 [0,2,0,0,0,0|1,0,1]=4 4254 B14R1.3 COc1ccc(C[C@@H](N)C(O)=O)cc1 Amb20241652 [0,2,0,0,0,0|1,0,1]=4 4255 B14R1.3 COc1ccc(C[C@@H](O)C(O)=O)cc1 Amb22747357 [0,2,0,0,0,0|0,0,2]=4 4256 B14R1.3 COc1ccc(\C=C(\F)/C(O)=O)cc1 Amb18652300 [0,2,0,0,0,0|1,0,1]=4 4257 B14R1.3 COc1ccc(cc1)C=C(C(=O)O)S Amb2383947 [0,2,0,0,0,0|0,1,1]=4 4258 B14R1.3 COc1ccc(cc1)CC(=O)C(=O)O Amb1134810 [0,2,0,0,0,0|0,0,0]=2 4259 B14R1.3 COc1ccc(cc1)CC(C(=O)O)Cl Amb17204461 [0,2,0,0,0,0|1,0,1]=4 4260 B14R1.3 COc1ccc(cc1)CC(C(=O)O)O Amb17139589 [0,2,0,0,0,0|0,0,2]=4 4261 B14R1.3 COc1ccc(cc1)NC(=O)C(=O)C Amb2383841 [0,2,0,0,0,0|2,0,0]=4 4262 B14R1.3 COc1ccc(cc1)NC(=O)C(=O)N Amb1859526 [0,2,0,0,0,0|2,0,0]=4 4263 B14R1.3 COc1ccc(cc1)\C=C(/C(=O)O)\S Amb1922217 [0,2,0,0,0,0|0,1,1]=4 4264 B14R1.3 COc1ccc(cc1)\C=C(\C(=O)O)/O Amb1227696 [0,2,0,0,0,0|0,0,2]=4 4265 B14R1.3 CSc1ccc(cc1)CC(C(=O)O)N Amb13951673 [0,2,0,0,0,0|1,0,1]=4 4266 B14R1.3 C\C(=C\c1ccc(CC)cc1)\C(O)=O Amb25128557 [0,2,0,0,0,0|1,0,1]=4 4267 B14R1.3 C\C(=N/c1ccc(cc1)OC)\C(O)=O Amb25725055 [0,2,0,0,0,0|2,0,0]=4 4268 B14R1.3 N#Cc1ccc(CC(Cl)C(O)=O)cc1 Amb24447099 [0,2,0,0,0,0|1,0,1]=4 4269 B14R1.3 N#Cc1ccc(C[C@H](Cl)C(O)=O)cc1 Amb25055871 [0,2,0,0,0,0|1,0,1]=4 4270 B14R1.3 N#Cc1ccc(\C=C(/F)\C(O)=O)cc1 Amb24431317 [0,2,0,0,0,0|1,0,1]=4 4271 B14R1.3 N#Cc1ccc(cc1)CC(=O)C(=O)O Amb1139062 [0,2,0,0,0,0|0,0,0]=2 4272 B14R1.3 N#Cc1ccc(cc1)NC(=O)C(=O)C Amb17401164 [0,2,0,0,0,0|2,0,0]=4 4273 B14R1.3 NC(=O)C(=O)Nc1ccc(cc1)C#N Amb25708444 [0,2,0,0,0,0|2,0,0]=4 4274 B14R1.3 NC(Cc1ccc(cc1)C#N)C(O)=O Amb22002699 [0,2,0,0,0,0|1,0,1]=4 4275 B14R1.3 NCc1ccc(CC(N)C(O)=O)cc1 Amb22002700 [0,2,0,0,0,0|1,0,1]=4 4276 B14R1.3 NNc1ccc(CC(N)C(O)=O)cc1 Amb25791647 [0,2,0,0,0,0|1,0,1]=4 4277 B14R1.3 N[C@@H](Cc1ccc(cc1)C#N)C(O)=O Amb22746029 [0,2,0,0,0,0|1,0,1]=4 4278 B14R1.3 N[C@H](Cc1ccc(CO)cc1)C(O)=O Amb22336868 [0,2,0,0,0,0|1,0,1]=4 4279 B14R1.3 OCc1ccc(cc1)CC(C(=O)O)N Amb2412263 [0,2,0,0,0,0|1,0,1]=4 4280 B14R1.132 BrC(C(C(=O)O)Br)c1ccc(cc1)Br Amb17612538 [0,2,0,0,0,0|1,0,1]=4 4281 B14R1.132 C=C(C(N)c1ccc(Cl)cc1)C(N)=O Amb25166044 [0,2,0,0,0,0|2,0,0]=4 4282 B14R1.132 C=C(C(N)c1ccc(Cl)cc1)C(O)=O Amb24568941 [0,2,0,0,0,0|1,0,0]=3 4283 B14R1.132 C=C(C(N)c1ccc(F)cc1)C(N)=O Amb24342876 [0,2,0,0,0,0|2,0,0]=4 4284 B14R1.132 C=C(C(N)c1ccc(F)cc1)C(O)=O Amb25165745 [0,2,0,0,0,0|1,0,0]=3 4285 B14R1.132 C=C(C(O)c1ccc(Cl)cc1)C(N)=O Amb24401675 [0,2,0,0,0,0|2,0,0]=4 4286 B14R1.132 C=C(C(O)c1ccc(F)cc1)C(O)=O Amb25181604 [0,2,0,0,0,0|1,0,0]=3 4287 B14R1.132 C=C([C@@H](N)c1ccc(Cl)cc1)C(N)=O Amb25165762 [0,2,0,0,0,0|2,0,0]=4 4288 B14R1.132 C=C([C@@H](N)c1ccc(Cl)cc1)C(O)=O Amb24669038 [0,2,0,0,0,0|1,0,0]=3 4289 B14R1.132 CC(=C)C(=O)C(C)c1ccc(N)cc1 Amb25366376 [0,2,0,0,0,0|2,0,0]=4 4290 B14R1.132 CC(=O)C(=C)C(O)c1ccc(F)cc1 Amb25848604 [0,2,0,0,0,0|2,0,0]=4 4291 B14R1.132 CC(=O)C(=C)C(O)c1ccc(O)cc1 Amb25752582 [0,2,0,0,0,0|2,0,0]=4 4292 B14R1.132 CC(C(=C)C(O)=O)c1ccc(F)cc1 Amb24634260 [0,2,0,0,0,0|1,0,0]=3 4293 B14R1.132 CC(C(C)c1ccc(Br)cc1)C(O)=O Amb18692614 [0,2,0,0,0,0|1,0,1]=4 4294 B14R1.132 CC(C(C)c1ccc(Cl)cc1)C(O)=O Amb25237125 [0,2,0,0,0,0|1,0,1]=4 4295 B14R1.132 CC(C(C)c1ccc(F)cc1)C(O)=O Amb18813112 [0,2,0,0,0,0|1,0,1]=4 4296 B14R1.132 CC(C(Cl)C(O)=O)c1ccc(F)cc1 Amb24539303 [0,2,0,0,0,0|1,0,1]=4 4297 B14R1.132 CC(C(F)C(O)=O)c1ccc(Br)cc1 Amb25200829 [0,2,0,0,0,0|1,0,1]=4 4298 B14R1.132 CC(C(F)C(O)=O)c1ccc(F)cc1 Amb25738779 [0,2,0,0,0,0|1,0,1]=4 4299 B14R1.132 CC(C(F)C(O)=O)c1ccc(I)cc1 Amb25235034 [0,2,0,0,0,0|1,0,1]=4 4300 B14R1.132 CC(C(N)C(O)=O)c1ccc(Cl)cc1 Amb18657526 [0,2,0,0,0,0|1,0,1]=4 4301 B14R1.132 CC(C(N)C(O)=O)c1ccc(N)cc1 Amb18651901 [0,2,0,0,0,0|1,0,1]=4 4302 B14R1.132 CC(C(O)c1ccc(Cl)cc1)C(O)=O Amb18990622 [0,2,0,0,0,0|1,0,1]=4 4303 B14R1.132 CC(C(O)c1ccc(F)cc1)C(O)=O Amb18990625 [0,2,0,0,0,0|1,0,1]=4 4304 B14R1.132 CN(c1ccc(Cl)cc1)C(=O)C(O)=O Amb25045506 [0,2,0,0,0,0|1,0,0]=3 4305 B14R1.132 CN(c1ccc(F)cc1)C(=O)C(O)=O Amb18284152 [0,2,0,0,0,0|1,0,0]=3 4306 B14R1.132 CN(c1ccc(O)cc1)C(=O)C(O)=O Amb25813283 [0,2,0,0,0,0|1,0,0]=3 4307 B14R1.132 C[C@@H]([C@@H](N)C(O)=O)c1ccc(F)cc1 Amb24590238 [0,2,0,0,0,0|1,0,1]=4 4308 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(Br)cc1 Amb24575274 [0,2,0,0,0,0|1,0,1]=4 4309 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(Cl)cc1 Amb24640346 [0,2,0,0,0,0|1,0,1]=4 4310 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(O)cc1 Amb25783870 [0,2,0,0,0,0|1,0,1]=4 4311 B14R1.132 C[C@@H]([C@H](O)c1ccc(F)cc1)C(O)=O Amb25134261 [0,2,0,0,0,0|1,0,1]=4 4312 B14R1.132 C[C@H]([C@H](N)C(O)=O)c1ccc(Br)cc1 Amb25198880 [0,2,0,0,0,0|1,0,1]=4 4313 B14R1.132 C[C@H]([C@H](N)C(O)=O)c1ccc(O)cc1 Amb25774999 [0,2,0,0,0,0|1,0,1]=4 4314 B14R1.132 C\C(=C(\F)/C(O)=O)\c1ccc(Br)cc1 Amb25664823 [0,2,0,0,0,0|1,0,1]=4 4315 B14R1.132 C\C(=C(\F)/C(O)=O)\c1ccc(I)cc1 Amb25191037 [0,2,0,0,0,0|1,0,1]=4 4316 B14R1.132 C\C(\C(O)=O)=C(/C)\c1ccc(F)cc1 Amb25164445 [0,2,0,0,0,0|1,0,1]=4 4317 B14R1.132 C\C(\C(O)=O)=C(\C)/c1ccc(Cl)cc1 Amb24455090 [0,2,0,0,0,0|1,0,1]=4 4318 B14R1.132 C\C(\C(O)=O)=C(\C)/c1ccc(F)cc1 Amb25265842 [0,2,0,0,0,0|1,0,1]=4 4319 B14R1.132 C\C(\C(O)=O)=C(\Cl)/c1ccc(Cl)cc1 Amb25856432 [0,2,0,0,0,0|1,0,1]=4 4320 B14R1.132 C\C(\c1ccc(C)cc1)=C(\C)/C(O)=O Amb24455930 [0,2,0,0,0,0|1,0,1]=4 4321 B14R1.132 Cc1ccc(cc1)C(C)C(=S)C(O)=O Amb25218249 [0,2,0,0,0,0|0,1,0]=3 4322 B14R1.132 Cc1ccc(cc1)C(C)C(C)C(O)=O Amb18190563 [0,2,0,0,0,0|1,0,1]=4 4323 B14R1.132 Cc1ccc(cc1)C(C)C(F)C(O)=O Amb25289864 [0,2,0,0,0,0|1,0,1]=4 4324 B14R1.132 Cc1ccc(cc1)C(C)C(N)C(O)=O Amb18651559 [0,2,0,0,0,0|1,0,1]=4 4325 B14R1.132 Cc1ccc(cc1)C(C)C(O)C(O)=O Amb19149343 [0,2,0,0,0,0|0,0,2]=4 4326 B14R1.132 Cc1ccc(cc1)C(Cl)C(=O)C(N)=O Amb25733472 [0,2,0,0,0,0|1,0,0]=3 4327 B14R1.132 Cc1ccc(cc1)C(N)C(=C)C(C)=O Amb24443914 [0,2,0,0,0,0|2,0,0]=4 4328 B14R1.132 Cc1ccc(cc1)C(N)C(N)C(O)=O Amb25111186 [0,2,0,0,0,0|1,0,1]=4 4329 B14R1.132 Cc1ccc(cc1)C(O)C(=C)C(C)=O Amb24414990 [0,2,0,0,0,0|2,0,0]=4 4330 B14R1.132 Cc1ccc(cc1)C(O)C(=C)C(N)=O Amb24729014 [0,2,0,0,0,0|2,0,0]=4 4331 B14R1.132 Cc1ccc(cc1)C(O)C(=O)C(C)=C Amb25813823 [0,2,0,0,0,0|2,0,0]=4 4332 B14R1.132 Cc1ccc(cc1)C(O)C(N)C(O)=O Amb25232569 [0,2,0,0,0,0|1,0,1]=4 4333 B14R1.132 Cc1ccc(cc1)N(C)C(=O)C(O)=O Amb18957814 [0,2,0,0,0,0|1,0,0]=3 4334 B14R1.132 Cc1ccc(cc1)[C@@H](C)[C@@H](N)C(O)=O Amb25109337 [0,2,0,0,0,0|1,0,1]=4 4335 B14R1.132 Cc1ccc(cc1)[C@@H](N)[C@@H](C)C(O)=O Amb24381868 [0,2,0,0,0,0|1,0,1]=4 4336 B14R1.132 Cc1ccc(cc1)[C@@H](N)[C@@H](O)C(O)=O Amb22756713 [0,2,0,0,0,0|0,0,2]=4 4337 B14R1.132 Cc1ccc(cc1)[C@@H](N)[C@H](O)C(O)=O Amb24579096 [0,2,0,0,0,0|0,0,2]=4 4338 B14R1.132 Cc1ccc(cc1)[C@@H](O)[C@@H](C)C(O)=O Amb25807681 [0,2,0,0,0,0|1,0,1]=4 4339 B14R1.132 Cc1ccc(cc1)[C@@H](O)[C@@H](N)C(O)=O Amb25361019 [0,2,0,0,0,0|1,0,1]=4 4340 B14R1.132 Cc1ccc(cc1)[C@@H](O)[C@H](N)C(O)=O Amb25101011 [0,2,0,0,0,0|1,0,1]=4 4341 B14R1.132 Cc1ccc(cc1)[C@H](N)[C@@H](N)C(O)=O Amb25061276 [0,2,0,0,0,0|1,0,1]=4 4342 B14R1.132 Cc1ccc(cc1)[C@H](N)[C@H](O)C(O)=O Amb25282340 [0,2,0,0,0,0|0,0,2]=4 4343 B14R1.132 Cc1ccc(cc1)[C@H](O)[C@@H](O)C(O)=O Amb24711257 [0,2,0,0,0,0|0,0,2]=4 4344 B14R1.132 Cc1ccc(cc1)\C(\F)=C(\F)/C(O)=O Amb24511908 [0,2,0,0,0,0|1,0,1]=4 4345 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)Br Amb17473595 [0,2,0,0,0,0|1,0,1]=4 4346 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)C Amb17470846 [0,2,0,0,0,0|1,0,1]=4 4347 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)Cl Amb17471484 [0,2,0,0,0,0|1,0,1]=4 4348 B14R1.132 NC(C(C(=O)O)C)c1ccc(cc1)F Amb17470956 [0,2,0,0,0,0|1,0,1]=4 4349 B14R1.132 NC(C(F)C(O)=O)c1ccc(F)cc1 Amb24597731 [0,2,0,0,0,0|1,0,1]=4 4350 B14R1.132 NC(C(F)c1ccc(Cl)cc1)C(O)=O Amb25324931 [0,2,0,0,0,0|1,0,1]=4 4351 B14R1.132 NC(C(N)c1ccc(O)cc1)C(O)=O Amb25288112 [0,2,0,0,0,0|1,0,1]=4 4352 B14R1.132 NC(C(O)C(O)=O)c1ccc(Cl)cc1 Amb25308091 [0,2,0,0,0,0|0,0,2]=4 4353 B14R1.132 NC(C(O)C(O)=O)c1ccc(F)cc1 Amb24711455 [0,2,0,0,0,0|0,0,2]=4 4354 B14R1.132 NC(C(O)C(O)=O)c1ccc(I)cc1 Amb24530510 [0,2,0,0,0,0|0,0,2]=4 4355 B14R1.132 NC(C(O)c1ccc(Br)cc1)C(O)=O Amb18692059 [0,2,0,0,0,0|1,0,1]=4 4356 B14R1.132 NC(C(O)c1ccc(Cl)cc1)C(O)=O Amb18657878 [0,2,0,0,0,0|1,0,1]=4 4357 B14R1.132 NC(C(O)c1ccc(F)cc1)C(O)=O Amb17846423 [0,2,0,0,0,0|1,0,1]=4 4358 B14R1.132 NC(C(O)c1ccc(O)cc1)C(O)=O Amb18652543 [0,2,0,0,0,0|1,0,1]=4 4359 B14R1.132 NC(C(S)c1ccc(Cl)cc1)C(O)=O Amb24355278 [0,2,0,0,0,0|1,0,1]=4 4360 B14R1.132 NC(C(S)c1ccc(F)cc1)C(O)=O Amb25770122 [0,2,0,0,0,0|1,0,1]=4 4361 B14R1.132 N[C@@H](C(O)c1ccc(F)cc1)C(O)=O Amb25288164 [0,2,0,0,0,0|1,0,1]=4 4362 B14R1.132 N[C@@H](C(O)c1ccc(O)cc1)C(O)=O Amb25310972 [0,2,0,0,0,0|1,0,1]=4 4363 B14R1.132 N[C@@H]([C@@H](O)C(O)=O)c1ccc(F)cc1 Amb22746337 [0,2,0,0,0,0|0,0,2]=4 4364 B14R1.132 N[C@@H]([C@@H](O)c1ccc(Cl)cc1)C(O)=O Amb23603668 [0,2,0,0,0,0|1,0,1]=4 4365 B14R1.132 N[C@@H]([C@H](N)c1ccc(F)cc1)C(O)=O Amb24693961 [0,2,0,0,0,0|1,0,1]=4 4366 B14R1.132 N[C@@H]([C@H](O)C(O)=O)c1ccc(Br)cc1 Amb24637298 [0,2,0,0,0,0|0,0,2]=4 4367 B14R1.132 N[C@@H]([C@H](O)C(O)=O)c1ccc(F)cc1 Amb25672659 [0,2,0,0,0,0|0,0,2]=4 4368 B14R1.132 N[C@@H]([C@H](O)c1ccc(Cl)cc1)C(O)=O Amb25715774 [0,2,0,0,0,0|1,0,1]=4 4369 B14R1.132 N[C@@H]([C@H](S)c1ccc(Cl)cc1)C(O)=O Amb25356169 [0,2,0,0,0,0|1,0,1]=4 4370 B14R1.132 N[C@H](C(O)c1ccc(F)cc1)C(O)=O Amb24498337 [0,2,0,0,0,0|1,0,1]=4 4371 B14R1.132 N[C@H](C(O)c1ccc(O)cc1)C(O)=O Amb25181831 [0,2,0,0,0,0|1,0,1]=4 4372 B14R1.132 N[C@H]([C@@H](O)C(O)=O)c1ccc(Br)cc1 Amb25730047 [0,2,0,0,0,0|0,0,2]=4 4373 B14R1.132 N[C@H]([C@@H](O)C(O)=O)c1ccc(F)cc1 Amb24454558 [0,2,0,0,0,0|0,0,2]=4 4374 B14R1.132 N[C@H]([C@@H](O)c1ccc(O)cc1)C(O)=O Amb24710046 [0,2,0,0,0,0|1,0,1]=4 4375 B14R1.132 N[C@H]([C@H](O)c1ccc(Cl)cc1)C(O)=O Amb25710838 [0,2,0,0,0,0|1,0,1]=4 4376 B14R1.132 N[C@H]([C@H](O)c1ccc(O)cc1)C(O)=O Amb24726352 [0,2,0,0,0,0|1,0,1]=4 4377 B14R1.132 Nc1ccc(cc1)C(N)C(N)C(O)=O Amb25185838 [0,2,0,0,0,0|1,0,1]=4 4378 B14R1.132 Nc1ccc(cc1)C(N)C(O)C(O)=O Amb24445167 [0,2,0,0,0,0|0,0,2]=4 4379 B14R1.132 Nc1ccc(cc1)C(O)C(N)C(O)=O Amb24692799 [0,2,0,0,0,0|1,0,1]=4 4380 B14R1.132 Nc1ccc(cc1)[C@@H](O)[C@@H](N)C(O)=O Amb25362267 [0,2,0,0,0,0|1,0,1]=4 4381 B14R1.132 OC(=O)C(=O)C(Br)c1ccc(F)cc1 Amb25055628 [0,2,0,0,0,0|0,0,0]=2 4382 B14R1.132 OC(=O)[C@H](O)[C@@H](O)c1ccc(F)cc1 Amb25131176 [0,2,0,0,0,0|0,0,2]=4 4383 B14R1.132 Oc1ccc(cc1)C(O)C(O)C(O)=O Amb21964899 [0,2,0,0,0,0|0,0,2]=4 4384 B14R1.132 Oc1ccc(cc1)\C(\F)=C(/F)\C(O)=O Amb25838725 [0,2,0,0,0,0|1,0,1]=4 4385 B14R1.132 Oc1ccc(cc1)\C(\F)=C(\F)/C(O)=O Amb25195941 [0,2,0,0,0,0|1,0,1]=4 4386 B14R1.134 CN(OC)C(=O)Cc1ccc(Br)cc1 Amb22886722 [0,2,0,0,0,0|2,0,0]=4 4387 B14R1.134 CN(OC)C(=O)Cc1ccc(Cl)cc1 Amb20673766 [0,2,0,0,0,0|2,0,0]=4 4388 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)C Amb1808222 [0,2,0,0,0,0|2,0,0]=4 4389 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)Cl Amb1856171 [0,2,0,0,0,0|2,0,0]=4 4390 B14R1.134 CNC(=O)C(=O)Nc1ccc(cc1)F Amb1931362 [0,2,0,0,0,0|2,0,0]=4 4391 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)Br Amb17162561 [0,2,0,0,0,0|0,0,0]=2 4392 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)C Amb17139342 [0,2,0,0,0,0|0,0,0]=2 4393 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)Cl Amb17140710 [0,2,0,0,0,0|0,0,0]=2 4394 B14R1.134 COC(=O)C(=O)Cc1ccc(cc1)F Amb17139585 [0,2,0,0,0,0|0,0,0]=2 4395 B14R1.134 COC(=O)C(=O)NC1=CNC(=O)C=C1 Amb25029313 [0,2,0,0,0,0|2,0,0]=4 4396 B14R1.134 COC(=O)C(=O)Nc1ccc(Br)c[n]1 Amb25331380 [0,2,0,0,0,0|2,0,0]=4 4397 B14R1.134 COC(=O)C(=O)Nc1ccc(Br)cc1 Amb25693653 [0,2,0,0,0,0|1,0,0]=3 4398 B14R1.134 COC(=O)C(=O)Nc1ccc(F)c[n]1 Amb24095898 [0,2,0,0,0,0|2,0,0]=4 4399 B14R1.134 COC(=O)C(=O)Nc1ccc(I)cc1 Amb24644865 [0,2,0,0,0,0|1,0,0]=3 4400 B14R1.134 COC(=O)C(=O)Nc1ccc(cn1)Cl Amb10071055 [0,2,0,0,0,0|2,0,0]=4 4401 B14R1.134 COC(=O)C(C)Cc1ccc(C)cc1 Amb17844107 [0,2,0,0,0,0|1,0,1]=4 4402 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)Cl Amb17204951 [0,2,0,0,0,0|1,0,1]=4 4403 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)N Amb17415249 [0,2,0,0,0,0|1,0,1]=4 4404 B14R1.134 COC(=O)C(Cc1ccc(cc1)Br)O Amb17163100 [0,2,0,0,0,0|0,0,2]=4 4405 B14R1.134 COC(=O)C(Cc1ccc(cc1)C)Cl Amb17204448 [0,2,0,0,0,0|1,0,1]=4 4406 B14R1.134 COC(=O)C(Cc1ccc(cc1)C)N Amb17401774 [0,2,0,0,0,0|1,0,1]=4 4407 B14R1.134 COC(=O)C(Cc1ccc(cc1)C)O Amb17139450 [0,2,0,0,0,0|0,0,2]=4 4408 B14R1.134 COC(=O)C(Cc1ccc(cc1)Cl)Cl Amb17204593 [0,2,0,0,0,0|1,0,1]=4 4409 B14R1.134 COC(=O)C(Cc1ccc(cc1)Cl)N Amb2228449 [0,2,0,0,0,0|1,0,1]=4 4410 B14R1.134 COC(=O)C(Cc1ccc(cc1)Cl)O Amb17140888 [0,2,0,0,0,0|0,0,2]=4 4411 B14R1.134 COC(=O)C(Cc1ccc(cc1)F)Cl Amb17204463 [0,2,0,0,0,0|1,0,1]=4 4412 B14R1.134 COC(=O)C(Cc1ccc(cc1)F)N Amb17402183 [0,2,0,0,0,0|1,0,1]=4 4413 B14R1.134 COC(=O)C(Cc1ccc(cc1)F)O Amb17139694 [0,2,0,0,0,0|0,0,2]=4 4414 B14R1.134 COC(=O)C(Cc1ccc(cc1)O)N Amb1210958 [0,2,0,0,0,0|1,0,1]=4 4415 B14R1.134 COC(=O)C(N)Cc1ccc(Br)cc1 Amb17943431 [0,2,0,0,0,0|1,0,1]=4 4416 B14R1.134 COC(=O)C(O)Cc1ccc(O)cc1 Amb18652328 [0,2,0,0,0,0|0,0,2]=4 4417 B14R1.134 COC(=O)C([NH3+])Cc1ccc(Cl)cc1 Amb22492774 [0,2,0,0,0,0|1,0,1]=4 4418 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(F)cc1 Amb22745758 [0,2,0,0,0,0|1,0,1]=4 4419 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(I)cc1 Amb22226738 [0,2,0,0,0,0|1,0,1]=4 4420 B14R1.134 COC(=O)[C@@H](N)Cc1ccc(N)cc1 Amb22746725 [0,2,0,0,0,0|1,0,1]=4 4421 B14R1.134 COC(=O)[C@@H](O)Cc1ccc(F)cc1 Amb22747622 [0,2,0,0,0,0|0,0,2]=4 4422 B14R1.134 COC(=O)[C@@H](O)Cc1ccc(O)cc1 Amb22747623 [0,2,0,0,0,0|0,0,2]=4 4423 B14R1.134 COC(=O)[C@H](N)Cc1ccc(O)cc1 Amb19944299 [0,2,0,0,0,0|1,0,1]=4 4424 B14R1.134 COC(=O)[C@H](O)Cc1ccc(F)cc1 Amb17935903 [0,2,0,0,0,0|0,0,2]=4 4425 B14R1.134 COC(=O)\C(\N)=C\c1ccc(Cl)cc1 Amb25743045 [0,2,0,0,0,0|1,0,1]=4 4426 B14R1.134 COC(=O)\C(\N)=C\c1ccc(O)cc1 Amb18651414 [0,2,0,0,0,0|1,0,1]=4 4427 B14R1.134 COC(=O)\C(\O)=C/c1ccc(O)cc1 Amb24422360 [0,2,0,0,0,0|0,0,2]=4 4428 B14R1.134 COC(=O)\C(\O)=C\c1ccc(O)cc1 Amb25262758 [0,2,0,0,0,0|0,0,2]=4 4429 B14R1.134 COC(=O)\C(\S)=C/c1ccc(O)cc1 Amb24380870 [0,2,0,0,0,0|0,1,1]=4 4430 B14R1.134 COC(=O)\C(\S)=C\c1ccc(O)cc1 Amb25366564 [0,2,0,0,0,0|0,1,1]=4 4431 B14R1.134 C\C(=C/c1ccc(N)cc1)\C(=O)OC Amb25664150 [0,2,0,0,0,0|1,0,1]=4 4432 B14R1.134 C\C(=C/c1ccc(O)cc1)\C(=O)OC Amb25767747 [0,2,0,0,0,0|1,0,1]=4 4433 B14R1.134 C\C(=C\c1ccc(O)cc1)\C(=O)OC Amb25087135 [0,2,0,0,0,0|1,0,1]=4 4434 B14R1.134 Cc1ccc(CC(=O)N(C)OC)cc1 Amb20673715 [0,2,0,0,0,0|2,0,0]=4 4435 B14R1.134 Cc1ccc(NC(=O)C(=O)OC)[n]c1 Amb25665775 [0,2,0,0,0,0|2,0,0]=4 4436 B14R1.134 Cc1ccc(cc1)NC(=O)C(=O)CC Amb25110053 [0,2,0,0,0,0|2,0,0]=4 4437 B14R1.134 Cc1ccc(cc1)NC(=O)\C(\N)=N/O Amb19664197 [0,2,0,0,0,0|2,0,0]=4 4438 B14R1.134 Cc1ccc(cc1)NC(=O)\C(\N)=N\O Amb21972244 [0,2,0,0,0,0|2,0,0]=4 4439 B14R1.134 NC(Cc1ccc(F)cc1)C(=O)NO Amb25104313 [0,2,0,0,0,0|1,0,1]=4 4440 B14R1.134 NC(Cc1ccc(O)cc1)C(=O)NO Amb22451358 [0,2,0,0,0,0|1,0,1]=4 4441 B14R1.134 NNC(=O)C(=O)Nc1ccc(cc1)Br Amb1939003 [0,2,0,0,0,0|2,0,0]=4 4442 B14R1.134 NNC(=O)C(=O)Nc1ccc(cc1)C Amb1657705 [0,2,0,0,0,0|2,0,0]=4 4443 B14R1.134 NNC(=O)C(=O)Nc1ccc(cc1)F Amb2167673 [0,2,0,0,0,0|2,0,0]=4 4444 B14R1.134 N[C@@H](Cc1ccc(O)cc1)C(=O)NO Amb24096672 [0,2,0,0,0,0|1,0,1]=4 4445 B14R1.134 N[C@H](Cc1ccc(O)cc1)C(=O)NO Amb25185575 [0,2,0,0,0,0|1,0,1]=4 4446 B14R1.134 N\C(=N\O)\C(=O)Nc1ccc(Br)cc1 Amb19664175 [0,2,0,0,0,0|2,0,0]=4 4447 B14R1.134 N\C(=N\O)\C(=O)Nc1ccc(Cl)cc1 Amb19664179 [0,2,0,0,0,0|2,0,0]=4 4448 B14R1.134 N\C(=N\O)\C(=O)Nc1ccc(F)cc1 Amb19664217 [0,2,0,0,0,0|2,0,0]=4 4449 B14R1.134 N\C(=N\O)\C(=O)Nc1ccc(I)cc1 Amb19664218 [0,2,0,0,0,0|2,0,0]=4 4450 B14R1.134 Nc1ccc(CC(N)C(=O)NO)cc1 Amb24713615 [0,2,0,0,0,0|1,0,1]=4 4451 B14R1.134 Nc1ccc(C[C@H](N)C(=O)NO)cc1 Amb25769906 [0,2,0,0,0,0|1,0,1]=4 4452 B14R1.134 OCC(=O)N(Cc1ccc(cc1)Br)C Amb17415251 [0,2,0,0,0,0|2,0,0]=4 4453 B14R1.134 OCC(=O)N(Cc1ccc(cc1)C)C Amb1110323 [0,2,0,0,0,0|2,0,0]=4 4454 B14R1.134 OCC(=O)N(Cc1ccc(cc1)Cl)C Amb17404296 [0,2,0,0,0,0|2,0,0]=4 4455 B14R1.134 OCC(=O)N(Cc1ccc(cc1)F)C Amb1110198 [0,2,0,0,0,0|2,0,0]=4 4456 B14R1.536 C=C=C(Cc1ccc(F)cc1)C(O)=O Amb25088401 [0,2,0,0,0,0|1,0,0]=3 4457 B14R1.536 CC(=O)\C(\Cc1ccc(O)cc1)=N/O Amb25128987 [0,2,0,0,0,0|1,0,1]=4 4458 B14R1.536 CCC(C(=O)O)Cc1ccc(cc1)Br Amb17605818 [0,2,0,0,0,0|1,0,1]=4 4459 B14R1.536 CC\C(=C\c1ccc(Cl)cc1)\C(O)=O Amb25287336 [0,2,0,0,0,0|1,0,1]=4 4460 B14R1.536 CC\C(=C\c1ccc(F)cc1)\C(O)=O Amb24640765 [0,2,0,0,0,0|1,0,1]=4 4461 B14R1.536 CC\C(=C\c1ccc(O)cc1)\C(O)=O Amb25803410 [0,2,0,0,0,0|1,0,1]=4 4462 B14R1.536 CNC(Cc1ccc(O)cc1)C(O)=O Amb18652099 [0,2,0,0,0,0|1,0,1]=4 4463 B14R1.536 CN[C@H](C(=O)O)Cc1ccc(cc1)O Amb17617887 [0,2,0,0,0,0|1,0,1]=4 4464 B14R1.536 COC(C(=O)O)Cc1ccc(cc1)Cl Amb16233253 [0,2,0,0,0,0|0,0,2]=4 4465 B14R1.536 COC(Cc1ccc(Br)cc1)C(O)=O Amb23321116 [0,2,0,0,0,0|0,0,2]=4 4466 B14R1.536 COC(Cc1ccc(F)cc1)C(O)=O Amb23320970 [0,2,0,0,0,0|0,0,2]=4 4467 B14R1.536 COC(Cc1ccc(I)cc1)C(O)=O Amb23321146 [0,2,0,0,0,0|0,0,2]=4 4468 B14R1.536 CO\C(=C/c1ccc(O)cc1)\C(O)=O Amb23512576 [0,2,0,0,0,0|0,0,2]=4 4469 B14R1.536 CS\C(=C\c1ccc(O)cc1)\C(O)=O Amb18131177 [0,2,0,0,0,0|0,1,1]=4 4470 B14R1.536 C\C=C(\Oc1ccc(F)cc1)/C(O)=O Amb25232598 [0,2,0,0,0,0|2,0,0]=4 4471 B14R1.536 Cc1ccc(CC(CN)C(O)=O)cc1 Amb20622926 [0,2,0,0,0,0|1,0,1]=4 4472 B14R1.536 Cc1ccc(CC(OC)C(O)=O)cc1 Amb23320726 [0,2,0,0,0,0|0,0,2]=4 4473 B14R1.536 Cc1ccc(\C=C(\C=C)/C(O)=O)cc1 Amb24617862 [0,2,0,0,0,0|1,0,1]=4 4474 B14R1.536 Cc1ccc(\C=C(\CC)/C(O)=O)cc1 Amb24536291 [0,2,0,0,0,0|1,0,1]=4 4475 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)C Amb17090112 [0,2,0,0,0,0|1,0,1]=4 4476 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)Cl Amb17090120 [0,2,0,0,0,0|1,0,1]=4 4477 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)F Amb17090114 [0,2,0,0,0,0|1,0,1]=4 4478 B14R1.536 N#CC(C(=O)O)Cc1ccc(cc1)O Amb17090135 [0,2,0,0,0,0|1,0,1]=4 4479 B14R1.536 N#C\C(=C/c1ccc(I)cc1)\C(O)=O Amb24417447 [0,2,0,0,0,0|1,0,1]=4 4480 B14R1.536 N#C\C(=C/c1ccc(O)cc1)\C(O)=O Amb22337322 [0,2,0,0,0,0|1,0,1]=4 4481 B14R1.536 N#C\C(=C/c1ccc(O)cc1)\C(O)=O Amb22337325 [0,2,0,0,0,0|1,0,1]=4 4482 B14R1.536 N#C\C(=C/c1ccc(cc1)Br)\C(=O)O Amb1134779 [0,2,0,0,0,0|1,0,1]=4 4483 B14R1.536 N#C\C(=C/c1ccc(cc1)C)\C(=O)O Amb1646932 [0,2,0,0,0,0|1,0,1]=4 4484 B14R1.536 N#C\C(=C/c1ccc(cc1)Cl)\C(=O)O Amb1102781 [0,2,0,0,0,0|1,0,1]=4 4485 B14R1.536 N#C\C(=C/c1ccc(cc1)O)\C(=O)O Amb1136902 [0,2,0,0,0,0|1,0,1]=4 4486 B14R1.536 N#C\C(=C\c1ccc(cc1)C)\C(=O)O Amb2370592 [0,2,0,0,0,0|1,0,1]=4 4487 B14R1.536 N#C\C(=C\c1ccc(cc1)F)\C(=O)O Amb2370578 [0,2,0,0,0,0|1,0,1]=4 4488 B14R1.536 NCC(Cc1ccc(Cl)cc1)C(O)=O Amb19321135 [0,2,0,0,0,0|1,0,1]=4 4489 B14R1.536 N\N=C(\Cc1ccc(O)cc1)/C(O)=O Amb25288151 [0,2,0,0,0,0|1,0,0]=3 4490 B14R1.536 Nc1ccc(\C=C(\C#N)/C(O)=O)cc1 Amb25701392 [0,2,0,0,0,0|1,0,1]=4 4491 B14R1.536 OC(=O)\C(\Cc1ccc(Cl)cc1)=N/O Amb23603648 [0,2,0,0,0,0|0,0,1]=3 4492 B14R1.536 OC(=O)\C(\Cc1ccc(F)cc1)=N/O Amb23603649 [0,2,0,0,0,0|0,0,1]=3 4493 B14R1.536 Oc1ccc(C\C(=N/O)\C(O)=O)cc1 Amb24722830 [0,2,0,0,0,0|0,0,1]=3 4494 B14R1.686 CC(=C)C(=O)Cc1cc(Cl)c(Cl)cc1 Amb24627608 [0,2,0,0,0,0|2,0,0]=4 4495 B14R1.686 CC(=C)C(=O)Cc1cc(F)c(F)cc1 Amb24362897 [0,2,0,0,0,0|2,0,0]=4 4496 B14R1.686 CC(=C)C(=O)Cc1ccc(Cl)c(F)c1 Amb24387197 [0,2,0,0,0,0|2,0,0]=4 4497 B14R1.686 CC(=C)C(=O)Cc1ccc(F)c(Cl)c1 Amb24752806 [0,2,0,0,0,0|2,0,0]=4 4498 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)Br)C Amb17414694 [0,2,0,0,0,0|2,0,0]=4 4499 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)C)Br Amb17414697 [0,2,0,0,0,0|2,0,0]=4 4500 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)C)C Amb17401503 [0,2,0,0,0,0|2,0,0]=4 4501 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)Cl)C Amb17404135 [0,2,0,0,0,0|2,0,0]=4 4502 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)Cl)Cl Amb17407819 [0,2,0,0,0,0|2,0,0]=4 4503 B14R1.686 CC(=O)C(=O)Nc1ccc(c(c1)Cl)F Amb17404504 [0,2,0,0,0,0|2,0,0]=4 4504 B14R1.686 CC(Cc1cc(O)c(Br)cc1)C(O)=O Amb24593252 [0,2,0,0,0,0|1,0,1]=4 4505 B14R1.686 CC(Cc1cc(O)c(Cl)cc1)C(O)=O Amb25854276 [0,2,0,0,0,0|1,0,1]=4 4506 B14R1.686 CC(Cc1cc(O)c(F)cc1)C(O)=O Amb25084258 [0,2,0,0,0,0|1,0,1]=4 4507 B14R1.686 CC(Cc1ccc(Br)c(F)c1)C(O)=O Amb24733936 [0,2,0,0,0,0|1,0,1]=4 4508 B14R1.686 CC(Cc1ccc(F)c(Br)c1)C(O)=O Amb20629131 [0,2,0,0,0,0|1,0,1]=4 4509 B14R1.686 CC(Cc1ccc(F)c(N)c1)C(O)=O Amb24514204 [0,2,0,0,0,0|1,0,1]=4 4510 B14R1.686 CC(O)C(=O)Cc1ccc(Cl)c(F)c1 Amb25813426 [0,2,0,0,0,0|1,0,1]=4 4511 B14R1.686 CC(O)C(=O)Cc1ccc(F)c(Br)c1 Amb24734474 [0,2,0,0,0,0|1,0,1]=4 4512 B14R1.686 CC1=CN(CC(=C)C(O)=O)C=CC1=O Amb25854485 [0,2,0,0,0,0|2,0,0]=4 4513 B14R1.686 CN1C=CC(CC(=O)C(O)=O)=CC1=O Amb24608927 [0,2,0,0,0,0|1,0,0]=3 4514 B14R1.686 C\C(=C/c1cc(F)c(F)cc1)\C(O)=O Amb24526111 [0,2,0,0,0,0|1,0,1]=4 4515 B14R1.686 C\C(=C/c1cc(O)c(I)cc1)\C(O)=O Amb25800170 [0,2,0,0,0,0|1,0,1]=4 4516 B14R1.686 C\C(=C/c1ccc(C)c(F)c1)\C(O)=O Amb24523794 [0,2,0,0,0,0|1,0,1]=4 4517 B14R1.686 C\C(=C/c1ccc(Cl)c(F)c1)\C(O)=O Amb24181899 [0,2,0,0,0,0|1,0,1]=4 4518 B14R1.686 C\C(=C/c1ccc(O)c(C)c1)\C(O)=O Amb24400271 [0,2,0,0,0,0|1,0,1]=4 4519 B14R1.686 C\C(=C\c1cc(Br)c(Br)cc1)\C(O)=O Amb25754512 [0,2,0,0,0,0|1,0,1]=4 4520 B14R1.686 C\C(=C\c1cc(Cl)c(Cl)cc1)\C(O)=O Amb25181901 [0,2,0,0,0,0|1,0,1]=4 4521 B14R1.686 C\C(=C\c1cc(F)c(F)cc1)\C(O)=O Amb25691892 [0,2,0,0,0,0|1,0,1]=4 4522 B14R1.686 C\C(=C\c1ccc(C)c(Br)c1)\C(O)=O Amb24701673 [0,2,0,0,0,0|1,0,1]=4 4523 B14R1.686 C\C(=C\c1ccc(C)c(C)c1)\C(O)=O Amb25764770 [0,2,0,0,0,0|1,0,1]=4 4524 B14R1.686 C\C(=C\c1ccc(O)c(Cl)c1)\C(O)=O Amb25086769 [0,2,0,0,0,0|1,0,1]=4 4525 B14R1.686 C\C(=N\c1ccc(N)c(N)c1)\C(O)=O Amb25274077 [0,2,0,0,0,0|2,0,0]=4 4526 B14R1.686 Cc1cc(CC(=N)C(N)=O)ccc1C Amb24498293 [0,2,0,0,0,0|2,0,0]=4 4527 B14R1.686 Cc1cc(CC(=O)C(C)O)ccc1C Amb25687212 [0,2,0,0,0,0|1,0,1]=4 4528 B14R1.686 Cc1cc(CC(=O)C(O)=O)c[n]c1N Amb24650894 [0,2,0,0,0,0|1,0,0]=3 4529 B14R1.686 Cc1cc(CC(=O)C(O)=O)ccc1Br Amb25054918 [0,2,0,0,0,0|0,0,0]=2 4530 B14R1.686 Cc1cc(CC(=O)C(O)=O)ccc1F Amb18295687 [0,2,0,0,0,0|0,0,0]=2 4531 B14R1.686 Cc1cc(CC(Br)C(O)=O)ccc1C Amb23320609 [0,2,0,0,0,0|1,0,1]=4 4532 B14R1.686 Cc1cc(CC(C)C(O)=O)ccc1F Amb25807813 [0,2,0,0,0,0|1,0,1]=4 4533 B14R1.686 Cc1cc(CC(C)C(O)=O)ccc1O Amb25028881 [0,2,0,0,0,0|1,0,1]=4 4534 B14R1.686 Cc1cc(CC(F)C(O)=O)ccc1F Amb25103157 [0,2,0,0,0,0|1,0,1]=4 4535 B14R1.686 Cc1cc(CC(N)C(O)=O)ccc1Cl Amb22043837 [0,2,0,0,0,0|1,0,1]=4 4536 B14R1.686 Cc1cc(CC(N)C(O)=O)ccc1F Amb18300563 [0,2,0,0,0,0|1,0,1]=4 4537 B14R1.686 Cc1cc(CC(O)C(O)=O)ccc1C Amb24726250 [0,2,0,0,0,0|0,0,2]=4 4538 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1C Amb19061741 [0,2,0,0,0,0|1,0,1]=4 4539 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1F Amb18325205 [0,2,0,0,0,0|1,0,1]=4 4540 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1I Amb25112678 [0,2,0,0,0,0|1,0,1]=4 4541 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1N Amb25326363 [0,2,0,0,0,0|1,0,1]=4 4542 B14R1.686 Cc1cc(C[C@@H](N)C(O)=O)ccc1O Amb25814510 [0,2,0,0,0,0|1,0,1]=4 4543 B14R1.686 Cc1cc(C[C@H](N)C(O)=O)ccc1N Amb25127940 [0,2,0,0,0,0|1,0,1]=4 4544 B14R1.686 Cc1cc(C[C@H](N)C(O)=O)ccc1O Amb24655787 [0,2,0,0,0,0|1,0,1]=4 4545 B14R1.686 Cc1cc(\C=C(\N)/C(O)=O)ccc1F Amb25790261 [0,2,0,0,0,0|1,0,1]=4 4546 B14R1.686 Cc1cc(ccc1Cl)NC(=O)C(O)=O Amb25320622 [0,2,0,0,0,0|1,0,0]=3 4547 B14R1.686 Cc1cc(ccc1F)NC(=O)C(O)=O Amb18964954 [0,2,0,0,0,0|1,0,0]=3 4548 B14R1.686 Cc1ccc(CC(=O)C(O)=O)cc1Br Amb25692628 [0,2,0,0,0,0|0,0,0]=2 4549 B14R1.686 Cc1ccc(CC(Br)C(O)=O)cc1Cl Amb23320628 [0,2,0,0,0,0|1,0,1]=4 4550 B14R1.686 Cc1ccc(CC(C)C(O)=O)cc1Cl Amb25827789 [0,2,0,0,0,0|1,0,1]=4 4551 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1Cl Amb24756671 [0,2,0,0,0,0|1,0,1]=4 4552 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1F Amb22047660 [0,2,0,0,0,0|1,0,1]=4 4553 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1I Amb25758874 [0,2,0,0,0,0|1,0,1]=4 4554 B14R1.686 Cc1ccc(CC(N)C(O)=O)cc1O Amb25840843 [0,2,0,0,0,0|1,0,1]=4 4555 B14R1.686 Cc1ccc(CC(O)C(O)=O)cc1Br Amb24339477 [0,2,0,0,0,0|0,0,2]=4 4556 B14R1.686 Cc1ccc(CC(O)C(O)=O)cc1Cl Amb24456663 [0,2,0,0,0,0|0,0,2]=4 4557 B14R1.686 Cc1ccc(C[C@@H](N)C(O)=O)cc1F Amb24643475 [0,2,0,0,0,0|1,0,1]=4 4558 B14R1.686 Cc1ccc(C[C@@H](N)C(O)=O)cc1I Amb24715553 [0,2,0,0,0,0|1,0,1]=4 4559 B14R1.686 Cc1ccc(C[C@@H](N)C(O)=O)cc1O Amb25814511 [0,2,0,0,0,0|1,0,1]=4 4560 B14R1.686 Cc1ccc(C[C@@H](O)C(O)=O)cc1Cl Amb25817647 [0,2,0,0,0,0|0,0,2]=4 4561 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1Br Amb24336188 [0,2,0,0,0,0|1,0,1]=4 4562 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1F Amb25340927 [0,2,0,0,0,0|1,0,1]=4 4563 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1N Amb24521109 [0,2,0,0,0,0|1,0,1]=4 4564 B14R1.686 Cc1ccc(C[C@H](N)C(O)=O)cc1O Amb24376614 [0,2,0,0,0,0|1,0,1]=4 4565 B14R1.686 Cc1ccc(\C=C(\F)/C(O)=O)cc1Br Amb24535873 [0,2,0,0,0,0|1,0,1]=4 4566 B14R1.686 Cc1ccc(\C=C(\F)/C(O)=O)cc1F Amb25113160 [0,2,0,0,0,0|1,0,1]=4 4567 B14R1.686 Cc1ccc(\C=C(\N)/C(O)=O)cc1Cl Amb24436998 [0,2,0,0,0,0|1,0,1]=4 4568 B14R1.686 Cc1ccc(\C=C(\N)/C(O)=O)cc1F Amb24370813 [0,2,0,0,0,0|1,0,1]=4 4569 B14R1.686 Cc1ccc(cc1N)NC(=O)C(N)=O Amb25053327 [0,2,0,0,0,0|2,0,0]=4 4570 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)C Amb1029551 [0,2,0,0,0,0|2,0,0]=4 4571 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)Cl Amb1859947 [0,2,0,0,0,0|2,0,0]=4 4572 B14R1.686 NC(=O)C(=O)Nc1ccc(c(c1)Cl)F Amb10581201 [0,2,0,0,0,0|2,0,0]=4 4573 B14R1.686 NC(CC1=CC(=O)C(=O)C=C1)C(O)=O Amb25111133 [0,2,0,0,0,0|1,0,1]=4 4574 B14R1.686 NC(Cc1cc(O)c(Br)cc1)C(O)=O Amb18668187 [0,2,0,0,0,0|1,0,1]=4 4575 B14R1.686 NC(Cc1cc(O)c(Cl)cc1)C(O)=O Amb25844062 [0,2,0,0,0,0|1,0,1]=4 4576 B14R1.686 NC(Cc1cc(O)c(F)cc1)C(O)=O Amb24117508 [0,2,0,0,0,0|1,0,1]=4 4577 B14R1.686 NC(Cc1cc(O)c(F)cc1)C(O)=O Amb24671256 [0,2,0,0,0,0|1,0,1]=4 4578 B14R1.686 NC(Cc1ccc(Cl)c(F)c1)C(O)=O Amb18300562 [0,2,0,0,0,0|1,0,1]=4 4579 B14R1.686 NC(Cc1ccc(F)c(Cl)c1)C(O)=O Amb18226045 [0,2,0,0,0,0|1,0,1]=4 4580 B14R1.686 NC(Cc1ccc(F)c(Cl)c1)C(O)=O Amb22047584 [0,2,0,0,0,0|1,0,1]=4 4581 B14R1.686 NC(Cc1ccc(I)c(Br)c1)C(O)=O Amb24731762 [0,2,0,0,0,0|1,0,1]=4 4582 B14R1.686 NC(Cc1ccc(I)c(F)c1)C(O)=O Amb24451684 [0,2,0,0,0,0|1,0,1]=4 4583 B14R1.686 NC(Cc1ccc(O)c(Br)c1)C(O)=O Amb20243421 [0,2,0,0,0,0|1,0,1]=4 4584 B14R1.686 NC(Cc1ccc(O)c(Cl)c1)C(O)=O Amb22349804 [0,2,0,0,0,0|1,0,1]=4 4585 B14R1.686 N[C@@H](CC=1C=CC(=O)C(=N)C1)C(O)=O Amb25668485 [0,2,0,0,0,0|1,0,1]=4 4586 B14R1.686 N[C@@H](Cc1cc(O)c(Br)cc1)C(O)=O Amb25140963 [0,2,0,0,0,0|1,0,1]=4 4587 B14R1.686 N[C@@H](Cc1cc(O)c(Cl)cc1)C(O)=O Amb25785694 [0,2,0,0,0,0|1,0,1]=4 4588 B14R1.686 N[C@@H](Cc1cc(O)c(O)cc1)C(O)=O Amb25671225 [0,2,0,0,0,0|1,0,1]=4 4589 B14R1.686 N[C@@H](Cc1ccc(Br)c(F)c1)C(O)=O Amb25095944 [0,2,0,0,0,0|1,0,1]=4 4590 B14R1.686 N[C@@H](Cc1ccc(Br)c(I)c1)C(O)=O Amb25125922 [0,2,0,0,0,0|1,0,1]=4 4591 B14R1.686 N[C@@H](Cc1ccc(Cl)c(F)c1)C(O)=O Amb25856705 [0,2,0,0,0,0|1,0,1]=4 4592 B14R1.686 N[C@@H](Cc1ccc(Cl)c(I)c1)C(O)=O Amb25082084 [0,2,0,0,0,0|1,0,1]=4 4593 B14R1.686 N[C@@H](Cc1ccc(F)c(Cl)c1)C(O)=O Amb25194777 [0,2,0,0,0,0|1,0,1]=4 4594 B14R1.686 N[C@@H](Cc1ccc(I)c(Br)c1)C(O)=O Amb25748106 [0,2,0,0,0,0|1,0,1]=4 4595 B14R1.686 N[C@@H](Cc1ccc(I)c(F)c1)C(O)=O Amb25375913 [0,2,0,0,0,0|1,0,1]=4 4596 B14R1.686 N[C@@H](Cc1ccc(O)c(Br)c1)C(O)=O Amb22229234 [0,2,0,0,0,0|1,0,1]=4 4597 B14R1.686 N[C@@H](Cc1ccc(O)c(S)c1)C(O)=O Amb25782038 [0,2,0,0,0,0|1,0,1]=4 4598 B14R1.686 N[C@H](CC1=CC(=O)C(=O)C=C1)C(O)=O Amb25274975 [0,2,0,0,0,0|1,0,1]=4 4599 B14R1.686 N[C@H](Cc1cc(Br)c(Br)cc1)C(O)=O Amb25665238 [0,2,0,0,0,0|1,0,1]=4 4600 B14R1.686 N[C@H](Cc1ccc(Br)c(Cl)c1)C(O)=O Amb25794884 [0,2,0,0,0,0|1,0,1]=4 4601 B14R1.686 N[C@H](Cc1ccc(Cl)c(Br)c1)C(O)=O Amb24670160 [0,2,0,0,0,0|1,0,1]=4 4602 B14R1.686 N[C@H](Cc1ccc(Cl)c(F)c1)C(O)=O Amb24510514 [0,2,0,0,0,0|1,0,1]=4 4603 B14R1.686 N[C@H](Cc1ccc(I)c(Br)c1)C(O)=O Amb24682403 [0,2,0,0,0,0|1,0,1]=4 4604 B14R1.686 N[C@H](Cc1ccc(I)c(Cl)c1)C(O)=O Amb25313163 [0,2,0,0,0,0|1,0,1]=4 4605 B14R1.686 N[C@H](Cc1ccc(O)c(Br)c1)C(O)=O Amb22229233 [0,2,0,0,0,0|1,0,1]=4 4606 B14R1.686 N\C(=C\c1cc(Cl)c(Cl)cc1)\C(O)=O Amb24728103 [0,2,0,0,0,0|1,0,1]=4 4607 B14R1.686 Nc1cc(CC(N)C(O)=O)ccc1N Amb18652146 [0,2,0,0,0,0|1,0,1]=4 4608 B14R1.686 Nc1cc(CC(N)C(O)=O)ccc1O Amb22229179 [0,2,0,0,0,0|1,0,1]=4 4609 B14R1.686 Nc1cc(CC(N)C(O)=O)ccc1O Amb22492604 [0,2,0,0,0,0|1,0,1]=4 4610 B14R1.686 Nc1cc(CC(O)C(O)=O)ccc1O Amb24710411 [0,2,0,0,0,0|0,0,2]=4 4611 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1Br Amb25342348 [0,2,0,0,0,0|1,0,1]=4 4612 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1Cl Amb25744448 [0,2,0,0,0,0|1,0,1]=4 4613 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1F Amb24595720 [0,2,0,0,0,0|1,0,1]=4 4614 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1O Amb22750576 [0,2,0,0,0,0|1,0,1]=4 4615 B14R1.686 Nc1cc(C[C@@H](N)C(O)=O)ccc1O Amb22755065 [0,2,0,0,0,0|1,0,1]=4 4616 B14R1.686 Nc1cc(C[C@@H](O)C(O)=O)ccc1O Amb24498396 [0,2,0,0,0,0|0,0,2]=4 4617 B14R1.686 Nc1cc(C[C@H](N)C(O)=O)ccc1Br Amb24402259 [0,2,0,0,0,0|1,0,1]=4 4618 B14R1.686 Nc1cc(C[C@H](N)C(O)=O)ccc1N Amb25757131 [0,2,0,0,0,0|1,0,1]=4 4619 B14R1.686 Nc1ccc(CC(N)C(O)=O)cc1Br Amb25705138 [0,2,0,0,0,0|1,0,1]=4 4620 B14R1.686 Nc1ccc(CC(N)C(O)=O)cc1O Amb22054329 [0,2,0,0,0,0|1,0,1]=4 4621 B14R1.686 Nc1ccc(C[C@@H](N)C(O)=O)cc1Br Amb25342211 [0,2,0,0,0,0|1,0,1]=4 4622 B14R1.686 Nc1ccc(C[C@@H](N)C(O)=O)cc1O Amb25759725 [0,2,0,0,0,0|1,0,1]=4 4623 B14R1.686 Nc1ccc(C[C@H](N)C(O)=O)cc1F Amb24351132 [0,2,0,0,0,0|1,0,1]=4 4624 B14R1.686 Nc1ccc(C[C@H](N)C(O)=O)cc1O Amb24094583 [0,2,0,0,0,0|1,0,1]=4 4625 B14R1.686 OC(=O)C(=O)Cc1ccc(Br)c(Cl)c1 Amb25220059 [0,2,0,0,0,0|0,0,0]=2 4626 B14R1.686 OC(=O)C(=O)Cc1ccc(Br)c(F)c1 Amb24591367 [0,2,0,0,0,0|0,0,0]=2 4627 B14R1.686 OC(=O)C(=O)Cc1ccc(Cl)c(Br)c1 Amb25134658 [0,2,0,0,0,0|0,0,0]=2 4628 B14R1.686 OC(=O)C(=O)Cc1ccc(Cl)c(F)c1 Amb18980641 [0,2,0,0,0,0|0,0,0]=2 4629 B14R1.686 OC(=O)C(=O)Cc1ccc(F)c(Cl)c1 Amb24462337 [0,2,0,0,0,0|0,0,0]=2 4630 B14R1.686 OC(=O)C(=O)Cc1ccc(O)c(Cl)c1 Amb18980953 [0,2,0,0,0,0|0,0,0]=2 4631 B14R1.686 OC(=O)C(=O)Cc1ccc(O)c(F)c1 Amb24655684 [0,2,0,0,0,0|0,0,0]=2 4632 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)Br)F Amb1133011 [0,2,0,0,0,0|0,0,0]=2 4633 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)Cl)Cl Amb1126045 [0,2,0,0,0,0|0,0,0]=2 4634 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)F)F Amb1138787 [0,2,0,0,0,0|0,0,0]=2 4635 B14R1.686 OC(=O)C(=O)Cc1ccc(c(c1)O)O Amb1127083 [0,2,0,0,0,0|0,0,0]=2 4636 B14R1.686 OC(=O)C(=O)Nc1ccc(Br)c(Cl)c1 Amb25096575 [0,2,0,0,0,0|1,0,0]=3 4637 B14R1.686 OC(=O)C(=O)Nc1ccc(Br)c(F)c1 Amb25663968 [0,2,0,0,0,0|1,0,0]=3 4638 B14R1.686 OC(=O)C(=O)Nc1ccc(Br)c(I)c1 Amb25853581 [0,2,0,0,0,0|1,0,0]=3 4639 B14R1.686 OC(=O)C(=O)Nc1ccc(Cl)c(Br)c1 Amb24398945 [0,2,0,0,0,0|1,0,0]=3 4640 B14R1.686 OC(=O)C(=O)Nc1ccc(Cl)c(F)c1 Amb18954770 [0,2,0,0,0,0|1,0,0]=3 4641 B14R1.686 OC(=O)C(=O)Nc1ccc(I)c(Br)c1 Amb25774257 [0,2,0,0,0,0|1,0,0]=3 4642 B14R1.686 OC(=O)C(=O)Nc1ccc(c(c1)Br)C Amb17048360 [0,2,0,0,0,0|1,0,0]=3 4643 B14R1.686 OC(=O)C(=O)Nc1ccc(c(c1)C)C Amb1105585 [0,2,0,0,0,0|1,0,0]=3 4644 B14R1.686 OC(=O)C(Br)Cc1cc(F)c(F)cc1 Amb25854960 [0,2,0,0,0,0|1,0,1]=4 4645 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Br)C)Cl Amb17204947 [0,2,0,0,0,0|1,0,1]=4 4646 B14R1.686 OC(=O)C(Cc1ccc(c(c1)C)Br)Cl Amb17204950 [0,2,0,0,0,0|1,0,1]=4 4647 B14R1.686 OC(=O)C(Cc1ccc(c(c1)C)C)C Amb17605829 [0,2,0,0,0,0|1,0,1]=4 4648 B14R1.686 OC(=O)C(Cc1ccc(c(c1)C)C)Cl Amb17204442 [0,2,0,0,0,0|1,0,1]=4 4649 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)C)Cl Amb17204588 [0,2,0,0,0,0|1,0,1]=4 4650 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)Cl)Br Amb10576762 [0,2,0,0,0,0|1,0,1]=4 4651 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)Cl)C Amb17605797 [0,2,0,0,0,0|1,0,1]=4 4652 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)Cl)Cl Amb17204773 [0,2,0,0,0,0|1,0,1]=4 4653 B14R1.686 OC(=O)C(Cc1ccc(c(c1)Cl)F)Cl Amb17204626 [0,2,0,0,0,0|1,0,1]=4 4654 B14R1.686 OC(=O)C(Cc1ccc(c(c1)F)F)Cl Amb17204501 [0,2,0,0,0,0|1,0,1]=4 4655 B14R1.686 OC(=O)C(Cc1ccc(c(c1)F)O)C Amb10844160 [0,2,0,0,0,0|1,0,1]=4 4656 B14R1.686 OC(=O)C(Cc1ccc(c(c1)I)O)N Amb16204813 [0,2,0,0,0,0|1,0,1]=4 4657 B14R1.686 OC(=O)C(Cc1ccc(c(c1)O)O)N Amb1216479 [0,2,0,0,0,0|1,0,1]=4 4658 B14R1.686 OC(=O)C(F)Cc1cc(F)c(Cl)cc1 Amb25200731 [0,2,0,0,0,0|1,0,1]=4 4659 B14R1.686 OC(=O)C(F)Cc1ccc(Cl)c(Br)c1 Amb25200807 [0,2,0,0,0,0|1,0,1]=4 4660 B14R1.686 OC(=O)C(F)Cc1ccc(F)c(Br)c1 Amb24586120 [0,2,0,0,0,0|1,0,1]=4 4661 B14R1.686 OC(=O)C(F)Cc1ccc(F)c(Cl)c1 Amb25096720 [0,2,0,0,0,0|1,0,1]=4 4662 B14R1.686 OC(=O)C(O)Cc1cc(Cl)c(Cl)cc1 Amb24094048 [0,2,0,0,0,0|0,0,2]=4 4663 B14R1.686 OC(=O)C(O)Cc1cc(F)c(F)cc1 Amb25059600 [0,2,0,0,0,0|0,0,2]=4 4664 B14R1.686 OC(=O)C(O)Cc1ccc(F)c(Br)c1 Amb24570493 [0,2,0,0,0,0|0,0,2]=4 4665 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)Cl)O)N Amb16231682 [0,2,0,0,0,0|1,0,1]=4 4666 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)F)O)N Amb10839960 [0,2,0,0,0,0|1,0,1]=4 4667 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)I)O)N Amb10072403 [0,2,0,0,0,0|1,0,1]=4 4668 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)N)O)N Amb10072243 [0,2,0,0,0,0|1,0,1]=4 4669 B14R1.686 OC(=O)[C@@H](Cc1ccc(c(c1)O)O)N Amb17613565 [0,2,0,0,0,0|1,0,1]=4 4670 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)C)C)N Amb16231648 [0,2,0,0,0,0|1,0,1]=4 4671 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)Cl)O)N Amb16233351 [0,2,0,0,0,0|1,0,1]=4 4672 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)F)F)C Amb10844146 [0,2,0,0,0,0|1,0,1]=4 4673 B14R1.686 OC(=O)[C@H](Cc1ccc(c(c1)N)O)N Amb16231672 [0,2,0,0,0,0|1,0,1]=4 4674 B14R1.686 OC(=O)\C(\F)=C\c1cc(Br)c(Br)cc1 Amb25691274 [0,2,0,0,0,0|1,0,1]=4 4675 B14R1.686 OC(=O)\C(\F)=C\c1cc(Cl)c(Cl)cc1 Amb25340295 [0,2,0,0,0,0|1,0,1]=4 4676 B14R1.686 OC(=O)\C(\F)=C\c1cc(F)c(F)cc1 Amb25664445 [0,2,0,0,0,0|1,0,1]=4 4677 B14R1.686 OC(=O)\C(\F)=C\c1ccc(Cl)c(Br)c1 Amb24368272 [0,2,0,0,0,0|1,0,1]=4 4678 B14R1.686 O[C@@H](Cc1cc(O)c(O)cc1)C(O)=O Amb22747075 [0,2,0,0,0,0|0,0,2]=4 4679 B14R1.686 O[C@H](Cc1cc(O)c(O)cc1)C(O)=O Amb24629166 [0,2,0,0,0,0|0,0,2]=4 4680 B14R1.686 Oc1cc(CC(F)C(O)=O)ccc1O Amb25790634 [0,2,0,0,0,0|1,0,1]=4 4681 B14R1.686 Oc1cc(\C=C(/Cl)\C(O)=O)ccc1O Amb24336705 [0,2,0,0,0,0|1,0,1]=4 4682 B14R1.686 Oc1cc(\C=C(/F)\C(O)=O)ccc1O Amb25664572 [0,2,0,0,0,0|1,0,1]=4 4683 B14R1.686 Oc1ccc(CC(F)C(O)=O)cc1F Amb25219647 [0,2,0,0,0,0|1,0,1]=4 4684 B14R1.686 Oc1ccc(CC(O)C(O)=O)cc1F Amb25220163 [0,2,0,0,0,0|0,0,2]=4 4685 B14R1.686 Oc1ccc(\C=C(/F)\C(O)=O)cc1F Amb25186268 [0,2,0,0,0,0|1,0,1]=4 4686 B14R1.686 [O-]C(=O)C(=O)Cc1cc(O)c(O)cc1 Amb22899774 [0,2,0,0,0,0|0,0,1]=3 4687 B14R1.700 CC(C)(O)C(=O)Cc1ccc(Br)cc1 Amb25683074 [0,2,0,0,0,0|1,0,1]=4 4688 B14R1.700 CC(C)(O)C(=O)Cc1ccc(Cl)cc1 Amb24402133 [0,2,0,0,0,0|1,0,1]=4 4689 B14R1.700 CC(C)(O)C(=O)Cc1ccc(I)cc1 Amb25280577 [0,2,0,0,0,0|1,0,1]=4 4690 B14R1.700 Cc1ccc(CC(=O)C(C)(C)O)cc1 Amb25349833 [0,2,0,0,0,0|1,0,1]=4 4691 B14R1.6049 Brc1ccc(c(c1)C)NC(=O)C(=O)C Amb17414696 [0,2,0,0,0,0|2,0,0]=4 4692 B14R1.6049 CC(=C)C(=O)Cc1ccc(F)cc1Br Amb24662866 [0,2,0,0,0,0|2,0,0]=4 4693 B14R1.6049 CC(=C)C(=O)Cc1ccc(F)cc1F Amb25047578 [0,2,0,0,0,0|2,0,0]=4 4694 B14R1.6049 CC(=O)C(=O)Cc1ccc(C)cc1C Amb24405914 [0,2,0,0,0,0|1,0,0]=3 4695 B14R1.6049 CC(=O)C(=O)Cc1ccc(Cl)cc1Cl Amb24554770 [0,2,0,0,0,0|1,0,0]=3 4696 B14R1.6049 CC(Cc1ccc(Cl)cc1Br)C(O)=O Amb25028936 [0,2,0,0,0,0|1,0,1]=4 4697 B14R1.6049 CC(Cc1ccc(Cl)cc1F)C(O)=O Amb24463169 [0,2,0,0,0,0|1,0,1]=4 4698 B14R1.6049 CC(Cc1ccc(F)cc1Br)C(O)=O Amb24502990 [0,2,0,0,0,0|1,0,1]=4 4699 B14R1.6049 CC(Cc1ccc(F)cc1Cl)C(O)=O Amb25849479 [0,2,0,0,0,0|1,0,1]=4 4700 B14R1.6049 CC(O)C(=O)Cc1ccc(Br)cc1F Amb24730370 [0,2,0,0,0,0|1,0,1]=4 4701 B14R1.6049 CC(O)C(=O)Cc1ccc(F)cc1F Amb24402134 [0,2,0,0,0,0|1,0,1]=4 4702 B14R1.6049 C[C@H](Cc1ccc(Cl)cc1F)C(O)=O Amb24668899 [0,2,0,0,0,0|1,0,1]=4 4703 B14R1.6049 C\C(=C/c1ccc(C)cc1C)\C(O)=O Amb24654861 [0,2,0,0,0,0|1,0,1]=4 4704 B14R1.6049 C\C(=C/c1ccc(C)cc1F)\C(O)=O Amb24427557 [0,2,0,0,0,0|1,0,1]=4 4705 B14R1.6049 C\C(=C/c1ccc(F)cc1Br)\C(O)=O Amb24386733 [0,2,0,0,0,0|1,0,1]=4 4706 B14R1.6049 C\C(=C/c1ccc(F)cc1F)\C(O)=O Amb24761428 [0,2,0,0,0,0|1,0,1]=4 4707 B14R1.6049 C\C(=C/c1ccc(F)cc1O)\C(O)=O Amb24468684 [0,2,0,0,0,0|1,0,1]=4 4708 B14R1.6049 C\C(=C/c1ccc(O)cc1Cl)\C(O)=O Amb25105010 [0,2,0,0,0,0|1,0,1]=4 4709 B14R1.6049 C\C(=C\c1ccc(Br)cc1Cl)\C(O)=O Amb25823248 [0,2,0,0,0,0|1,0,1]=4 4710 B14R1.6049 C\C(=C\c1ccc(Br)cc1F)\C(O)=O Amb24751320 [0,2,0,0,0,0|1,0,1]=4 4711 B14R1.6049 C\C(=C\c1ccc(C)cc1C)\C(O)=O Amb25828808 [0,2,0,0,0,0|1,0,1]=4 4712 B14R1.6049 C\C(=C\c1ccc(C)cc1O)\C(O)=O Amb25300460 [0,2,0,0,0,0|1,0,1]=4 4713 B14R1.6049 C\C(=C\c1ccc(Cl)cc1F)\C(O)=O Amb25122326 [0,2,0,0,0,0|1,0,1]=4 4714 B14R1.6049 C\C(=C\c1ccc(Cl)cc1N)\C(O)=O Amb24613479 [0,2,0,0,0,0|1,0,1]=4 4715 B14R1.6049 C\C(=C\c1ccc(F)cc1Br)\C(O)=O Amb25712560 [0,2,0,0,0,0|1,0,1]=4 4716 B14R1.6049 C\C(=C\c1ccc(F)cc1F)\C(O)=O Amb24722128 [0,2,0,0,0,0|1,0,1]=4 4717 B14R1.6049 C\C(=C\c1ccc(F)cc1O)\C(O)=O Amb25210685 [0,2,0,0,0,0|1,0,1]=4 4718 B14R1.6049 C\C(=C\c1ccc(O)cc1Cl)\C(O)=O Amb25211005 [0,2,0,0,0,0|1,0,1]=4 4719 B14R1.6049 C\C(=C\c1ccc(O)cc1O)\C(O)=O Amb25238013 [0,2,0,0,0,0|1,0,1]=4 4720 B14R1.6049 Cc1cc(Br)ccc1C[C@H](N)C(O)=O Amb24421163 [0,2,0,0,0,0|1,0,1]=4 4721 B14R1.6049 Cc1cc(Br)ccc1\C=C(\C)/C(O)=O Amb25698668 [0,2,0,0,0,0|1,0,1]=4 4722 B14R1.6049 Cc1cc(C)ccc1\C=C(\F)/C(O)=O Amb25142378 [0,2,0,0,0,0|1,0,1]=4 4723 B14R1.6049 Cc1cc(Cl)c[n]c1NC(=O)C(O)=O Amb25673444 [0,2,0,0,0,0|2,0,0]=4 4724 B14R1.6049 Cc1cc(Cl)ccc1CC(=O)C(O)=O Amb25028752 [0,2,0,0,0,0|0,0,0]=2 4725 B14R1.6049 Cc1cc(Cl)ccc1CC(Br)C(O)=O Amb23320626 [0,2,0,0,0,0|1,0,1]=4 4726 B14R1.6049 Cc1cc(Cl)ccc1CC(N)C(O)=O Amb25732389 [0,2,0,0,0,0|1,0,1]=4 4727 B14R1.6049 Cc1cc(Cl)ccc1NC(=N)C(O)=O Amb25798323 [0,2,0,0,0,0|2,0,0]=4 4728 B14R1.6049 Cc1cc(Cl)ccc1\C=C(\C)/C(O)=O Amb25754539 [0,2,0,0,0,0|1,0,1]=4 4729 B14R1.6049 Cc1cc(Cl)ccc1\C=C(\F)/C(O)=O Amb24416795 [0,2,0,0,0,0|1,0,1]=4 4730 B14R1.6049 Cc1cc(F)ccc1CC(=O)C(C)=C Amb24408781 [0,2,0,0,0,0|2,0,0]=4 4731 B14R1.6049 Cc1cc(F)ccc1CC(=O)C(C)O Amb24464860 [0,2,0,0,0,0|1,0,1]=4 4732 B14R1.6049 Cc1cc(F)ccc1CC(=O)C(O)=O Amb18986590 [0,2,0,0,0,0|0,0,0]=2 4733 B14R1.6049 Cc1cc(F)ccc1CC(N)C(O)=O Amb18995883 [0,2,0,0,0,0|1,0,1]=4 4734 B14R1.6049 Cc1cc(F)ccc1C[C@@H](N)C(O)=O Amb18325206 [0,2,0,0,0,0|1,0,1]=4 4735 B14R1.6049 Cc1cc(F)ccc1C[C@H](N)C(O)=O Amb25309017 [0,2,0,0,0,0|1,0,1]=4 4736 B14R1.6049 Cc1cc(N)ccc1CC(N)C(O)=O Amb25670989 [0,2,0,0,0,0|1,0,1]=4 4737 B14R1.6049 Cc1cc(N)ccc1C[C@H](N)C(O)=O Amb24714719 [0,2,0,0,0,0|1,0,1]=4 4738 B14R1.6049 Cc1cc(O)c(C[C@H](N)C(O)=O)cc1 Amb25749763 [0,2,0,0,0,0|1,0,1]=4 4739 B14R1.6049 Cc1cc(O)ccc1CC(Cl)C(O)=O Amb25801019 [0,2,0,0,0,0|1,0,1]=4 4740 B14R1.6049 Cc1cc(O)ccc1NC(=O)C(O)=O Amb22457252 [0,2,0,0,0,0|1,0,0]=3 4741 B14R1.6049 Cc1ccc(CC(=O)C(C)O)c(Cl)c1 Amb25856503 [0,2,0,0,0,0|1,0,1]=4 4742 B14R1.6049 Cc1ccc(CC(Br)C(O)=O)c(C)c1 Amb23320605 [0,2,0,0,0,0|1,0,1]=4 4743 B14R1.6049 Cc1ccc(CC(C)C(O)=O)c(C)c1 Amb24498055 [0,2,0,0,0,0|1,0,1]=4 4744 B14R1.6049 Cc1ccc(CC(C)C(O)=O)c(Cl)c1 Amb25251901 [0,2,0,0,0,0|1,0,1]=4 4745 B14R1.6049 Cc1ccc(CC(F)C(O)=O)c(Br)c1 Amb25352789 [0,2,0,0,0,0|1,0,1]=4 4746 B14R1.6049 Cc1ccc(CC(F)C(O)=O)c(C)c1 Amb25237498 [0,2,0,0,0,0|1,0,1]=4 4747 B14R1.6049 Cc1ccc(CC(N)C(O)=O)c(Br)c1 Amb24399395 [0,2,0,0,0,0|1,0,1]=4 4748 B14R1.6049 Cc1ccc(CC(N)C(O)=O)c(Cl)c1 Amb25744040 [0,2,0,0,0,0|1,0,1]=4 4749 B14R1.6049 Cc1ccc(CC(N)C(O)=O)c(F)c1 Amb22043806 [0,2,0,0,0,0|1,0,1]=4 4750 B14R1.6049 Cc1ccc(C[C@@H](N)C(O)=O)c(Cl)c1 Amb24452116 [0,2,0,0,0,0|1,0,1]=4 4751 B14R1.6049 Cc1ccc(C[C@H](N)C(O)=O)c(Cl)c1 Amb25730036 [0,2,0,0,0,0|1,0,1]=4 4752 B14R1.6049 Cc1ccc(C[C@H](N)C(O)=O)c(F)c1 Amb24617556 [0,2,0,0,0,0|1,0,1]=4 4753 B14R1.6049 Cc1ccc(NC(=N)C(O)=O)c(C)c1 Amb18651185 [0,2,0,0,0,0|2,0,0]=4 4754 B14R1.6049 Cc1ccc(NC(=N)C(O)=O)c(Cl)c1 Amb24680277 [0,2,0,0,0,0|2,0,0]=4 4755 B14R1.6049 Cc1ccc(c(c1)Br)NC(=O)C(=O)C Amb17414695 [0,2,0,0,0,0|2,0,0]=4 4756 B14R1.6049 Cc1ccc(c(c1)C)CC(=O)C(=O)O Amb1125553 [0,2,0,0,0,0|0,0,0]=2 4757 B14R1.6049 Cc1ccc(c(c1)C)NC(=O)C(=O)C Amb17401501 [0,2,0,0,0,0|2,0,0]=4 4758 B14R1.6049 Clc1ccc(c(c1)C)NC(=O)C(=O)C Amb17404134 [0,2,0,0,0,0|2,0,0]=4 4759 B14R1.6049 Clc1ccc(c(c1)Cl)CC(=O)C(=O)O Amb1139812 [0,2,0,0,0,0|0,0,0]=2 4760 B14R1.6049 Clc1ccc(c(c1)Cl)NC(=O)C(=O)C Amb17407820 [0,2,0,0,0,0|2,0,0]=4 4761 B14R1.6049 Clc1ccc(c(c1)Cl)NC(=O)C(=O)N Amb2408655 [0,2,0,0,0,0|2,0,0]=4 4762 B14R1.6049 Fc1ccc(c(c1)F)CC(=O)C(=O)O Amb1140150 [0,2,0,0,0,0|0,0,0]=2 4763 B14R1.6049 NC(Cc1ccc(Br)cc1Br)C(O)=O Amb24454739 [0,2,0,0,0,0|1,0,1]=4 4764 B14R1.6049 NC(Cc1ccc(Cl)cc1Br)C(O)=O Amb25376983 [0,2,0,0,0,0|1,0,1]=4 4765 B14R1.6049 NC(Cc1ccc(Cl)cc1F)C(O)=O Amb22738201 [0,2,0,0,0,0|1,0,1]=4 4766 B14R1.6049 NC(Cc1ccc(Cl)cc1I)C(O)=O Amb25275250 [0,2,0,0,0,0|1,0,1]=4 4767 B14R1.6049 NC(Cc1ccc(Cl)cc1O)C(O)=O Amb25790444 [0,2,0,0,0,0|1,0,1]=4 4768 B14R1.6049 NC(Cc1ccc(F)cc1I)C(O)=O Amb24356682 [0,2,0,0,0,0|1,0,1]=4 4769 B14R1.6049 NC(Cc1ccc(I)cc1O)C(O)=O Amb25737858 [0,2,0,0,0,0|1,0,1]=4 4770 B14R1.6049 NC(Cc1ccc(O)cc1Br)C(O)=O Amb22749906 [0,2,0,0,0,0|1,0,1]=4 4771 B14R1.6049 N[C@@H](Cc1ccc(Br)cc1Br)C(O)=O Amb24367958 [0,2,0,0,0,0|1,0,1]=4 4772 B14R1.6049 N[C@@H](Cc1ccc(Br)cc1Cl)C(O)=O Amb25103196 [0,2,0,0,0,0|1,0,1]=4 4773 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1Br)C(O)=O Amb25124932 [0,2,0,0,0,0|1,0,1]=4 4774 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1F)C(O)=O Amb22752990 [0,2,0,0,0,0|1,0,1]=4 4775 B14R1.6049 N[C@@H](Cc1ccc(Cl)cc1O)C(O)=O Amb25165000 [0,2,0,0,0,0|1,0,1]=4 4776 B14R1.6049 N[C@@H](Cc1ccc(F)cc1Br)C(O)=O Amb25254735 [0,2,0,0,0,0|1,0,1]=4 4777 B14R1.6049 N[C@@H](Cc1ccc(F)cc1Cl)C(O)=O Amb25766645 [0,2,0,0,0,0|1,0,1]=4 4778 B14R1.6049 N[C@@H](Cc1ccc(F)cc1I)C(O)=O Amb25313302 [0,2,0,0,0,0|1,0,1]=4 4779 B14R1.6049 N[C@@H](Cc1ccc(F)cc1O)C(O)=O Amb25104765 [0,2,0,0,0,0|1,0,1]=4 4780 B14R1.6049 N[C@@H](Cc1ccc(I)cc1Cl)C(O)=O Amb24587175 [0,2,0,0,0,0|1,0,1]=4 4781 B14R1.6049 N[C@@H](Cc1ccc(I)cc1F)C(O)=O Amb25076319 [0,2,0,0,0,0|1,0,1]=4 4782 B14R1.6049 N[C@@H](Cc1ccc(I)cc1O)C(O)=O Amb24394391 [0,2,0,0,0,0|1,0,1]=4 4783 B14R1.6049 N[C@@H](Cc1ccc(O)cc1Br)C(O)=O Amb25222655 [0,2,0,0,0,0|1,0,1]=4 4784 B14R1.6049 N[C@@H](Cc1ccc(O)cc1Cl)C(O)=O Amb22746045 [0,2,0,0,0,0|1,0,1]=4 4785 B14R1.6049 N[C@@H](Cc1ccc(O)cc1I)C(O)=O Amb22228858 [0,2,0,0,0,0|1,0,1]=4 4786 B14R1.6049 N[C@@H](Cc1ccc(O)cc1O)C(O)=O Amb22228337 [0,2,0,0,0,0|1,0,1]=4 4787 B14R1.6049 N[C@@H](Cc1ccc(O)cc1O)C(O)=O Amb22755431 [0,2,0,0,0,0|1,0,1]=4 4788 B14R1.6049 N[C@H](Cc1ccc(Br)cc1Br)C(O)=O Amb25676247 [0,2,0,0,0,0|1,0,1]=4 4789 B14R1.6049 N[C@H](Cc1ccc(Br)cc1O)C(O)=O Amb25798177 [0,2,0,0,0,0|1,0,1]=4 4790 B14R1.6049 N[C@H](Cc1ccc(Cl)cc1I)C(O)=O Amb24416902 [0,2,0,0,0,0|1,0,1]=4 4791 B14R1.6049 N[C@H](Cc1ccc(Cl)cc1O)C(O)=O Amb25377140 [0,2,0,0,0,0|1,0,1]=4 4792 B14R1.6049 N[C@H](Cc1ccc(F)cc1Br)C(O)=O Amb25238670 [0,2,0,0,0,0|1,0,1]=4 4793 B14R1.6049 N[C@H](Cc1ccc(F)cc1O)C(O)=O Amb24655941 [0,2,0,0,0,0|1,0,1]=4 4794 B14R1.6049 N[C@H](Cc1ccc(I)cc1Cl)C(O)=O Amb25756677 [0,2,0,0,0,0|1,0,1]=4 4795 B14R1.6049 N[C@H](Cc1ccc(I)cc1O)C(O)=O Amb24729507 [0,2,0,0,0,0|1,0,1]=4 4796 B14R1.6049 N[C@H](Cc1ccc(O)cc1Br)C(O)=O Amb24703086 [0,2,0,0,0,0|1,0,1]=4 4797 B14R1.6049 N[C@H](Cc1ccc(O)cc1F)C(O)=O Amb25181843 [0,2,0,0,0,0|1,0,1]=4 4798 B14R1.6049 N[C@H](Cc1ccc(O)cc1O)C(O)=O Amb22228336 [0,2,0,0,0,0|1,0,1]=4 4799 B14R1.6049 Nc1cc(Br)ccc1CC(N)C(O)=O Amb24437621 [0,2,0,0,0,0|1,0,1]=4 4800 B14R1.6049 Nc1cc(Br)ccc1C[C@@H](N)C(O)=O Amb25748112 [0,2,0,0,0,0|1,0,1]=4 4801 B14R1.6049 Nc1cc(Br)ccc1C[C@H](N)C(O)=O Amb24391831 [0,2,0,0,0,0|1,0,1]=4 4802 B14R1.6049 Nc1cc(Cl)ccc1CC(N)C(O)=O Amb18657750 [0,2,0,0,0,0|1,0,1]=4 4803 B14R1.6049 Nc1cc(Cl)ccc1C[C@H](N)C(O)=O Amb24662691 [0,2,0,0,0,0|1,0,1]=4 4804 B14R1.6049 Nc1cc(F)ccc1C[C@@H](N)C(O)=O Amb25088945 [0,2,0,0,0,0|1,0,1]=4 4805 B14R1.6049 Nc1ccc(CC(N)C(O)=O)c(Cl)c1 Amb24597038 [0,2,0,0,0,0|1,0,1]=4 4806 B14R1.6049 Nc1ccc(CC(N)C(O)=O)c(F)c1 Amb25276148 [0,2,0,0,0,0|1,0,1]=4 4807 B14R1.6049 Nc1ccc(CC(N)C(O)=O)c(O)c1 Amb24392157 [0,2,0,0,0,0|1,0,1]=4 4808 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(Br)c1 Amb24591786 [0,2,0,0,0,0|1,0,1]=4 4809 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(Cl)c1 Amb25364211 [0,2,0,0,0,0|1,0,1]=4 4810 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(F)c1 Amb24498927 [0,2,0,0,0,0|1,0,1]=4 4811 B14R1.6049 Nc1ccc(C[C@H](N)C(O)=O)c(O)c1 Amb25278467 [0,2,0,0,0,0|1,0,1]=4 4812 B14R1.6049 OC(=O)C(=O)Cc1ccc(Br)cc1Cl Amb25823249 [0,2,0,0,0,0|0,0,0]=2 4813 B14R1.6049 OC(=O)C(=O)Cc1ccc(Cl)cc1Br Amb25165671 [0,2,0,0,0,0|0,0,0]=2 4814 B14R1.6049 OC(=O)C(=O)Cc1ccc(Cl)cc1F Amb25167113 [0,2,0,0,0,0|0,0,0]=2 4815 B14R1.6049 OC(=O)C(=O)Nc1ccc(Cl)cc1F Amb18954785 [0,2,0,0,0,0|1,0,0]=3 4816 B14R1.6049 OC(=O)C(=O)Nc1ccc(I)cc1Cl Amb24681917 [0,2,0,0,0,0|1,0,0]=3 4817 B14R1.6049 OC(=O)C(=O)Nc1ccc(O)cc1Cl Amb22475813 [0,2,0,0,0,0|1,0,0]=3 4818 B14R1.6049 OC(=O)C(Br)Cc1ccc(F)cc1F Amb25754333 [0,2,0,0,0,0|1,0,1]=4 4819 B14R1.6049 OC(=O)C(Cc1ccc(cc1Br)C)Cl Amb17204948 [0,2,0,0,0,0|1,0,1]=4 4820 B14R1.6049 OC(=O)C(Cc1ccc(cc1C)Br)Cl Amb17204949 [0,2,0,0,0,0|1,0,1]=4 4821 B14R1.6049 OC(=O)C(Cc1ccc(cc1C)C)Cl Amb17204440 [0,2,0,0,0,0|1,0,1]=4 4822 B14R1.6049 OC(=O)C(Cc1ccc(cc1C)Cl)Cl Amb17204587 [0,2,0,0,0,0|1,0,1]=4 4823 B14R1.6049 OC(=O)C(Cc1ccc(cc1Cl)Cl)Br Amb10597007 [0,2,0,0,0,0|1,0,1]=4 4824 B14R1.6049 OC(=O)C(Cc1ccc(cc1Cl)Cl)C Amb17605799 [0,2,0,0,0,0|1,0,1]=4 4825 B14R1.6049 OC(=O)C(Cc1ccc(cc1F)F)C Amb17605827 [0,2,0,0,0,0|1,0,1]=4 4826 B14R1.6049 OC(=O)C(Cc1ccc(cc1F)F)Cl Amb17204500 [0,2,0,0,0,0|1,0,1]=4 4827 B14R1.6049 OC(=O)C(Cc1ccc(cc1N)O)N Amb16767184 [0,2,0,0,0,0|1,0,1]=4 4828 B14R1.6049 OC(=O)C(F)Cc1ccc(Cl)cc1F Amb24717270 [0,2,0,0,0,0|1,0,1]=4 4829 B14R1.6049 OC(=O)C(F)Cc1ccc(F)cc1Cl Amb25213697 [0,2,0,0,0,0|1,0,1]=4 4830 B14R1.6049 OC(=O)C(F)Cc1ccc(F)cc1F Amb25165244 [0,2,0,0,0,0|1,0,1]=4 4831 B14R1.6049 OC(=O)C(O)Cc1ccc(Br)cc1F Amb24389246 [0,2,0,0,0,0|0,0,2]=4 4832 B14R1.6049 OC(=O)[C@@H](Cc1ccc(cc1F)F)N Amb16231883 [0,2,0,0,0,0|1,0,1]=4 4833 B14R1.6049 OC(=O)[C@H](Cc1ccc(cc1F)O)N Amb10845772 [0,2,0,0,0,0|1,0,1]=4 4834 B14R1.6049 OC(=O)\C(\F)=C\c1ccc(Cl)cc1Cl Amb25840539 [0,2,0,0,0,0|1,0,1]=4 4835 B14R1.6049 OC(=O)\C(\F)=C\c1ccc(Cl)cc1F Amb25079512 [0,2,0,0,0,0|1,0,1]=4 4836 B14R1.6049 OC(=O)\C(\F)=C\c1ccc(F)cc1F Amb25822535 [0,2,0,0,0,0|1,0,1]=4 4837 B14R1.7626 CC(Br)(Cc1ccc(Cl)cc1)C(O)=O Amb24507517 [0,2,0,0,0,0|1,0,1]=4 4838 B14R1.7626 CC(Cl)(Cc1ccc(Cl)cc1)C(O)=O Amb24644127 [0,2,0,0,0,0|1,0,1]=4 4839 B14R1.7626 CC(F)(Cc1ccc(F)cc1)C(O)=O Amb24747199 [0,2,0,0,0,0|1,0,1]=4 4840 B14R1.7626 CC(N)(Cc1ccc(N)cc1)C(O)=O Amb24618145 [0,2,0,0,0,0|1,0,1]=4 4841 B14R1.7626 CC(N)(Cc1ccc(S)cc1)C(O)=O Amb25365035 [0,2,0,0,0,0|1,0,1]=4 4842 B14R1.7626 CC(O)(Cc1ccc(Br)cc1)C(O)=O Amb25327444 [0,2,0,0,0,0|0,0,2]=4 4843 B14R1.7626 CC(O)(Cc1ccc(Cl)cc1)C(O)=O Amb25104269 [0,2,0,0,0,0|0,0,2]=4 4844 B14R1.7626 C[C@@](N)(Cc1ccc(Cl)cc1)C(O)=O Amb24468309 [0,2,0,0,0,0|1,0,1]=4 4845 B14R1.7626 C[C@@](N)(Cc1ccc(F)cc1)C(O)=O Amb22745963 [0,2,0,0,0,0|1,0,1]=4 4846 B14R1.7626 C[C@@](N)(Cc1ccc(S)cc1)C(O)=O Amb25364941 [0,2,0,0,0,0|1,0,1]=4 4847 B14R1.7626 C[C@](N)(Cc1ccc(F)cc1)C(O)=O Amb25077186 [0,2,0,0,0,0|1,0,1]=4 4848 B14R1.7626 C[C@](N)(Cc1ccc(N)cc1)C(O)=O Amb24761343 [0,2,0,0,0,0|1,0,1]=4 4849 B14R1.7626 C[C@](N)(Cc1ccc(S)cc1)C(O)=O Amb24720142 [0,2,0,0,0,0|1,0,1]=4 4850 B14R1.7626 C[C@](O)(Cc1ccc(Br)cc1)C(O)=O Amb25095876 [0,2,0,0,0,0|0,0,2]=4 4851 B14R1.7626 C[C@](O)(Cc1ccc(Cl)cc1)C(O)=O Amb25106563 [0,2,0,0,0,0|0,0,2]=4 4852 B14R1.7626 Cc1ccc(CC(C)(Br)C(O)=O)cc1 Amb25852765 [0,2,0,0,0,0|1,0,1]=4 4853 B14R1.7626 Cc1ccc(CC(C)(Cl)C(O)=O)cc1 Amb25783790 [0,2,0,0,0,0|1,0,1]=4 4854 B14R1.7626 Cc1ccc(CC(C)(O)C(O)=O)cc1 Amb25779395 [0,2,0,0,0,0|0,0,2]=4 4855 B14R1.7626 Cc1ccc(C[C@](C)(N)C(O)=O)cc1 Amb25809391 [0,2,0,0,0,0|1,0,1]=4 4856 B14R1.7626 OC(=O)C(Cc1ccc(cc1)Br)(C)C Amb17265524 [0,2,0,0,0,0|1,0,1]=4 4857 B14R1.7626 OC(=O)C(Cc1ccc(cc1)Br)(N)C Amb17266143 [0,2,0,0,0,0|1,0,1]=4 4858 B14R1.7626 OC(=O)C(Cc1ccc(cc1)C)(C)C Amb17235388 [0,2,0,0,0,0|1,0,1]=4 4859 B14R1.7626 OC(=O)C(Cc1ccc(cc1)C)(N)C Amb17235616 [0,2,0,0,0,0|1,0,1]=4 4860 B14R1.7626 OC(=O)C(Cc1ccc(cc1)Cl)(C)C Amb17241249 [0,2,0,0,0,0|1,0,1]=4 4861 B14R1.7626 OC(=O)C(Cc1ccc(cc1)F)(C)C Amb17236376 [0,2,0,0,0,0|1,0,1]=4 4862 B14R1.7626 OC(=O)C(Cc1ccc(cc1)F)(N)C Amb17236544 [0,2,0,0,0,0|1,0,1]=4 4863 B14R1.7626 OC(=O)C(Cc1ccc(cc1)S)(C)C Amb17613333 [0,2,0,0,0,0|1,0,1]=4 4864 B14R1.7626 OC(=O)C(F)(F)Cc1ccc(Br)cc1 Amb25313273 [0,2,0,0,0,0|1,0,1]=4 4865 B14R1.7626 OC(=O)C(F)(F)Cc1ccc(F)cc1 Amb25747554 [0,2,0,0,0,0|1,0,1]=4 4866 B14R1.7626 OC(=O)[C@@](Cc1ccc(cc1)I)(N)C Amb16183900 [0,2,0,0,0,0|1,0,1]=4 4867 B14R1.7626 OC(=O)[C@](Cc1ccc(cc1)Br)(N)C Amb16183906 [0,2,0,0,0,0|1,0,1]=4 4868 B14R1.7626 OC(=O)[C@](Cc1ccc(cc1)I)(N)C Amb16183907 [0,2,0,0,0,0|1,0,1]=4 4869 B14R1.7626 Oc1ccc(cc1)CC(C(=O)O)(N)C Amb1917483 [0,2,0,0,0,0|1,0,1]=4 4870 B14R1.60 CCCC(=O)C(=O)Nc1ccccc1 Amb25706664 [0,2,0,0,0,0|2,0,0]=4 4871 B14R1.60 CCNC(=O)C(=O)Cc1ccccc1 Amb17401495 [0,2,0,0,0,0|1,0,0]=3 4872 B14R1.60 CCNC(=O)C(=O)Nc1ccccc1 Amb1814008 [0,2,0,0,0,0|2,0,0]=4 4873 B14R1.60 CCOC(=O)C(=O)Nc1ccccc1 Amb1196006 [0,2,0,0,0,0|1,0,0]=3 4874 B14R1.60 CCOC(=O)C(=O)Oc1cccc[n]1 Amb24103622 [0,2,0,0,0,0|2,0,0]=4 4875 B14R1.60 CCOC(=O)C(Cl)Cc1ccccc1 Amb24066460 [0,2,0,0,0,0|1,0,1]=4 4876 B14R1.60 CCOC(=O)C(O)Cc1ccccc1 Amb19079971 [0,2,0,0,0,0|0,0,2]=4 4877 B14R1.60 CCOC(=O)[C@H](N)Cc1ccccc1 Amb19889827 [0,2,0,0,0,0|1,0,1]=4 4878 B14R1.60 CCOC(=O)\C(=C/c1ccccc1)\C Amb10976899 [0,2,0,0,0,0|1,0,1]=4 4879 B14R1.60 CCOC(=O)\C(=C\c1ccccc1)\Br Amb2573602 [0,2,0,0,0,0|1,0,1]=4 4880 B14R1.60 CN(Cc1ccccc1)C(=O)OCCl Amb24371177 [0,2,0,0,0,0|2,0,0]=4 4881 B14R1.60 COC=C(Cl)C(=O)Nc1ccccc1 Amb22432715 [0,2,0,0,0,0|2,0,0]=4 4882 B14R1.60 CO\C=C(/F)\C(=O)Nc1ccccc1 Amb22547243 [0,2,0,0,0,0|2,0,0]=4 4883 B14R1.60 CO\C=C(/F)\C(=O)Sc1ccccc1 Amb22641707 [0,2,0,0,0,0|2,0,0]=4 4884 B14R1.60 CO\C=C(\F)/C(=O)Nc1ccccc1 Amb24616271 [0,2,0,0,0,0|2,0,0]=4 4885 B14R1.60 O=C(N=C=S)C(=O)Nc1ccccc1 Amb25122826 [0,2,0,0,0,0|1,1,0]=4 4886 B14R1.60 O=CCN(C(=O)Cc1ccccc1)C Amb17080705 [0,2,0,0,0,0|2,0,0]=4 4887 B14R1.60 OCCC(=O)N(Cc1ccccc1)C Amb17336607 [0,2,0,0,0,0|2,0,0]=4 4888 B14R1.60 OCCN(C(=O)Cc1ccccc1)C Amb2439745 [0,2,0,0,0,0|2,0,0]=4 4889 B14R1.60 OC\C=C(\F)/C(=O)Nc1ccccc1 Amb24360442 [0,2,0,0,0,0|2,0,0]=4 4890 B14R1.60 [N-]=[N+]=NC(=O)C(=O)Nc1ccccc1 Amb24419900 [0,2,0,0,0,0|2,0,0]=4 4891 B14R1.85 CC(C(Cl)C(=O)OC)c1ccccc1 Amb22059076 [0,2,0,0,0,0|1,0,1]=4 4892 B14R1.85 CC(C(N)C(=O)OC)c1ccccc1 Amb19013065 [0,2,0,0,0,0|1,0,1]=4 4893 B14R1.85 CC(C(N)c1ccccc1)C(=O)NO Amb24369091 [0,2,0,0,0,0|1,0,1]=4 4894 B14R1.85 CC(C(N)c1ccccc1)C(=O)OC Amb20623659 [0,2,0,0,0,0|1,0,1]=4 4895 B14R1.85 COC(=O)C(=O)C(Cl)c1c[n]ccc1 Amb18866485 [0,2,0,0,0,0|1,0,0]=3 4896 B14R1.85 COC(=O)C(=O)C(Cl)c1cc[n]cc1 Amb18225175 [0,2,0,0,0,0|1,0,0]=3 4897 B14R1.85 COC(=O)C(=O)C(Cl)c1cccc[n]1 Amb18866484 [0,2,0,0,0,0|1,0,0]=3 4898 B14R1.85 COC(=O)C(=O)C(Cl)c1ccccc1 Amb18866388 [0,2,0,0,0,0|0,0,0]=2 4899 B14R1.85 COC(=O)C(=O)C(c1ccccc1)C Amb17139343 [0,2,0,0,0,0|0,0,0]=2 4900 B14R1.85 COC(=O)C(=O)N(c1ccccc1)C Amb2438091 [0,2,0,0,0,0|1,0,0]=3 4901 B14R1.85 COC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb23439859 [0,2,0,0,0,0|0,0,2]=4 4902 B14R1.85 COC(=O)[C@@H](O)[C@H](Cl)c1ccccc1 Amb17844463 [0,2,0,0,0,0|0,0,2]=4 4903 B14R1.85 COC(=O)[C@@H](O)[C@H](N)c1ccccc1 Amb22744727 [0,2,0,0,0,0|0,0,2]=4 4904 B14R1.85 COC(=O)[C@@H](O)[C@H](O)c1ccccc1 Amb22336526 [0,2,0,0,0,0|0,0,2]=4 4905 B14R1.85 COC(=O)[C@@H]([C@H](c1ccccc1)N)O Amb10603125 [0,2,0,0,0,0|0,0,2]=4 4906 B14R1.85 COC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb22230835 [0,2,0,0,0,0|0,0,2]=4 4907 B14R1.85 C\C(=C\C)\C(=O)C(O)c1ccccc1 Amb25852903 [0,2,0,0,0,0|2,0,0]=4 4908 B14R1.85 C\C(\C(=O)OC)=C(\N)/c1ccccc1 Amb24711435 [0,2,0,0,0,0|1,0,1]=4 4909 B14R1.85 NC(C(O)c1ccccc1)C(=O)NO Amb25362212 [0,2,0,0,0,0|1,0,1]=4 4910 B14R1.85 OCC(=O)N(C(c1ccccc1)C)C Amb1109670 [0,2,0,0,0,0|2,0,0]=4 4911 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)C Amb1786276 [0,2,0,0,0,0|2,0,0]=4 4912 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)Cl Amb1772795 [0,2,0,0,0,0|2,0,0]=4 4913 B14R1.135 CNC(=O)C(=O)Nc1cccc(c1)F Amb1008328 [0,2,0,0,0,0|2,0,0]=4 4914 B14R1.135 COC(=O)C(=O)Cc1cccc(c1)Br Amb17162560 [0,2,0,0,0,0|0,0,0]=2 4915 B14R1.135 COC(=O)C(=O)Cc1cccc(c1)C Amb17139341 [0,2,0,0,0,0|0,0,0]=2 4916 B14R1.135 COC(=O)C(=O)Cc1cccc(c1)Cl Amb17140709 [0,2,0,0,0,0|0,0,0]=2 4917 B14R1.135 COC(=O)C(=O)Nc1c[n]cc(Br)c1 Amb24658245 [0,2,0,0,0,0|2,0,0]=4 4918 B14R1.135 COC(=O)C(=O)Nc1c[n]cc(F)c1 Amb24454224 [0,2,0,0,0,0|2,0,0]=4 4919 B14R1.135 COC(=O)C(=O)Nc1cccc(Br)c1 Amb24359229 [0,2,0,0,0,0|1,0,0]=3 4920 B14R1.135 COC(=O)C(=O)Nc1cccc(Cl)c1 Amb24687413 [0,2,0,0,0,0|1,0,0]=3 4921 B14R1.135 COC(=O)C(=O)Nc1cccc(I)c1 Amb25665663 [0,2,0,0,0,0|1,0,0]=3 4922 B14R1.135 COC(=O)C(Cc1cccc(c1)Br)Cl Amb17204953 [0,2,0,0,0,0|1,0,1]=4 4923 B14R1.135 COC(=O)C(Cc1cccc(c1)Br)N Amb17415246 [0,2,0,0,0,0|1,0,1]=4 4924 B14R1.135 COC(=O)C(Cc1cccc(c1)Br)O Amb17163099 [0,2,0,0,0,0|0,0,2]=4 4925 B14R1.135 COC(=O)C(Cc1cccc(c1)C)Cl Amb17204447 [0,2,0,0,0,0|1,0,1]=4 4926 B14R1.135 COC(=O)C(Cc1cccc(c1)C)N Amb17401771 [0,2,0,0,0,0|1,0,1]=4 4927 B14R1.135 COC(=O)C(Cc1cccc(c1)C)O Amb17139449 [0,2,0,0,0,0|0,0,2]=4 4928 B14R1.135 COC(=O)C(Cc1cccc(c1)Cl)Cl Amb17204592 [0,2,0,0,0,0|1,0,1]=4 4929 B14R1.135 COC(=O)C(Cc1cccc(c1)Cl)N Amb17404295 [0,2,0,0,0,0|1,0,1]=4 4930 B14R1.135 COC(=O)C(Cc1cccc(c1)Cl)O Amb17140887 [0,2,0,0,0,0|0,0,2]=4 4931 B14R1.135 COC(=O)C(Cc1cccc(c1)F)Br Amb17357773 [0,2,0,0,0,0|1,0,1]=4 4932 B14R1.135 COC(=O)C(Cc1cccc(c1)F)Cl Amb17204464 [0,2,0,0,0,0|1,0,1]=4 4933 B14R1.135 COC(=O)C(Cc1cccc(c1)O)N Amb17621158 [0,2,0,0,0,0|1,0,1]=4 4934 B14R1.135 COC(=O)[C@@H](N)Cc1cccc(O)c1 Amb22746779 [0,2,0,0,0,0|1,0,1]=4 4935 B14R1.135 COC(=O)\C(\Cl)=C\c1cccc(O)c1 Amb24564924 [0,2,0,0,0,0|1,0,1]=4 4936 B14R1.135 C\C(=C/c1cccc(O)c1)\C(=O)OC Amb25706936 [0,2,0,0,0,0|1,0,1]=4 4937 B14R1.135 Cc1c[n]cc(c1)NC(=O)C(=O)OC Amb24722032 [0,2,0,0,0,0|2,0,0]=4 4938 B14R1.135 Cc1cc(C[C@H](N)C(=O)NO)ccc1 Amb24444731 [0,2,0,0,0,0|1,0,1]=4 4939 B14R1.135 Cc1cc(ccc1)NC(=O)\C(\N)=N/O Amb19664196 [0,2,0,0,0,0|2,0,0]=4 4940 B14R1.135 Cc1cc(ccc1)NC(=O)\C(\N)=N\O Amb21972228 [0,2,0,0,0,0|2,0,0]=4 4941 B14R1.135 Cc1cc[n]c(c1)NC(=O)C(=O)OC Amb24361650 [0,2,0,0,0,0|2,0,0]=4 4942 B14R1.135 Cc1cccc(NC(=O)C(=O)OC)[n]1 Amb25716370 [0,2,0,0,0,0|2,0,0]=4 4943 B14R1.135 NNC(=O)C(=O)Nc1cccc(c1)Cl Amb1019566 [0,2,0,0,0,0|2,0,0]=4 4944 B14R1.135 NNC(=O)C(=O)Nc1cccc(c1)F Amb2167390 [0,2,0,0,0,0|2,0,0]=4 4945 B14R1.135 N\C(=N\O)\C(=O)Nc1cccc(Cl)c1 Amb19664178 [0,2,0,0,0,0|2,0,0]=4 4946 B14R1.135 OCC(=O)N(Cc1cccc(c1)Br)C Amb17415248 [0,2,0,0,0,0|2,0,0]=4 4947 B14R1.135 OCC(=O)N(Cc1cccc(c1)C)C Amb17401773 [0,2,0,0,0,0|2,0,0]=4 4948 B14R1.532 C\C=C(\OC)/C(=O)Nc1ccccc1 Amb25287252 [0,2,0,0,0,0|2,0,0]=4 4949 B14R1.532 N#C\C(=C\O)\C(=O)Nc1ccccc1 Amb25796966 [0,2,0,0,0,0|2,0,0]=4 4950 B14R1.532 O\N=C(\C(=O)Nc1ccccc1)/C#N Amb1984044 [0,2,0,0,0,0|2,0,0]=4 4951 B14R1.1007 CN(OC)C(=O)Cc1ccccc1Cl Amb20673704 [0,2,0,0,0,0|2,0,0]=4 4952 B14R1.1007 CN(OC)C(=O)Cc1ccccc1F Amb23597322 [0,2,0,0,0,0|2,0,0]=4 4953 B14R1.1007 CNC(=O)C(=O)Nc1ccccc1C Amb1811592 [0,2,0,0,0,0|2,0,0]=4 4954 B14R1.1007 COC(=O)C(=O)Cc1ccccc1C Amb17139340 [0,2,0,0,0,0|0,0,0]=2 4955 B14R1.1007 COC(=O)C(=O)Cc1ccccc1Cl Amb17140708 [0,2,0,0,0,0|0,0,0]=2 4956 B14R1.1007 COC(=O)C(=O)Cc1ccccc1F Amb17139584 [0,2,0,0,0,0|0,0,0]=2 4957 B14R1.1007 COC(=O)C(=O)Nc1[n]cccc1Br Amb24530694 [0,2,0,0,0,0|2,0,0]=4 4958 B14R1.1007 COC(=O)C(=O)Nc1ccccc1Br Amb24463900 [0,2,0,0,0,0|1,0,0]=3 4959 B14R1.1007 COC(=O)C(=O)Nc1ccccc1Cl Amb25119278 [0,2,0,0,0,0|1,0,0]=3 4960 B14R1.1007 COC(=O)C(=O)Nc1ccccc1O Amb24678810 [0,2,0,0,0,0|1,0,0]=3 4961 B14R1.1007 COC(=O)C(=O)Nc1ccccc1S Amb25698410 [0,2,0,0,0,0|1,0,0]=3 4962 B14R1.1007 COC(=O)C(Cc1ccccc1Br)Cl Amb17204952 [0,2,0,0,0,0|1,0,1]=4 4963 B14R1.1007 COC(=O)C(Cc1ccccc1C)Br Amb17355935 [0,2,0,0,0,0|1,0,1]=4 4964 B14R1.1007 COC(=O)C(Cc1ccccc1C)Cl Amb17204446 [0,2,0,0,0,0|1,0,1]=4 4965 B14R1.1007 COC(=O)C(Cc1ccccc1C)N Amb17401769 [0,2,0,0,0,0|1,0,1]=4 4966 B14R1.1007 COC(=O)C(Cc1ccccc1C)O Amb17139448 [0,2,0,0,0,0|0,0,2]=4 4967 B14R1.1007 COC(=O)C(Cc1ccccc1Cl)Cl Amb17204591 [0,2,0,0,0,0|1,0,1]=4 4968 B14R1.1007 COC(=O)C(Cc1ccccc1Cl)N Amb17404292 [0,2,0,0,0,0|1,0,1]=4 4969 B14R1.1007 COC(=O)C(Cc1ccccc1Cl)O Amb17140886 [0,2,0,0,0,0|0,0,2]=4 4970 B14R1.1007 COC(=O)C(Cc1ccccc1F)Br Amb17357772 [0,2,0,0,0,0|1,0,1]=4 4971 B14R1.1007 COC(=O)C(Cc1ccccc1F)Cl Amb17204462 [0,2,0,0,0,0|1,0,1]=4 4972 B14R1.1007 COC(=O)C(Cc1ccccc1F)N Amb17402181 [0,2,0,0,0,0|1,0,1]=4 4973 B14R1.1007 COC(=O)C(Cc1ccccc1F)O Amb17139693 [0,2,0,0,0,0|0,0,2]=4 4974 B14R1.1007 C\C(=C/c1ccccc1O)\C(=O)OC Amb25347509 [0,2,0,0,0,0|1,0,1]=4 4975 B14R1.1007 C\C(\CO)=C(\C)/Cc1ccccc1O Amb18651242 [0,2,0,0,0,0|2,0,0]=4 4976 B14R1.1007 Cc1[n]cccc1NC(=O)C(=O)OC Amb24687416 [0,2,0,0,0,0|2,0,0]=4 4977 B14R1.1007 Cc1c[n]ccc1NC(=O)C(=O)OC Amb25252705 [0,2,0,0,0,0|2,0,0]=4 4978 B14R1.1007 Cc1cc[n]cc1NC(=O)C(=O)OC Amb25720823 [0,2,0,0,0,0|2,0,0]=4 4979 B14R1.1007 Cc1ccccc1NC(=O)C(=O)OC Amb25770508 [0,2,0,0,0,0|1,0,0]=3 4980 B14R1.1007 Cc1ccccc1NC(=O)\C(\N)=N/O Amb19664195 [0,2,0,0,0,0|2,0,0]=4 4981 B14R1.1007 Cc1ccccc1NC(=O)\C(\N)=N\O Amb21972045 [0,2,0,0,0,0|2,0,0]=4 4982 B14R1.1007 NNC(=O)C(=O)Nc1ccccc1F Amb2167681 [0,2,0,0,0,0|2,0,0]=4 4983 B14R1.1007 N\C(=N\O)\C(=O)Nc1ccccc1Br Amb19664174 [0,2,0,0,0,0|2,0,0]=4 4984 B14R1.1007 N\C(=N\O)\C(=O)Nc1ccccc1Cl Amb19664177 [0,2,0,0,0,0|2,0,0]=4 4985 B14R1.1007 N\C(=N\O)\C(=O)Nc1ccccc1F Amb19664216 [0,2,0,0,0,0|2,0,0]=4 4986 B14R1.1007 OCC(=O)N(Cc1ccccc1Br)C Amb1110503 [0,2,0,0,0,0|2,0,0]=4 4987 B14R1.1007 OCC(=O)N(Cc1ccccc1C)C Amb1109921 [0,2,0,0,0,0|2,0,0]=4 4988 B14R1.1007 OCC(=O)N(Cc1ccccc1Cl)C Amb17404294 [0,2,0,0,0,0|2,0,0]=4 4989 B14R1.1031 CCN(Cc1ccccc1)C(=O)OC Amb24448645 [0,2,0,0,0,0|2,0,0]=4 4990 B14R1.1031 CNC(=O)\C(\Cc1ccccc1)=N\O Amb24392175 [0,2,0,0,0,0|1,0,1]=4 4991 B14R1.1031 CNC(Cc1ccccc1)C(=O)OC Amb22463164 [0,2,0,0,0,0|1,0,1]=4 4992 B14R1.1031 CN[C@@H](Cc1ccccc1)C(=O)OC Amb22745351 [0,2,0,0,0,0|1,0,1]=4 4993 B14R1.1031 COC(=O)C(Cc1ccccc1)C#N Amb17336069 [0,2,0,0,0,0|1,0,1]=4 4994 B14R1.1031 COC(=O)C(Cc1ccccc1)OC Amb22499910 [0,2,0,0,0,0|0,0,2]=4 4995 B14R1.1031 COC(=O)[C@@H](Cc1ccccc1)OC Amb22747354 [0,2,0,0,0,0|0,0,2]=4 4996 B14R1.1031 COC(=O)\C(=C\c1ccccc1)\C#N Amb10844663 [0,2,0,0,0,0|1,0,1]=4 4997 B14R1.1031 COC(=O)\C(\CBr)=C\c1ccccc1 Amb21959582 [0,2,0,0,0,0|1,0,1]=4 4998 B14R1.1031 COC(=O)\C(\CN)=C\c1ccccc1 Amb18650860 [0,2,0,0,0,0|1,0,1]=4 4999 B14R1.1031 NNC(=O)\C(\Cc1ccccc1)=N\N Amb25291010 [0,2,0,0,0,0|2,0,0]=4 5000 B14R1.1031 N\C(=N\O)\C(\Cc1ccccc1)=N/O Amb22053028 [0,2,0,0,0,0|1,0,1]=4 5001 B14R1.1031 O=C(CCl)N(Cc1ccccc1)N=O Amb24670124 [0,2,0,0,0,0|2,0,0]=4 5002 B14R1.1031 OCC(C(=O)OC)Cc1ccccc1 Amb10608962 [0,2,0,0,0,0|0,0,2]=4 5003 B14R1.1107 COC(=O)C(C)(C)Cc1ccccc1 Amb17844108 [0,2,0,0,0,0|1,0,1]=4 5004 B14R1.1107 COC(=O)C(Cc1ccccc1)(N)C Amb17401738 [0,2,0,0,0,0|1,0,1]=4 5005 B14R1.75 C#Cc1cccc(C[C@@H](N)C(O)=O)c1 Amb25313172 [0,2,0,0,0,0|1,0,1]=4 5006 B14R1.75 CC(=O)C(=O)Cc1cc(ccc1)OC Amb23603626 [0,2,0,0,0,0|1,0,0]=3 5007 B14R1.75 COc1cc(\C=C(\Cl)/C(O)=O)ccc1 Amb24759112 [0,2,0,0,0,0|1,0,1]=4 5008 B14R1.75 COc1cc(\C=C(\F)/C(O)=O)ccc1 Amb25818745 [0,2,0,0,0,0|1,0,1]=4 5009 B14R1.75 COc1cc(\C=C(\N)/C(O)=O)ccc1 Amb25341647 [0,2,0,0,0,0|1,0,1]=4 5010 B14R1.75 COc1cc(\C=C(\S)/C(O)=O)ccc1 Amb18656862 [0,2,0,0,0,0|0,1,1]=4 5011 B14R1.75 COc1cccc(CC(Br)C(O)=O)c1 Amb23320637 [0,2,0,0,0,0|1,0,1]=4 5012 B14R1.75 COc1cccc(c1)CC(=O)C(=O)O Amb1129281 [0,2,0,0,0,0|0,0,0]=2 5013 B14R1.75 COc1cccc(c1)CC(C(=O)O)Cl Amb17204460 [0,2,0,0,0,0|1,0,1]=4 5014 B14R1.75 COc1cccc(c1)CC(C(=O)O)O Amb17139588 [0,2,0,0,0,0|0,0,2]=4 5015 B14R1.75 COc1cccc(c1)C[C@H](C(=O)O)N Amb16231882 [0,2,0,0,0,0|1,0,1]=4 5016 B14R1.75 COc1cccc(c1)NC(=O)C(=O)C Amb17401707 [0,2,0,0,0,0|2,0,0]=4 5017 B14R1.75 C\C(=C/c1cccc(C=C)c1)\C(O)=O Amb25663951 [0,2,0,0,0,0|1,0,1]=4 5018 B14R1.75 C\C(=C\c1cccc(C=C)c1)\C(O)=O Amb24558007 [0,2,0,0,0,0|1,0,1]=4 5019 B14R1.75 N#Cc1cc(\C=C(/F)\C(O)=O)ccc1 Amb25301687 [0,2,0,0,0,0|1,0,1]=4 5020 B14R1.75 N#Cc1cccc(c1)CC(=O)C(=O)O Amb1130314 [0,2,0,0,0,0|0,0,0]=2 5021 B14R1.75 N#Cc1cccc(c1)CC(C(=O)O)C Amb17605833 [0,2,0,0,0,0|1,0,1]=4 5022 B14R1.75 N#Cc1cccc(c1)NC(=O)C(=O)C Amb17401163 [0,2,0,0,0,0|2,0,0]=4 5023 B14R1.75 NC(Cc1cc(ccc1)C#N)C(O)=O Amb18650431 [0,2,0,0,0,0|1,0,1]=4 5024 B14R1.75 N\C(=C\c1cc(ccc1)C#N)\C(O)=O Amb25330228 [0,2,0,0,0,0|1,0,1]=4 5025 B14R1.75 OC(=O)C(=O)Nc1cc(ccc1)C=O Amb25823608 [0,2,0,0,0,0|1,0,0]=3 5026 B14R1.150 C=C(C(N)c1cccc(Cl)c1)C(N)=O Amb25703651 [0,2,0,0,0,0|2,0,0]=4 5027 B14R1.150 C=C(C(N)c1cccc(Cl)c1)C(O)=O Amb25114043 [0,2,0,0,0,0|1,0,0]=3 5028 B14R1.150 C=C(C(O)c1cccc(Br)c1)C(O)=O Amb24381720 [0,2,0,0,0,0|1,0,0]=3 5029 B14R1.150 C=C(C(O)c1cccc(Cl)c1)C(O)=O Amb25733510 [0,2,0,0,0,0|1,0,0]=3 5030 B14R1.150 C=C(C(O)c1cccc(F)c1)C(N)=O Amb24696407 [0,2,0,0,0,0|2,0,0]=4 5031 B14R1.150 C=C([C@@H](N)c1cccc(Cl)c1)C(N)=O Amb25166042 [0,2,0,0,0,0|2,0,0]=4 5032 B14R1.150 CC(C(C)c1cccc(Br)c1)C(O)=O Amb25200830 [0,2,0,0,0,0|1,0,1]=4 5033 B14R1.150 CC(C(C)c1cccc(Cl)c1)C(O)=O Amb25265872 [0,2,0,0,0,0|1,0,1]=4 5034 B14R1.150 CC(C(C)c1cccc(F)c1)C(O)=O Amb25707225 [0,2,0,0,0,0|1,0,1]=4 5035 B14R1.150 CC(C(F)C(O)=O)c1cccc(Br)c1 Amb25200831 [0,2,0,0,0,0|1,0,1]=4 5036 B14R1.150 CC(C(F)C(O)=O)c1cccc(Cl)c1 Amb25213678 [0,2,0,0,0,0|1,0,1]=4 5037 B14R1.150 CC(C(F)C(O)=O)c1cccc(F)c1 Amb25289863 [0,2,0,0,0,0|1,0,1]=4 5038 B14R1.150 CC(C(N)C(O)=O)c1cccc(N)c1 Amb18651902 [0,2,0,0,0,0|1,0,1]=4 5039 B14R1.150 CC(C(N)c1cccc(O)c1)C(O)=O Amb24391526 [0,2,0,0,0,0|1,0,1]=4 5040 B14R1.150 CC(C(O)=O)=C(C)c1cccc(C)c1 Amb17777936 [0,2,0,0,0,0|1,0,1]=4 5041 B14R1.150 CC(C(O)C(O)=O)c1cccc(F)c1 Amb25139188 [0,2,0,0,0,0|0,0,2]=4 5042 B14R1.150 CN(c1cccc(F)c1)C(=O)C(O)=O Amb18957816 [0,2,0,0,0,0|1,0,0]=3 5043 B14R1.150 C[C@H]([C@H](N)C(O)=O)c1cccc(N)c1 Amb24552903 [0,2,0,0,0,0|1,0,1]=4 5044 B14R1.150 C\C(=C(\F)/C(O)=O)\c1cccc(Br)c1 Amb24684232 [0,2,0,0,0,0|1,0,1]=4 5045 B14R1.150 C\C(=C(\S)/C(O)=O)\c1cc(O)ccc1 Amb25095873 [0,2,0,0,0,0|0,1,1]=4 5046 B14R1.150 C\C(\C(O)=O)=C(\C)/c1cccc(Cl)c1 Amb25838976 [0,2,0,0,0,0|1,0,1]=4 5047 B14R1.150 C\C(\c1cc(C)ccc1)=C(\C)/C(O)=O Amb25304537 [0,2,0,0,0,0|1,0,1]=4 5048 B14R1.150 Cc1cc(ccc1)C(C)C(C)C(O)=O Amb25795828 [0,2,0,0,0,0|1,0,1]=4 5049 B14R1.150 Cc1cc(ccc1)C(N)C(O)C(O)=O Amb24381383 [0,2,0,0,0,0|0,0,2]=4 5050 B14R1.150 Cc1cc(ccc1)C(O)C(N)C(O)=O Amb18814158 [0,2,0,0,0,0|1,0,1]=4 5051 B14R1.150 Cc1cc(ccc1)[C@@H](N)[C@@H](O)C(O)=O Amb22756710 [0,2,0,0,0,0|0,0,2]=4 5052 B14R1.150 Cc1cccc(c1)N(C)C(=O)C(O)=O Amb18957790 [0,2,0,0,0,0|1,0,0]=3 5053 B14R1.150 NC(C(O)C(O)=O)c1cccc(F)c1 Amb25122657 [0,2,0,0,0,0|0,0,2]=4 5054 B14R1.150 NC(C(O)c1cc(Br)ccc1)C(O)=O Amb18692061 [0,2,0,0,0,0|1,0,1]=4 5055 B14R1.150 NC(C(O)c1cc(Cl)ccc1)C(O)=O Amb18657877 [0,2,0,0,0,0|1,0,1]=4 5056 B14R1.150 NC(C(O)c1cc(F)ccc1)C(O)=O Amb18187798 [0,2,0,0,0,0|1,0,1]=4 5057 B14R1.150 NC(C(O)c1cccc(O)c1)C(O)=O Amb25211277 [0,2,0,0,0,0|1,0,1]=4 5058 B14R1.150 N[C@@H]([C@@H](O)C(O)=O)c1cccc(F)c1 Amb22756701 [0,2,0,0,0,0|0,0,2]=4 5059 B14R1.150 N[C@@H]([C@@H](O)c1cc(Cl)ccc1)C(O)=O Amb25817634 [0,2,0,0,0,0|1,0,1]=4 5060 B14R1.150 N[C@H]([C@@H](O)c1cccc(O)c1)C(O)=O Amb24535338 [0,2,0,0,0,0|1,0,1]=4 5061 B14R1.150 N[C@H]([C@H](O)c1cccc(O)c1)C(O)=O Amb25138797 [0,2,0,0,0,0|1,0,1]=4 5062 B14R1.150 Nc1cc(ccc1)C(Br)C(Br)C(O)=O Amb21968238 [0,2,0,0,0,0|1,0,1]=4 5063 B14R1.150 Nc1cccc(c1)C(N)C(O)C(O)=O Amb25815588 [0,2,0,0,0,0|0,0,2]=4 5064 B14R1.150 Nc1cccc(c1)[C@H](N)[C@@H](O)C(O)=O Amb25752298 [0,2,0,0,0,0|0,0,2]=4 5065 B14R1.150 OC(=O)C(C(c1cccc(c1)Br)N)C Amb17473591 [0,2,0,0,0,0|1,0,1]=4 5066 B14R1.150 OC(=O)C(C(c1cccc(c1)C)N)C Amb17470842 [0,2,0,0,0,0|1,0,1]=4 5067 B14R1.150 OC(=O)C(C(c1cccc(c1)Cl)N)C Amb17471480 [0,2,0,0,0,0|1,0,1]=4 5068 B14R1.150 OC(=O)C(C(c1cccc(c1)F)N)C Amb17470959 [0,2,0,0,0,0|1,0,1]=4 5069 B14R1.153 CC(=C)C(=O)Cc1cccc(Cl)c1Cl Amb25813429 [0,2,0,0,0,0|2,0,0]=4 5070 B14R1.153 CC(=C)C(=O)Cc1cccc(F)c1Cl Amb24422775 [0,2,0,0,0,0|2,0,0]=4 5071 B14R1.153 CC(=O)C(=O)Nc1cccc(c1C)C Amb17401506 [0,2,0,0,0,0|2,0,0]=4 5072 B14R1.153 CC(=O)C(=O)Nc1cccc(c1Cl)Cl Amb17407823 [0,2,0,0,0,0|2,0,0]=4 5073 B14R1.153 CC(C(=O)O)Cc1cccc(c1Cl)Cl Amb17605805 [0,2,0,0,0,0|1,0,1]=4 5074 B14R1.153 CC(Cc1cccc(F)c1Br)C(O)=O Amb24521620 [0,2,0,0,0,0|1,0,1]=4 5075 B14R1.153 CC(Cc1cccc(F)c1F)C(O)=O Amb18972344 [0,2,0,0,0,0|1,0,1]=4 5076 B14R1.153 CC(Cc1cccc(O)c1Br)C(O)=O Amb25674846 [0,2,0,0,0,0|1,0,1]=4 5077 B14R1.153 CC(Cc1cccc(O)c1Cl)C(O)=O Amb25699254 [0,2,0,0,0,0|1,0,1]=4 5078 B14R1.153 CC(O)C(=O)Cc1cccc(Cl)c1Cl Amb25310793 [0,2,0,0,0,0|1,0,1]=4 5079 B14R1.153 CC(O)C(=O)Cc1cccc(Cl)c1F Amb24454449 [0,2,0,0,0,0|1,0,1]=4 5080 B14R1.153 CC(O)C(=O)Cc1cccc(F)c1Cl Amb25280507 [0,2,0,0,0,0|1,0,1]=4 5081 B14R1.153 CC(O)C(=O)Cc1cccc(F)c1F Amb24405442 [0,2,0,0,0,0|1,0,1]=4 5082 B14R1.153 CC1=CC=CN(CC(=C)C(O)=O)C1=O Amb24763696 [0,2,0,0,0,0|2,0,0]=4 5083 B14R1.153 CN1C(CC(=O)C(O)=O)=CC=CC1=O Amb25193220 [0,2,0,0,0,0|1,0,0]=3 5084 B14R1.153 C\C(=C/c1cccc(C)c1C)\C(O)=O Amb24727208 [0,2,0,0,0,0|1,0,1]=4 5085 B14R1.153 C\C(=C/c1cccc(Cl)c1F)\C(O)=O Amb24637736 [0,2,0,0,0,0|1,0,1]=4 5086 B14R1.153 C\C(=C/c1cccc(F)c1O)\C(O)=O Amb24763644 [0,2,0,0,0,0|1,0,1]=4 5087 B14R1.153 C\C(=C\c1cccc(Br)c1F)\C(O)=O Amb24527494 [0,2,0,0,0,0|1,0,1]=4 5088 B14R1.153 C\C(=C\c1cccc(C)c1F)\C(O)=O Amb24565180 [0,2,0,0,0,0|1,0,1]=4 5089 B14R1.153 C\C(=C\c1cccc(F)c1O)\C(O)=O Amb25288463 [0,2,0,0,0,0|1,0,1]=4 5090 B14R1.153 C\C(=C\c1cccc(O)c1Cl)\C(O)=O Amb25714823 [0,2,0,0,0,0|1,0,1]=4 5091 B14R1.153 Cc1c(Br)cccc1CC(C)C(O)=O Amb25705224 [0,2,0,0,0,0|1,0,1]=4 5092 B14R1.153 Cc1c(Br)cccc1CC(N)C(O)=O Amb25365005 [0,2,0,0,0,0|1,0,1]=4 5093 B14R1.153 Cc1c(Br)cccc1C[C@@H](N)C(O)=O Amb24417880 [0,2,0,0,0,0|1,0,1]=4 5094 B14R1.153 Cc1c(CC(C(=O)O)Cl)cccc1C Amb17204444 [0,2,0,0,0,0|1,0,1]=4 5095 B14R1.153 Cc1c(CC(C(=O)O)Cl)cccc1Cl Amb17204585 [0,2,0,0,0,0|1,0,1]=4 5096 B14R1.153 Cc1c(C[C@@H](N)C(O)=O)cccc1N Amb25694338 [0,2,0,0,0,0|1,0,1]=4 5097 B14R1.153 Cc1c(C[C@@H](N)C(O)=O)cccc1O Amb25113927 [0,2,0,0,0,0|1,0,1]=4 5098 B14R1.153 Cc1c(Cl)cccc1CC(Br)C(O)=O Amb23320623 [0,2,0,0,0,0|1,0,1]=4 5099 B14R1.153 Cc1c(Cl)cccc1CC(C)C(O)=O Amb24439500 [0,2,0,0,0,0|1,0,1]=4 5100 B14R1.153 Cc1c(F)cccc1CC(N)C(O)=O Amb22738001 [0,2,0,0,0,0|1,0,1]=4 5101 B14R1.153 Cc1c(F)cccc1C[C@@H](N)C(O)=O Amb25843792 [0,2,0,0,0,0|1,0,1]=4 5102 B14R1.153 Cc1c(F)cccc1C[C@H](N)C(O)=O Amb24715735 [0,2,0,0,0,0|1,0,1]=4 5103 B14R1.153 Cc1c(F)cccc1NC(=O)C(O)=O Amb18955830 [0,2,0,0,0,0|1,0,0]=3 5104 B14R1.153 Cc1c(F)cccc1\C=C(/C)\C(O)=O Amb25800225 [0,2,0,0,0,0|1,0,1]=4 5105 B14R1.153 Cc1c(I)cccc1C[C@@H](N)C(O)=O Amb24417877 [0,2,0,0,0,0|1,0,1]=4 5106 B14R1.153 Cc1c(I)cccc1NC(=O)C(O)=O Amb24374381 [0,2,0,0,0,0|1,0,0]=3 5107 B14R1.153 Cc1c(NC(=O)C(=O)C)cccc1Cl Amb17404132 [0,2,0,0,0,0|2,0,0]=4 5108 B14R1.153 Cc1c(NC(=O)C(=O)N)cccc1Cl Amb1014784 [0,2,0,0,0,0|2,0,0]=4 5109 B14R1.153 Cc1c(O)cccc1CC(C)C(O)=O Amb25282969 [0,2,0,0,0,0|1,0,1]=4 5110 B14R1.153 Cc1c(\C=C(\N)/C(O)=O)cccc1C Amb25103028 [0,2,0,0,0,0|1,0,1]=4 5111 B14R1.153 Cc1cccc(CC(=O)C(O)=O)c1C Amb18293177 [0,2,0,0,0,0|0,0,0]=2 5112 B14R1.153 Cc1cccc(CC(=O)C(O)=O)c1F Amb25359744 [0,2,0,0,0,0|0,0,0]=2 5113 B14R1.153 Cc1cccc(CC(Br)C(O)=O)c1C Amb23320604 [0,2,0,0,0,0|1,0,1]=4 5114 B14R1.153 Cc1cccc(CC(C)C(O)=O)c1Br Amb24645293 [0,2,0,0,0,0|1,0,1]=4 5115 B14R1.153 Cc1cccc(CC(C)C(O)=O)c1Cl Amb25316214 [0,2,0,0,0,0|1,0,1]=4 5116 B14R1.153 Cc1cccc(CC(C)C(O)=O)c1F Amb25763027 [0,2,0,0,0,0|1,0,1]=4 5117 B14R1.153 Cc1cccc(CC(F)C(O)=O)c1C Amb24741532 [0,2,0,0,0,0|1,0,1]=4 5118 B14R1.153 Cc1cccc(CC(S)C(O)=O)c1C Amb24416836 [0,2,0,0,0,0|0,1,1]=4 5119 B14R1.153 Cc1cccc(C[C@@H](N)C(O)=O)c1C Amb19061743 [0,2,0,0,0,0|1,0,1]=4 5120 B14R1.153 Cc1cccc(C[C@@H](N)C(O)=O)c1Cl Amb25747558 [0,2,0,0,0,0|1,0,1]=4 5121 B14R1.153 Cc1cccc(C[C@@H](N)C(O)=O)c1O Amb24350644 [0,2,0,0,0,0|1,0,1]=4 5122 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1Br Amb24499225 [0,2,0,0,0,0|1,0,1]=4 5123 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1C Amb24093651 [0,2,0,0,0,0|1,0,1]=4 5124 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1N Amb25326362 [0,2,0,0,0,0|1,0,1]=4 5125 B14R1.153 Cc1cccc(C[C@H](N)C(O)=O)c1O Amb25671992 [0,2,0,0,0,0|1,0,1]=4 5126 B14R1.153 Cc1cccc(NC(=N)C(O)=O)c1C Amb25164470 [0,2,0,0,0,0|2,0,0]=4 5127 B14R1.153 NC(=O)C(=O)Nc1cccc(c1Cl)Cl Amb2167173 [0,2,0,0,0,0|2,0,0]=4 5128 B14R1.153 NC(Cc1cccc(Br)c1Cl)C(O)=O Amb25049491 [0,2,0,0,0,0|1,0,1]=4 5129 B14R1.153 NC(Cc1cccc(Br)c1F)C(O)=O Amb25253473 [0,2,0,0,0,0|1,0,1]=4 5130 B14R1.153 NC(Cc1cccc(Cl)c1Br)C(O)=O Amb25121247 [0,2,0,0,0,0|1,0,1]=4 5131 B14R1.153 NC(Cc1cccc(Cl)c1F)C(O)=O Amb22738179 [0,2,0,0,0,0|1,0,1]=4 5132 B14R1.153 NC(Cc1cccc(Cl)c1O)C(O)=O Amb25752870 [0,2,0,0,0,0|1,0,1]=4 5133 B14R1.153 NC(Cc1cccc(F)c1Br)C(O)=O Amb24540531 [0,2,0,0,0,0|1,0,1]=4 5134 B14R1.153 NC(Cc1cccc(F)c1I)C(O)=O Amb25812910 [0,2,0,0,0,0|1,0,1]=4 5135 B14R1.153 NC(Cc1cccc(F)c1O)C(O)=O Amb24526128 [0,2,0,0,0,0|1,0,1]=4 5136 B14R1.153 NC(Cc1cccc(I)c1Cl)C(O)=O Amb25330907 [0,2,0,0,0,0|1,0,1]=4 5137 B14R1.153 NC(Cc1cccc(I)c1O)C(O)=O Amb24559177 [0,2,0,0,0,0|1,0,1]=4 5138 B14R1.153 NC(Cc1cccc(O)c1Cl)C(O)=O Amb25758579 [0,2,0,0,0,0|1,0,1]=4 5139 B14R1.153 NC(Cc1cccc(O)c1O)C(O)=O Amb21858507 [0,2,0,0,0,0|1,0,1]=4 5140 B14R1.153 N[C@@H](Cc1cccc(Br)c1Br)C(O)=O Amb25739023 [0,2,0,0,0,0|1,0,1]=4 5141 B14R1.153 N[C@@H](Cc1cccc(Br)c1O)C(O)=O Amb25339195 [0,2,0,0,0,0|1,0,1]=4 5142 B14R1.153 N[C@@H](Cc1cccc(Cl)c1Cl)C(O)=O Amb22228263 [0,2,0,0,0,0|1,0,1]=4 5143 B14R1.153 N[C@@H](Cc1cccc(Cl)c1F)C(O)=O Amb25047473 [0,2,0,0,0,0|1,0,1]=4 5144 B14R1.153 N[C@@H](Cc1cccc(Cl)c1O)C(O)=O Amb25835765 [0,2,0,0,0,0|1,0,1]=4 5145 B14R1.153 N[C@@H](Cc1cccc(F)c1Cl)C(O)=O Amb25784695 [0,2,0,0,0,0|1,0,1]=4 5146 B14R1.153 N[C@@H](Cc1cccc(F)c1I)C(O)=O Amb25748095 [0,2,0,0,0,0|1,0,1]=4 5147 B14R1.153 N[C@@H](Cc1cccc(I)c1Br)C(O)=O Amb25352707 [0,2,0,0,0,0|1,0,1]=4 5148 B14R1.153 N[C@@H](Cc1cccc(I)c1Cl)C(O)=O Amb25752312 [0,2,0,0,0,0|1,0,1]=4 5149 B14R1.153 N[C@@H](Cc1cccc(I)c1O)C(O)=O Amb25679133 [0,2,0,0,0,0|1,0,1]=4 5150 B14R1.153 N[C@@H](Cc1cccc(O)c1O)C(O)=O Amb22228292 [0,2,0,0,0,0|1,0,1]=4 5151 B14R1.153 N[C@H](Cc1cccc(Br)c1Cl)C(O)=O Amb24659596 [0,2,0,0,0,0|1,0,1]=4 5152 B14R1.153 N[C@H](Cc1cccc(Br)c1F)C(O)=O Amb25346904 [0,2,0,0,0,0|1,0,1]=4 5153 B14R1.153 N[C@H](Cc1cccc(Cl)c1Br)C(O)=O Amb24530391 [0,2,0,0,0,0|1,0,1]=4 5154 B14R1.153 N[C@H](Cc1cccc(Cl)c1Cl)C(O)=O Amb22228262 [0,2,0,0,0,0|1,0,1]=4 5155 B14R1.153 N[C@H](Cc1cccc(Cl)c1F)C(O)=O Amb24666507 [0,2,0,0,0,0|1,0,1]=4 5156 B14R1.153 N[C@H](Cc1cccc(Cl)c1O)C(O)=O Amb25726348 [0,2,0,0,0,0|1,0,1]=4 5157 B14R1.153 N[C@H](Cc1cccc(F)c1Br)C(O)=O Amb25808910 [0,2,0,0,0,0|1,0,1]=4 5158 B14R1.153 N[C@H](Cc1cccc(F)c1F)C(O)=O Amb20241135 [0,2,0,0,0,0|1,0,1]=4 5159 B14R1.153 N[C@H](Cc1cccc(F)c1O)C(O)=O Amb25181013 [0,2,0,0,0,0|1,0,1]=4 5160 B14R1.153 N[C@H](Cc1cccc(I)c1Cl)C(O)=O Amb24647989 [0,2,0,0,0,0|1,0,1]=4 5161 B14R1.153 N[C@H](Cc1cccc(O)c1Cl)C(O)=O Amb24640517 [0,2,0,0,0,0|1,0,1]=4 5162 B14R1.153 N[C@H](Cc1cccc(O)c1O)C(O)=O Amb22228291 [0,2,0,0,0,0|1,0,1]=4 5163 B14R1.153 N\C(=C\c1cccc(Br)c1F)\C(O)=O Amb24683364 [0,2,0,0,0,0|1,0,1]=4 5164 B14R1.153 Nc1c(Cl)cccc1CC(N)C(O)=O Amb18657749 [0,2,0,0,0,0|1,0,1]=4 5165 B14R1.153 Nc1c(Cl)cccc1C[C@@H](N)C(O)=O Amb25133741 [0,2,0,0,0,0|1,0,1]=4 5166 B14R1.153 Nc1c(Cl)cccc1C[C@H](N)C(O)=O Amb25185966 [0,2,0,0,0,0|1,0,1]=4 5167 B14R1.153 Nc1c(F)cccc1CC(N)C(O)=O Amb25214648 [0,2,0,0,0,0|1,0,1]=4 5168 B14R1.153 Nc1c(F)cccc1C[C@@H](N)C(O)=O Amb25710900 [0,2,0,0,0,0|1,0,1]=4 5169 B14R1.153 Nc1c(O)cccc1CC(N)C(O)=O Amb25294692 [0,2,0,0,0,0|1,0,1]=4 5170 B14R1.153 Nc1cccc(CC(N)C(O)=O)c1N Amb24746593 [0,2,0,0,0,0|1,0,1]=4 5171 B14R1.153 Nc1cccc(CC(N)C(O)=O)c1O Amb24419964 [0,2,0,0,0,0|1,0,1]=4 5172 B14R1.153 Nc1cccc(C[C@@H](N)C(O)=O)c1N Amb24621838 [0,2,0,0,0,0|1,0,1]=4 5173 B14R1.153 Nc1cccc(C[C@@H](N)C(O)=O)c1O Amb25224927 [0,2,0,0,0,0|1,0,1]=4 5174 B14R1.153 Nc1cccc(C[C@H](N)C(O)=O)c1O Amb25104253 [0,2,0,0,0,0|1,0,1]=4 5175 B14R1.153 OC(=O)C(=O)Cc1cccc(Br)c1F Amb24527493 [0,2,0,0,0,0|0,0,0]=2 5176 B14R1.153 OC(=O)C(=O)Nc1cccc(F)c1F Amb18951274 [0,2,0,0,0,0|1,0,0]=3 5177 B14R1.153 OC(=O)C(=O)Nc1cccc(F)c1I Amb25772454 [0,2,0,0,0,0|1,0,0]=3 5178 B14R1.153 OC(=O)C(Br)Cc1cccc(Cl)c1Cl Amb23320629 [0,2,0,0,0,0|1,0,1]=4 5179 B14R1.153 OC(=O)C(Cc1cccc(c1Cl)Cl)Cl Amb17204776 [0,2,0,0,0,0|1,0,1]=4 5180 B14R1.153 OC(=O)C(O)Cc1cccc(Cl)c1Cl Amb24358285 [0,2,0,0,0,0|0,0,2]=4 5181 B14R1.153 OC(=O)C(O)Cc1cccc(Cl)c1F Amb25079623 [0,2,0,0,0,0|0,0,2]=4 5182 B14R1.153 OC(=O)\C(\F)=C\c1cccc(Br)c1F Amb24626738 [0,2,0,0,0,0|1,0,1]=4 5183 B14R1.542 CCC(C(=O)O)Cc1cccc(c1)F Amb17605809 [0,2,0,0,0,0|1,0,1]=4 5184 B14R1.542 CCC(Cc1cc(Br)ccc1)C(O)=O Amb19374383 [0,2,0,0,0,0|1,0,1]=4 5185 B14R1.542 CC\C(=C/c1cccc(c1)N)\C(=O)O Amb17594988 [0,2,0,0,0,0|1,0,1]=4 5186 B14R1.542 CC\C(=C/c1cccc(c1)O)\C(=O)O Amb16205000 [0,2,0,0,0,0|1,0,1]=4 5187 B14R1.542 CNC(Cc1cccc(F)c1)C(O)=O Amb22468483 [0,2,0,0,0,0|1,0,1]=4 5188 B14R1.542 COC(Cc1cccc(Br)c1)C(O)=O Amb23321086 [0,2,0,0,0,0|0,0,2]=4 5189 B14R1.542 COC(Cc1cccc(Cl)c1)C(O)=O Amb23321027 [0,2,0,0,0,0|0,0,2]=4 5190 B14R1.542 Cc1cc(CC(CN)C(O)=O)ccc1 Amb20622915 [0,2,0,0,0,0|1,0,1]=4 5191 B14R1.542 Cc1cc(CC(OC)C(O)=O)ccc1 Amb23320709 [0,2,0,0,0,0|0,0,2]=4 5192 B14R1.542 Cc1cc(C\C(=N\O)\C(O)=O)ccc1 Amb25725090 [0,2,0,0,0,0|0,0,1]=3 5193 B14R1.542 Cc1cc(\C=C(\CC)/C(O)=O)ccc1 Amb25322378 [0,2,0,0,0,0|1,0,1]=4 5194 B14R1.542 N#CC(C(=O)O)Cc1cccc(c1)C Amb17090111 [0,2,0,0,0,0|1,0,1]=4 5195 B14R1.542 N#CC(C(=O)O)Cc1cccc(c1)Cl Amb17090119 [0,2,0,0,0,0|1,0,1]=4 5196 B14R1.542 N#CC(C(=O)O)Cc1cccc(c1)O Amb17090136 [0,2,0,0,0,0|1,0,1]=4 5197 B14R1.542 N#C\C(=C/c1cccc(c1)Br)\C(=O)O Amb1139466 [0,2,0,0,0,0|1,0,1]=4 5198 B14R1.542 N#C\C(=C/c1cccc(c1)C)\C(=O)O Amb1141637 [0,2,0,0,0,0|1,0,1]=4 5199 B14R1.542 N#C\C(=C/c1cccc(c1)Cl)\C(=O)O Amb1140365 [0,2,0,0,0,0|1,0,1]=4 5200 B14R1.542 N#C\C(=C/c1cccc(c1)F)\C(=O)O Amb1132671 [0,2,0,0,0,0|1,0,1]=4 5201 B14R1.542 N#C\C(=C/c1cccc(c1)O)\C(=O)O Amb1127320 [0,2,0,0,0,0|1,0,1]=4 5202 B14R1.542 N#C\C(=C\c1cc(O)ccc1)\C(O)=O Amb20407471 [0,2,0,0,0,0|1,0,1]=4 5203 B14R1.542 NCC(Cc1cc(Cl)ccc1)C(O)=O Amb19321126 [0,2,0,0,0,0|1,0,1]=4 5204 B14R1.542 NC\C(=C/c1cccc(Cl)c1)\C(O)=O Amb25041133 [0,2,0,0,0,0|1,0,1]=4 5205 B14R1.542 NC\C(=C\c1cccc(Cl)c1)\C(O)=O Amb25252120 [0,2,0,0,0,0|1,0,1]=4 5206 B14R1.542 Nc1cc(\C=C(\C#N)/C(O)=O)ccc1 Amb24470120 [0,2,0,0,0,0|1,0,1]=4 5207 B14R1.4257 CC(=C)C(=O)Cc1cc(F)cc(Br)c1 Amb25793286 [0,2,0,0,0,0|2,0,0]=4 5208 B14R1.4257 CC(C(=O)O)Cc1cc(Cl)cc(c1)Cl Amb17605838 [0,2,0,0,0,0|1,0,1]=4 5209 B14R1.4257 CC(Cc1cc(C)cc(C)c1)C(O)=O Amb19050593 [0,2,0,0,0,0|1,0,1]=4 5210 B14R1.4257 CC(Cc1cc(F)cc(Cl)c1)C(O)=O Amb25762039 [0,2,0,0,0,0|1,0,1]=4 5211 B14R1.4257 CC(Cc1cc(F)cc(F)c1)C(O)=O Amb25850756 [0,2,0,0,0,0|1,0,1]=4 5212 B14R1.4257 CC(Cc1cc(O)cc(Br)c1)C(O)=O Amb24473206 [0,2,0,0,0,0|1,0,1]=4 5213 B14R1.4257 CC(Cc1cc(O)cc(Cl)c1)C(O)=O Amb25220157 [0,2,0,0,0,0|1,0,1]=4 5214 B14R1.4257 C\C(=C/c1cc(C)cc(C)c1)\C(O)=O Amb24336012 [0,2,0,0,0,0|1,0,1]=4 5215 B14R1.4257 C\C(=C/c1cc(O)cc(O)c1)\C(O)=O Amb24336011 [0,2,0,0,0,0|1,0,1]=4 5216 B14R1.4257 C\C(=C\c1cc(Cl)cc(Cl)c1)\C(O)=O Amb25129976 [0,2,0,0,0,0|1,0,1]=4 5217 B14R1.4257 C\C(=C\c1cc(F)cc(F)c1)\C(O)=O Amb25692925 [0,2,0,0,0,0|1,0,1]=4 5218 B14R1.4257 C\C(=C\c1cc(O)cc(O)c1)\C(O)=O Amb25338400 [0,2,0,0,0,0|1,0,1]=4 5219 B14R1.4257 Cc1cc(CC(=O)C(O)=O)cc(C)c1 Amb18980661 [0,2,0,0,0,0|0,0,0]=2 5220 B14R1.4257 Cc1cc(CC(Br)C(O)=O)cc(C)c1 Amb23320610 [0,2,0,0,0,0|1,0,1]=4 5221 B14R1.4257 Cc1cc(CC(C)C(O)=O)cc(Cl)c1 Amb25754465 [0,2,0,0,0,0|1,0,1]=4 5222 B14R1.4257 Cc1cc(CC(C)C(O)=O)cc(F)c1 Amb25251900 [0,2,0,0,0,0|1,0,1]=4 5223 B14R1.4257 Cc1cc(CC(C)C(O)=O)cc(O)c1 Amb24359044 [0,2,0,0,0,0|1,0,1]=4 5224 B14R1.4257 Cc1cc(CC(F)C(O)=O)cc(Cl)c1 Amb25352804 [0,2,0,0,0,0|1,0,1]=4 5225 B14R1.4257 Cc1cc(CC(N)C(O)=O)cc(C)c1 Amb19348396 [0,2,0,0,0,0|1,0,1]=4 5226 B14R1.4257 Cc1cc(CC(S)C(O)=O)cc(C)c1 Amb25266214 [0,2,0,0,0,0|0,1,1]=4 5227 B14R1.4257 Cc1cc(C[C@@H](N)C(O)=O)cc(C)c1 Amb19061744 [0,2,0,0,0,0|1,0,1]=4 5228 B14R1.4257 Cc1cc(C[C@@H](N)C(O)=O)cc(Cl)c1 Amb24446519 [0,2,0,0,0,0|1,0,1]=4 5229 B14R1.4257 Cc1cc(C[C@@H](N)C(O)=O)cc(F)c1 Amb24426801 [0,2,0,0,0,0|1,0,1]=4 5230 B14R1.4257 Cc1cc(C[C@H](N)C(O)=O)cc(Br)c1 Amb25804244 [0,2,0,0,0,0|1,0,1]=4 5231 B14R1.4257 Cc1cc(C[C@H](N)C(O)=O)cc(C)c1 Amb24087704 [0,2,0,0,0,0|1,0,1]=4 5232 B14R1.4257 Cc1cc(\C=C(\F)/C(O)=O)cc(C)c1 Amb24644591 [0,2,0,0,0,0|1,0,1]=4 5233 B14R1.4257 Cc1cc(\C=C(\N)/C(O)=O)cc(C)c1 Amb24731298 [0,2,0,0,0,0|1,0,1]=4 5234 B14R1.4257 Cc1cc(\C=C(\N)/C(O)=O)cc(F)c1 Amb25798051 [0,2,0,0,0,0|1,0,1]=4 5235 B14R1.4257 Cc1cc(cc(Br)c1)NC(=O)C(O)=O Amb25671800 [0,2,0,0,0,0|1,0,0]=3 5236 B14R1.4257 Cc1cc(cc(C)c1)NC(=O)C(N)=O Amb25677004 [0,2,0,0,0,0|2,0,0]=4 5237 B14R1.4257 Cc1cc(cc(c1)C)NC(=O)C(=O)C Amb17401504 [0,2,0,0,0,0|2,0,0]=4 5238 B14R1.4257 ClC(C(=O)O)Cc1cc(C)cc(c1)C Amb17204443 [0,2,0,0,0,0|1,0,1]=4 5239 B14R1.4257 ClC(C(=O)O)Cc1cc(Cl)cc(c1)Cl Amb17204775 [0,2,0,0,0,0|1,0,1]=4 5240 B14R1.4257 NC(Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb18300561 [0,2,0,0,0,0|1,0,1]=4 5241 B14R1.4257 NC(Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb20627895 [0,2,0,0,0,0|1,0,1]=4 5242 B14R1.4257 NC(Cc1cc(F)cc(Cl)c1)C(O)=O Amb22738184 [0,2,0,0,0,0|1,0,1]=4 5243 B14R1.4257 NC(Cc1cc(O)cc(F)c1)C(O)=O Amb25791570 [0,2,0,0,0,0|1,0,1]=4 5244 B14R1.4257 NC(Cc1cc(O)cc(O)c1)C(O)=O Amb22002701 [0,2,0,0,0,0|1,0,1]=4 5245 B14R1.4257 N[C@@H](Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb22229070 [0,2,0,0,0,0|1,0,1]=4 5246 B14R1.4257 N[C@@H](Cc1cc(Cl)cc(I)c1)C(O)=O Amb24587152 [0,2,0,0,0,0|1,0,1]=4 5247 B14R1.4257 N[C@@H](Cc1cc(F)cc(Cl)c1)C(O)=O Amb25761525 [0,2,0,0,0,0|1,0,1]=4 5248 B14R1.4257 N[C@@H](Cc1cc(I)cc(I)c1)C(O)=O Amb22232859 [0,2,0,0,0,0|1,0,1]=4 5249 B14R1.4257 N[C@@H](Cc1cc(O)cc(O)c1)C(O)=O Amb22229078 [0,2,0,0,0,0|1,0,1]=4 5250 B14R1.4257 N[C@@H](Cc1cc(O)cc(O)c1)C(O)=O Amb23438870 [0,2,0,0,0,0|1,0,1]=4 5251 B14R1.4257 N[C@H](Cc1cc(Br)cc(Br)c1)C(O)=O Amb25702985 [0,2,0,0,0,0|1,0,1]=4 5252 B14R1.4257 N[C@H](Cc1cc(Cl)cc(Br)c1)C(O)=O Amb25664947 [0,2,0,0,0,0|1,0,1]=4 5253 B14R1.4257 N[C@H](Cc1cc(Cl)cc(Cl)c1)C(O)=O Amb22229068 [0,2,0,0,0,0|1,0,1]=4 5254 B14R1.4257 N[C@H](Cc1cc(Cl)cc(I)c1)C(O)=O Amb25771105 [0,2,0,0,0,0|1,0,1]=4 5255 B14R1.4257 N[C@H](Cc1cc(I)cc(I)c1)C(O)=O Amb25075204 [0,2,0,0,0,0|1,0,1]=4 5256 B14R1.4257 N[C@H](Cc1cc(O)cc(F)c1)C(O)=O Amb25342632 [0,2,0,0,0,0|1,0,1]=4 5257 B14R1.4257 N[C@H](Cc1cc(O)cc(O)c1)C(O)=O Amb22229077 [0,2,0,0,0,0|1,0,1]=4 5258 B14R1.4257 O=C(C(=O)C)Nc1cc(Cl)cc(c1)Cl Amb17407822 [0,2,0,0,0,0|2,0,0]=4 5259 B14R1.4257 OC(=O)C(=O)Cc1cc(Br)cc(Br)c1 Amb24532316 [0,2,0,0,0,0|0,0,0]=2 5260 B14R1.4257 OC(=O)C(=O)Cc1cc(Cl)cc(Cl)c1 Amb18288917 [0,2,0,0,0,0|0,0,0]=2 5261 B14R1.4257 OC(=O)C(=O)Cc1cc(F)cc(O)c1 Amb25818974 [0,2,0,0,0,0|0,0,0]=2 5262 B14R1.4257 OC(=O)C(Br)Cc1cc(Cl)cc(Cl)c1 Amb23320633 [0,2,0,0,0,0|1,0,1]=4 5263 B14R1.4257 OC(=O)C(F)Cc1cc(Br)cc(Br)c1 Amb24569309 [0,2,0,0,0,0|1,0,1]=4 5264 B14R1.4257 OC(=O)C(F)Cc1cc(F)cc(Br)c1 Amb25200788 [0,2,0,0,0,0|1,0,1]=4 5265 B14R1.4257 OC(=O)C(F)Cc1cc(F)cc(F)c1 Amb24472049 [0,2,0,0,0,0|1,0,1]=4 5266 B14R1.4257 OC(=O)C(O)Cc1cc(Cl)cc(Cl)c1 Amb24472418 [0,2,0,0,0,0|0,0,2]=4 5267 B14R1.4257 OC(=O)\C(\F)=C\c1cc(F)cc(F)c1 Amb25677168 [0,2,0,0,0,0|1,0,1]=4 5268 B14R1.4257 Oc1cc(CC(F)C(O)=O)cc(F)c1 Amb25260509 [0,2,0,0,0,0|1,0,1]=4 5269 B14R1.4404 Brc1cccc(c1)CC(C(=O)O)(C)C Amb17265522 [0,2,0,0,0,0|1,0,1]=4 5270 B14R1.4404 Brc1cccc(c1)CC(C(=O)O)(N)C Amb17266142 [0,2,0,0,0,0|1,0,1]=4 5271 B14R1.4404 Brc1cccc(c1)C[C@@](C(=O)O)(N)C Amb10066901 [0,2,0,0,0,0|1,0,1]=4 5272 B14R1.4404 CC(Br)(Cc1cccc(Cl)c1)C(O)=O Amb25029122 [0,2,0,0,0,0|1,0,1]=4 5273 B14R1.4404 CC(Cl)(Cc1cccc(Br)c1)C(O)=O Amb25029076 [0,2,0,0,0,0|1,0,1]=4 5274 B14R1.4404 CC(F)(Cc1cccc(Cl)c1)C(O)=O Amb25217872 [0,2,0,0,0,0|1,0,1]=4 5275 B14R1.4404 CC(O)(Cc1cccc(Cl)c1)C(O)=O Amb25278384 [0,2,0,0,0,0|0,0,2]=4 5276 B14R1.4404 C[C@@](N)(Cc1cc(N)ccc1)C(O)=O Amb25791126 [0,2,0,0,0,0|1,0,1]=4 5277 B14R1.4404 C[C@@](N)(Cc1cc(O)ccc1)C(O)=O Amb22751251 [0,2,0,0,0,0|1,0,1]=4 5278 B14R1.4404 C[C@@](N)(Cc1cccc(Cl)c1)C(O)=O Amb25703828 [0,2,0,0,0,0|1,0,1]=4 5279 B14R1.4404 C[C@@](N)(Cc1cccc(F)c1)C(O)=O Amb23439046 [0,2,0,0,0,0|1,0,1]=4 5280 B14R1.4404 C[C@@](N)(Cc1cccc(S)c1)C(O)=O Amb24382646 [0,2,0,0,0,0|1,0,1]=4 5281 B14R1.4404 C[C@@](O)(Cc1cccc(Br)c1)C(O)=O Amb24452123 [0,2,0,0,0,0|0,0,2]=4 5282 B14R1.4404 C[C@@](O)(Cc1cccc(Cl)c1)C(O)=O Amb24336050 [0,2,0,0,0,0|0,0,2]=4 5283 B14R1.4404 C[C@](N)(Cc1cc(O)ccc1)C(O)=O Amb24761288 [0,2,0,0,0,0|1,0,1]=4 5284 B14R1.4404 C[C@](N)(Cc1cccc(Cl)c1)C(O)=O Amb24468738 [0,2,0,0,0,0|1,0,1]=4 5285 B14R1.4404 C[C@](N)(Cc1cccc(F)c1)C(O)=O Amb25117945 [0,2,0,0,0,0|1,0,1]=4 5286 B14R1.4404 C[C@](N)(Cc1cccc(S)c1)C(O)=O Amb25826608 [0,2,0,0,0,0|1,0,1]=4 5287 B14R1.4404 C[C@](O)(Cc1cccc(Br)c1)C(O)=O Amb25729870 [0,2,0,0,0,0|0,0,2]=4 5288 B14R1.4404 Cc1cc(CC(C)(Cl)C(O)=O)ccc1 Amb24463739 [0,2,0,0,0,0|1,0,1]=4 5289 B14R1.4404 Cc1cccc(C[C@](C)(O)C(O)=O)c1 Amb25132097 [0,2,0,0,0,0|0,0,2]=4 5290 B14R1.4404 Cc1cccc(c1)CC(C(=O)O)(C)C Amb17235387 [0,2,0,0,0,0|1,0,1]=4 5291 B14R1.4404 Cc1cccc(c1)CC(C(=O)O)(N)C Amb17235615 [0,2,0,0,0,0|1,0,1]=4 5292 B14R1.4404 Clc1cccc(c1)CC(C(=O)O)(C)C Amb17241248 [0,2,0,0,0,0|1,0,1]=4 5293 B14R1.4404 Clc1cccc(c1)CC(C(=O)O)(N)C Amb17241539 [0,2,0,0,0,0|1,0,1]=4 5294 B14R1.4404 Fc1cccc(c1)CC(C(=O)O)(C)C Amb17333792 [0,2,0,0,0,0|1,0,1]=4 5295 B14R1.4404 Ic1cccc(c1)C[C@@](C(=O)O)(N)C Amb16183904 [0,2,0,0,0,0|1,0,1]=4 5296 B14R1.4404 Ic1cccc(c1)C[C@](C(=O)O)(N)C Amb16183898 [0,2,0,0,0,0|1,0,1]=4 5297 B14R1.4405 CC(C)(O)C(=O)Cc1cccc(Cl)c1 Amb25207650 [0,2,0,0,0,0|1,0,1]=4 5298 B14R1.4474 CC(=C)C(=O)Cc1cc(Cl)ccc1Br Amb25822727 [0,2,0,0,0,0|2,0,0]=4 5299 B14R1.4474 CC(=C)C(=O)Cc1cc(F)ccc1Cl Amb24608275 [0,2,0,0,0,0|2,0,0]=4 5300 B14R1.4474 CC(=C)C(=O)Cc1cc(F)ccc1F Amb24379212 [0,2,0,0,0,0|2,0,0]=4 5301 B14R1.4474 CC(=O)C(=O)Cc1cc(C)ccc1C Amb25029063 [0,2,0,0,0,0|1,0,0]=3 5302 B14R1.4474 CC(=O)C(=O)Nc1cc(Cl)ccc1Cl Amb17407821 [0,2,0,0,0,0|2,0,0]=4 5303 B14R1.4474 CC(C(=O)O)Cc1cc(F)ccc1F Amb17605835 [0,2,0,0,0,0|1,0,1]=4 5304 B14R1.4474 CC(Cc1cc(Cl)ccc1Cl)C(O)=O Amb22483423 [0,2,0,0,0,0|1,0,1]=4 5305 B14R1.4474 CC(Cc1cc(F)ccc1Cl)C(O)=O Amb24695088 [0,2,0,0,0,0|1,0,1]=4 5306 B14R1.4474 CC(Cc1cc(O)ccc1Cl)C(O)=O Amb25699867 [0,2,0,0,0,0|1,0,1]=4 5307 B14R1.4474 CC(O)C(=O)Cc1cc(Cl)ccc1Br Amb25344786 [0,2,0,0,0,0|1,0,1]=4 5308 B14R1.4474 CC(O)C(=O)Cc1cc(F)ccc1F Amb25354441 [0,2,0,0,0,0|1,0,1]=4 5309 B14R1.4474 C\C(=C/c1cc(C)ccc1C)\C(O)=O Amb25324266 [0,2,0,0,0,0|1,0,1]=4 5310 B14R1.4474 C\C(=C/c1cc(Cl)ccc1N)\C(O)=O Amb24727023 [0,2,0,0,0,0|1,0,1]=4 5311 B14R1.4474 C\C(=C/c1cc(F)ccc1F)\C(O)=O Amb25843296 [0,2,0,0,0,0|1,0,1]=4 5312 B14R1.4474 C\C(=C/c1cc(I)ccc1F)\C(O)=O Amb24730520 [0,2,0,0,0,0|1,0,1]=4 5313 B14R1.4474 C\C(=C\c1cc(Br)ccc1Cl)\C(O)=O Amb25170318 [0,2,0,0,0,0|1,0,1]=4 5314 B14R1.4474 C\C(=C\c1cc(C)ccc1C)\C(O)=O Amb25711084 [0,2,0,0,0,0|1,0,1]=4 5315 B14R1.4474 C\C(=C\c1cc(F)ccc1Cl)\C(O)=O Amb25242593 [0,2,0,0,0,0|1,0,1]=4 5316 B14R1.4474 C\C(=C\c1cc(O)ccc1O)\C(O)=O Amb24605676 [0,2,0,0,0,0|1,0,1]=4 5317 B14R1.4474 C\C(=N\c1cc(N)ccc1N)\C(O)=O Amb24443136 [0,2,0,0,0,0|2,0,0]=4 5318 B14R1.4474 Cc1cc(CC(=O)C(O)=O)c(C)cc1 Amb18978989 [0,2,0,0,0,0|0,0,0]=2 5319 B14R1.4474 Cc1cc(CC(Br)C(O)=O)c(C)cc1 Amb23320606 [0,2,0,0,0,0|1,0,1]=4 5320 B14R1.4474 Cc1cc(CC(C)C(O)=O)c(C)cc1 Amb19050594 [0,2,0,0,0,0|1,0,1]=4 5321 B14R1.4474 Cc1cc(CC(F)C(O)=O)c(C)cc1 Amb25183609 [0,2,0,0,0,0|1,0,1]=4 5322 B14R1.4474 Cc1cc(CC(N)C(O)=O)c(Br)cc1 Amb25068352 [0,2,0,0,0,0|1,0,1]=4 5323 B14R1.4474 Cc1cc(CC(N)C(O)=O)c(Cl)cc1 Amb25363453 [0,2,0,0,0,0|1,0,1]=4 5324 B14R1.4474 Cc1cc(CC(N)C(O)=O)c(F)cc1 Amb22011666 [0,2,0,0,0,0|1,0,1]=4 5325 B14R1.4474 Cc1cc(CC(O)C(O)=O)c(C)cc1 Amb25372528 [0,2,0,0,0,0|0,0,2]=4 5326 B14R1.4474 Cc1cc(C[C@@H](N)C(O)=O)c(Br)cc1 Amb25858033 [0,2,0,0,0,0|1,0,1]=4 5327 B14R1.4474 Cc1cc(C[C@@H](N)C(O)=O)c(C)cc1 Amb19061742 [0,2,0,0,0,0|1,0,1]=4 5328 B14R1.4474 Cc1cc(C[C@@H](N)C(O)=O)c(Cl)cc1 Amb25305742 [0,2,0,0,0,0|1,0,1]=4 5329 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(Br)cc1 Amb24499102 [0,2,0,0,0,0|1,0,1]=4 5330 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(C)cc1 Amb22228362 [0,2,0,0,0,0|1,0,1]=4 5331 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(Cl)cc1 Amb25207104 [0,2,0,0,0,0|1,0,1]=4 5332 B14R1.4474 Cc1cc(C[C@H](N)C(O)=O)c(F)cc1 Amb24398947 [0,2,0,0,0,0|1,0,1]=4 5333 B14R1.4474 Cc1cc(NC(=N)C(O)=O)c(C)cc1 Amb18651186 [0,2,0,0,0,0|2,0,0]=4 5334 B14R1.4474 Cc1cc(NC(=S)C(O)=O)c(N)cc1 Amb24469360 [0,2,0,0,0,0|1,1,0]=4 5335 B14R1.4474 Cc1cc(\C=C(\F)/C(O)=O)c(F)cc1 Amb25058076 [0,2,0,0,0,0|1,0,1]=4 5336 B14R1.4474 Cc1cc(\C=C(\N)/C(O)=O)c(Cl)cc1 Amb24339218 [0,2,0,0,0,0|1,0,1]=4 5337 B14R1.4474 Cc1ccc(Br)c(CC(C)C(O)=O)c1 Amb25320687 [0,2,0,0,0,0|1,0,1]=4 5338 B14R1.4474 Cc1ccc(Br)cc1CC(=O)C(C)=C Amb25375199 [0,2,0,0,0,0|2,0,0]=4 5339 B14R1.4474 Cc1ccc(Br)cc1CC(=O)C(C)O Amb25694943 [0,2,0,0,0,0|1,0,1]=4 5340 B14R1.4474 Cc1ccc(Br)cc1CC(=O)C(O)=O Amb25281136 [0,2,0,0,0,0|0,0,0]=2 5341 B14R1.4474 Cc1ccc(Br)cc1CC(C)C(O)=O Amb24361964 [0,2,0,0,0,0|1,0,1]=4 5342 B14R1.4474 Cc1ccc(Br)cc1C[C@@H](N)C(O)=O Amb25217556 [0,2,0,0,0,0|1,0,1]=4 5343 B14R1.4474 Cc1ccc(Br)cc1C[C@H](N)C(O)=O Amb24664141 [0,2,0,0,0,0|1,0,1]=4 5344 B14R1.4474 Cc1ccc(C)cc1\C=C(\F)/C(O)=O Amb25664440 [0,2,0,0,0,0|1,0,1]=4 5345 B14R1.4474 Cc1ccc(C)cc1\C=C(\N)/C(O)=O Amb24468653 [0,2,0,0,0,0|1,0,1]=4 5346 B14R1.4474 Cc1ccc(Cl)c(CC(C)C(O)=O)c1 Amb25028914 [0,2,0,0,0,0|1,0,1]=4 5347 B14R1.4474 Cc1ccc(Cl)cc1CC(Br)C(O)=O Amb23320627 [0,2,0,0,0,0|1,0,1]=4 5348 B14R1.4474 Cc1ccc(Cl)cc1C[C@@H](N)C(O)=O Amb25363915 [0,2,0,0,0,0|1,0,1]=4 5349 B14R1.4474 Cc1ccc(Cl)cc1C[C@H](N)C(O)=O Amb25786160 [0,2,0,0,0,0|1,0,1]=4 5350 B14R1.4474 Cc1ccc(Cl)cc1NC(=N)C(O)=O Amb25752589 [0,2,0,0,0,0|2,0,0]=4 5351 B14R1.4474 Cc1ccc(F)c(CC(C)C(O)=O)c1 Amb25777200 [0,2,0,0,0,0|1,0,1]=4 5352 B14R1.4474 Cc1ccc(F)c(CC(F)C(O)=O)c1 Amb25284684 [0,2,0,0,0,0|1,0,1]=4 5353 B14R1.4474 Cc1ccc(F)cc1CC(=O)C(O)=O Amb25857137 [0,2,0,0,0,0|0,0,0]=2 5354 B14R1.4474 Cc1ccc(F)cc1CC(C)C(O)=O Amb24732449 [0,2,0,0,0,0|1,0,1]=4 5355 B14R1.4474 Cc1ccc(F)cc1CC(F)C(O)=O Amb25028754 [0,2,0,0,0,0|1,0,1]=4 5356 B14R1.4474 Cc1ccc(F)cc1CC(N)C(O)=O Amb22738112 [0,2,0,0,0,0|1,0,1]=4 5357 B14R1.4474 Cc1ccc(F)cc1CC(O)C(O)=O Amb24688553 [0,2,0,0,0,0|0,0,2]=4 5358 B14R1.4474 Cc1ccc(F)cc1\C=C(\C)/C(O)=O Amb24735639 [0,2,0,0,0,0|1,0,1]=4 5359 B14R1.4474 Cc1ccc(F)cc1\C=C(\F)/C(O)=O Amb25759327 [0,2,0,0,0,0|1,0,1]=4 5360 B14R1.4474 Cc1ccc(F)cc1\C=C(\N)/C(O)=O Amb24685348 [0,2,0,0,0,0|1,0,1]=4 5361 B14R1.4474 Cc1ccc(I)cc1C[C@H](N)C(O)=O Amb25343363 [0,2,0,0,0,0|1,0,1]=4 5362 B14R1.4474 Cc1ccc(N)c(CC(N)C(O)=O)c1 Amb25062542 [0,2,0,0,0,0|1,0,1]=4 5363 B14R1.4474 Cc1ccc(N)cc1CC(N)C(O)=O Amb25701785 [0,2,0,0,0,0|1,0,1]=4 5364 B14R1.4474 Cc1ccc(O)c(CC(C)C(O)=O)c1 Amb24652411 [0,2,0,0,0,0|1,0,1]=4 5365 B14R1.4474 Cc1ccc(O)c(C[C@@H](N)C(O)=O)c1 Amb24712160 [0,2,0,0,0,0|1,0,1]=4 5366 B14R1.4474 Cc1ccc(O)c(C[C@H](N)C(O)=O)c1 Amb24621792 [0,2,0,0,0,0|1,0,1]=4 5367 B14R1.4474 Cc1ccc(O)cc1C[C@@H](N)C(O)=O Amb25340505 [0,2,0,0,0,0|1,0,1]=4 5368 B14R1.4474 Cc1ccc(O)cc1C[C@H](N)C(O)=O Amb25749760 [0,2,0,0,0,0|1,0,1]=4 5369 B14R1.4474 Cc1ccc(c(c1)NC(=O)C(=O)C)C Amb17401502 [0,2,0,0,0,0|2,0,0]=4 5370 B14R1.4474 Cc1ccc(cc1CC(C(=O)O)Cl)C Amb17204441 [0,2,0,0,0,0|1,0,1]=4 5371 B14R1.4474 Cc1ccc(cc1CC(C(=O)O)Cl)Cl Amb17204586 [0,2,0,0,0,0|1,0,1]=4 5372 B14R1.4474 Cc1ccc(cc1NC(=O)C(=O)C)Cl Amb17404133 [0,2,0,0,0,0|2,0,0]=4 5373 B14R1.4474 Cc1ccc(cc1NC(=O)C(=O)N)Cl Amb1860023 [0,2,0,0,0,0|2,0,0]=4 5374 B14R1.4474 NC(Cc1cc(Br)ccc1Cl)C(O)=O Amb25193399 [0,2,0,0,0,0|1,0,1]=4 5375 B14R1.4474 NC(Cc1cc(Cl)ccc1F)C(O)=O Amb18225658 [0,2,0,0,0,0|1,0,1]=4 5376 B14R1.4474 NC(Cc1cc(Cl)ccc1O)C(O)=O Amb19000855 [0,2,0,0,0,0|1,0,1]=4 5377 B14R1.4474 NC(Cc1cc(F)ccc1Cl)C(O)=O Amb18769201 [0,2,0,0,0,0|1,0,1]=4 5378 B14R1.4474 NC(Cc1cc(F)ccc1I)C(O)=O Amb24375672 [0,2,0,0,0,0|1,0,1]=4 5379 B14R1.4474 NC(Cc1cc(I)ccc1I)C(O)=O Amb25322230 [0,2,0,0,0,0|1,0,1]=4 5380 B14R1.4474 NC(Cc1cc(O)ccc1Br)C(O)=O Amb18668185 [0,2,0,0,0,0|1,0,1]=4 5381 B14R1.4474 NC(Cc1cc(O)ccc1Cl)C(O)=O Amb25287152 [0,2,0,0,0,0|1,0,1]=4 5382 B14R1.4474 NC(Cc1cc(O)ccc1F)C(O)=O Amb18130582 [0,2,0,0,0,0|1,0,1]=4 5383 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1Cl)C(O)=O Amb24678954 [0,2,0,0,0,0|1,0,1]=4 5384 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1F)C(O)=O Amb25062850 [0,2,0,0,0,0|1,0,1]=4 5385 B14R1.4474 N[C@@H](Cc1cc(Br)ccc1O)C(O)=O Amb25726419 [0,2,0,0,0,0|1,0,1]=4 5386 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Br)C(O)=O Amb25727085 [0,2,0,0,0,0|1,0,1]=4 5387 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Cl)C(O)=O Amb22228353 [0,2,0,0,0,0|1,0,1]=4 5388 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1Cl)C(O)=O Amb23399720 [0,2,0,0,0,0|1,0,1]=4 5389 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1F)C(O)=O Amb25793157 [0,2,0,0,0,0|1,0,1]=4 5390 B14R1.4474 N[C@@H](Cc1cc(Cl)ccc1I)C(O)=O Amb25783838 [0,2,0,0,0,0|1,0,1]=4 5391 B14R1.4474 N[C@@H](Cc1cc(F)ccc1F)C(O)=O Amb19087680 [0,2,0,0,0,0|1,0,1]=4 5392 B14R1.4474 N[C@@H](Cc1cc(F)ccc1I)C(O)=O Amb25066516 [0,2,0,0,0,0|1,0,1]=4 5393 B14R1.4474 N[C@@H](Cc1cc(I)ccc1Cl)C(O)=O Amb24451620 [0,2,0,0,0,0|1,0,1]=4 5394 B14R1.4474 N[C@@H](Cc1cc(O)ccc1O)C(O)=O Amb22228356 [0,2,0,0,0,0|1,0,1]=4 5395 B14R1.4474 N[C@H](Cc1cc(Br)ccc1Br)C(O)=O Amb25841588 [0,2,0,0,0,0|1,0,1]=4 5396 B14R1.4474 N[C@H](Cc1cc(Br)ccc1Cl)C(O)=O Amb25691521 [0,2,0,0,0,0|1,0,1]=4 5397 B14R1.4474 N[C@H](Cc1cc(Br)ccc1O)C(O)=O Amb25354524 [0,2,0,0,0,0|1,0,1]=4 5398 B14R1.4474 N[C@H](Cc1cc(Cl)ccc1Cl)C(O)=O Amb22228352 [0,2,0,0,0,0|1,0,1]=4 5399 B14R1.4474 N[C@H](Cc1cc(Cl)ccc1I)C(O)=O Amb24467769 [0,2,0,0,0,0|1,0,1]=4 5400 B14R1.4474 N[C@H](Cc1cc(Cl)ccc1O)C(O)=O Amb25792747 [0,2,0,0,0,0|1,0,1]=4 5401 B14R1.4474 N[C@H](Cc1cc(F)ccc1F)C(O)=O Amb19887665 [0,2,0,0,0,0|1,0,1]=4 5402 B14R1.4474 N[C@H](Cc1cc(F)ccc1I)C(O)=O Amb24603871 [0,2,0,0,0,0|1,0,1]=4 5403 B14R1.4474 N[C@H](Cc1cc(O)ccc1F)C(O)=O Amb25724385 [0,2,0,0,0,0|1,0,1]=4 5404 B14R1.4474 N[C@H](Cc1cc(O)ccc1O)C(O)=O Amb22228355 [0,2,0,0,0,0|1,0,1]=4 5405 B14R1.4474 N\C(=C\c1cc(Cl)ccc1Cl)\C(O)=O Amb25085548 [0,2,0,0,0,0|1,0,1]=4 5406 B14R1.4474 N\C(=C\c1cc(F)ccc1Cl)\C(O)=O Amb24444594 [0,2,0,0,0,0|1,0,1]=4 5407 B14R1.4474 Nc1cc(C[C@H](N)C(O)=O)c(N)cc1 Amb25708458 [0,2,0,0,0,0|1,0,1]=4 5408 B14R1.4474 Nc1cc(\C=C(\Cl)/C(O)=O)c(Cl)cc1 Amb24623661 [0,2,0,0,0,0|1,0,1]=4 5409 B14R1.4474 Nc1ccc(Br)cc1CC(N)C(O)=O Amb24399924 [0,2,0,0,0,0|1,0,1]=4 5410 B14R1.4474 Nc1ccc(Cl)c(C[C@@H](N)C(O)=O)c1 Amb24425013 [0,2,0,0,0,0|1,0,1]=4 5411 B14R1.4474 Nc1ccc(Cl)cc1CC(N)C(O)=O Amb25707564 [0,2,0,0,0,0|1,0,1]=4 5412 B14R1.4474 Nc1ccc(Cl)cc1C[C@@H](N)C(O)=O Amb24664382 [0,2,0,0,0,0|1,0,1]=4 5413 B14R1.4474 Nc1ccc(F)c(CC(N)C(O)=O)c1 Amb25063755 [0,2,0,0,0,0|1,0,1]=4 5414 B14R1.4474 Nc1ccc(F)c(C[C@@H](N)C(O)=O)c1 Amb25342014 [0,2,0,0,0,0|1,0,1]=4 5415 B14R1.4474 Nc1ccc(F)c(C[C@H](N)C(O)=O)c1 Amb25360924 [0,2,0,0,0,0|1,0,1]=4 5416 B14R1.4474 Nc1ccc(F)cc1CC(N)C(O)=O Amb18652765 [0,2,0,0,0,0|1,0,1]=4 5417 B14R1.4474 Nc1ccc(F)cc1C[C@@H](N)C(O)=O Amb24402834 [0,2,0,0,0,0|1,0,1]=4 5418 B14R1.4474 Nc1ccc(F)cc1C[C@H](N)C(O)=O Amb25131679 [0,2,0,0,0,0|1,0,1]=4 5419 B14R1.4474 Nc1ccc(O)c(CC(N)C(O)=O)c1 Amb25128000 [0,2,0,0,0,0|1,0,1]=4 5420 B14R1.4474 Nc1ccc(O)c(C[C@@H](N)C(O)=O)c1 Amb24655929 [0,2,0,0,0,0|1,0,1]=4 5421 B14R1.4474 Nc1ccc(O)cc1CC(N)C(O)=O Amb25127999 [0,2,0,0,0,0|1,0,1]=4 5422 B14R1.4474 Nc1ccc(O)cc1C[C@H](N)C(O)=O Amb25378751 [0,2,0,0,0,0|1,0,1]=4 5423 B14R1.4474 OC(=O)C(=O)Cc1cc(Br)ccc1F Amb1139984 [0,2,0,0,0,0|0,0,0]=2 5424 B14R1.4474 OC(=O)C(=O)Cc1cc(F)ccc1Br Amb25028844 [0,2,0,0,0,0|0,0,0]=2 5425 B14R1.4474 OC(=O)C(=O)Nc1cc(Br)ccc1Br Amb25697333 [0,2,0,0,0,0|1,0,0]=3 5426 B14R1.4474 OC(=O)C(=O)Nc1cc(Cl)ccc1Br Amb24451440 [0,2,0,0,0,0|1,0,0]=3 5427 B14R1.4474 OC(=O)C(Cc1cc(Cl)ccc1Cl)Br Amb10596988 [0,2,0,0,0,0|1,0,1]=4 5428 B14R1.4474 OC(=O)C(Cc1cc(Cl)ccc1Cl)Cl Amb17204774 [0,2,0,0,0,0|1,0,1]=4 5429 B14R1.4474 OC(=O)C(Cc1cc(O)ccc1O)N Amb17595220 [0,2,0,0,0,0|1,0,1]=4 5430 B14R1.4474 OC(=O)C(F)Cc1cc(Br)ccc1F Amb24586119 [0,2,0,0,0,0|1,0,1]=4 5431 B14R1.4474 OC(=O)C(F)Cc1cc(Cl)ccc1Cl Amb24717269 [0,2,0,0,0,0|1,0,1]=4 5432 B14R1.4474 OC(=O)C(F)Cc1cc(Cl)ccc1F Amb25229337 [0,2,0,0,0,0|1,0,1]=4 5433 B14R1.4474 OC(=O)C(F)Cc1cc(F)ccc1Br Amb25200744 [0,2,0,0,0,0|1,0,1]=4 5434 B14R1.4474 OC(=O)C(F)Cc1cc(F)ccc1F Amb24375896 [0,2,0,0,0,0|1,0,1]=4 5435 B14R1.4474 OC(=O)C(O)Cc1cc(Cl)ccc1Cl Amb25193286 [0,2,0,0,0,0|0,0,2]=4 5436 B14R1.4474 OC(=O)\C(\F)=C\c1cc(Br)ccc1Cl Amb25313018 [0,2,0,0,0,0|1,0,1]=4 5437 B14R1.4474 OC(=O)\C(\F)=C\c1cc(Br)ccc1F Amb25697829 [0,2,0,0,0,0|1,0,1]=4 5438 B14R1.4474 OC(=O)\C(\F)=C\c1cc(Cl)ccc1F Amb25050746 [0,2,0,0,0,0|1,0,1]=4 5439 B14R1.4474 OC(=O)\C(\F)=C\c1cc(F)ccc1Br Amb24399457 [0,2,0,0,0,0|1,0,1]=4 5440 B14R1.4474 Oc1cc(CC(O)C(O)=O)c(O)cc1 Amb24498275 [0,2,0,0,0,0|0,0,2]=4 5441 B14R1.243 C=C(C(O)c1ccccc1Cl)C(N)=O Amb25698344 [0,2,0,0,0,0|2,0,0]=4 5442 B14R1.243 C=C([C@@H](N)c1ccccc1Cl)C(N)=O Amb25112067 [0,2,0,0,0,0|2,0,0]=4 5443 B14R1.243 C=C([C@@H](O)c1ccccc1Cl)C(N)=O Amb25703667 [0,2,0,0,0,0|2,0,0]=4 5444 B14R1.243 C=C([C@H](O)c1ccccc1Cl)C(N)=O Amb25132259 [0,2,0,0,0,0|2,0,0]=4 5445 B14R1.243 CC(=O)C(=C)[C@@H](O)c1ccccc1F Amb25236478 [0,2,0,0,0,0|2,0,0]=4 5446 B14R1.243 CC(=O)C(=C)[C@H](O)c1ccccc1F Amb25748817 [0,2,0,0,0,0|2,0,0]=4 5447 B14R1.243 CC(C(C)c1ccccc1Br)C(O)=O Amb25200833 [0,2,0,0,0,0|1,0,1]=4 5448 B14R1.243 CC(C(C)c1ccccc1Cl)C(O)=O Amb24521299 [0,2,0,0,0,0|1,0,1]=4 5449 B14R1.243 CC(C(F)C(O)=O)c1ccccc1F Amb25165246 [0,2,0,0,0,0|1,0,1]=4 5450 B14R1.243 CC(C(N)C(O)=O)c1ccccc1Br Amb24679388 [0,2,0,0,0,0|1,0,1]=4 5451 B14R1.243 CC(C(N)C(O)=O)c1ccccc1N Amb18651900 [0,2,0,0,0,0|1,0,1]=4 5452 B14R1.243 CC(C(N)c1ccccc1N)C(O)=O Amb25247358 [0,2,0,0,0,0|1,0,1]=4 5453 B14R1.243 CC(C(O)C(O)=O)c1ccccc1Br Amb25301573 [0,2,0,0,0,0|0,0,2]=4 5454 B14R1.243 CN(c1ccccc1F)C(=O)C(O)=O Amb18957815 [0,2,0,0,0,0|1,0,0]=3 5455 B14R1.243 C[C@H]([C@@H](N)C(O)=O)c1ccccc1N Amb24355363 [0,2,0,0,0,0|1,0,1]=4 5456 B14R1.243 C[C@H]([C@H](N)C(O)=O)c1ccccc1N Amb25193515 [0,2,0,0,0,0|1,0,1]=4 5457 B14R1.243 C\C(=C(\F)/C(O)=O)\c1ccccc1Br Amb25721360 [0,2,0,0,0,0|1,0,1]=4 5458 B14R1.243 C\C(\c1ccccc1F)=C(\F)/C(O)=O Amb25823640 [0,2,0,0,0,0|1,0,1]=4 5459 B14R1.243 Cc1ccccc1C(C)C(=C)C(O)=O Amb25815056 [0,2,0,0,0,0|1,0,0]=3 5460 B14R1.243 Cc1ccccc1C(C)C(C)C(O)=O Amb24552960 [0,2,0,0,0,0|1,0,1]=4 5461 B14R1.243 Cc1ccccc1C(C)C(F)C(O)=O Amb25165245 [0,2,0,0,0,0|1,0,1]=4 5462 B14R1.243 Cc1ccccc1C(C)C(O)C(O)=O Amb25779784 [0,2,0,0,0,0|0,0,2]=4 5463 B14R1.243 Cc1ccccc1C(O)C(N)C(O)=O Amb18814159 [0,2,0,0,0,0|1,0,1]=4 5464 B14R1.243 Cc1ccccc1C(O)[C@H](N)C(O)=O Amb25725073 [0,2,0,0,0,0|1,0,1]=4 5465 B14R1.243 Cc1ccccc1N(C)C(=O)C(O)=O Amb18957789 [0,2,0,0,0,0|1,0,0]=3 5466 B14R1.243 Cc1ccccc1[C@@H](N)[C@@H](O)C(O)=O Amb22756711 [0,2,0,0,0,0|0,0,2]=4 5467 B14R1.243 Cc1ccccc1[C@@H](N)[C@H](O)C(O)=O Amb24727642 [0,2,0,0,0,0|0,0,2]=4 5468 B14R1.243 Cc1ccccc1[C@H](N)[C@H](O)C(O)=O Amb25850769 [0,2,0,0,0,0|0,0,2]=4 5469 B14R1.243 NC(C(O)C(O)=O)c1ccccc1Br Amb24670417 [0,2,0,0,0,0|0,0,2]=4 5470 B14R1.243 NC(C(O)C(O)=O)c1ccccc1F Amb24419847 [0,2,0,0,0,0|0,0,2]=4 5471 B14R1.243 NC(C(O)c1ccccc1Br)C(O)=O Amb18692060 [0,2,0,0,0,0|1,0,1]=4 5472 B14R1.243 NC(C(O)c1ccccc1Cl)C(O)=O Amb18170660 [0,2,0,0,0,0|1,0,1]=4 5473 B14R1.243 NC(C(O)c1ccccc1F)C(O)=O Amb24652416 [0,2,0,0,0,0|1,0,1]=4 5474 B14R1.243 NC(C(O)c1ccccc1O)C(O)=O Amb24365903 [0,2,0,0,0,0|1,0,1]=4 5475 B14R1.243 N[C@@H](C(O)c1ccccc1F)C(O)=O Amb24651121 [0,2,0,0,0,0|1,0,1]=4 5476 B14R1.243 N[C@@H](C(O)c1ccccc1O)C(O)=O Amb25798965 [0,2,0,0,0,0|1,0,1]=4 5477 B14R1.243 N[C@@H]([C@@H](O)C(O)=O)c1ccccc1F Amb22756700 [0,2,0,0,0,0|0,0,2]=4 5478 B14R1.243 N[C@@H]([C@@H](O)c1ccccc1Br)C(O)=O Amb24710896 [0,2,0,0,0,0|1,0,1]=4 5479 B14R1.243 N[C@@H]([C@@H](O)c1ccccc1O)C(O)=O Amb25664914 [0,2,0,0,0,0|1,0,1]=4 5480 B14R1.243 N[C@@H]([C@H](O)C(O)=O)c1ccccc1Br Amb24638195 [0,2,0,0,0,0|0,0,2]=4 5481 B14R1.243 N[C@@H]([C@H](O)c1ccccc1Cl)C(O)=O Amb25324164 [0,2,0,0,0,0|1,0,1]=4 5482 B14R1.243 N[C@H]([C@@H](O)C(O)=O)c1ccccc1Br Amb25248799 [0,2,0,0,0,0|0,0,2]=4 5483 B14R1.243 N[C@H]([C@@H](O)c1ccccc1Cl)C(O)=O Amb25119158 [0,2,0,0,0,0|1,0,1]=4 5484 B14R1.243 N[C@H]([C@@H](O)c1ccccc1O)C(O)=O Amb24710044 [0,2,0,0,0,0|1,0,1]=4 5485 B14R1.243 OC(=O)C(C(c1ccccc1Br)Br)Br Amb17612539 [0,2,0,0,0,0|1,0,1]=4 5486 B14R1.243 OC(=O)C(C(c1ccccc1Br)N)C Amb17473599 [0,2,0,0,0,0|1,0,1]=4 5487 B14R1.243 OC(=O)C(C(c1ccccc1C)N)C Amb17470838 [0,2,0,0,0,0|1,0,1]=4 5488 B14R1.243 OC(=O)C(C(c1ccccc1Cl)N)C Amb17471476 [0,2,0,0,0,0|1,0,1]=4 5489 B14R1.243 OC(=O)C(C(c1ccccc1F)N)C Amb17470952 [0,2,0,0,0,0|1,0,1]=4 5490 B14R1.243 OC(=O)C(C(c1ccccc1N)O)N Amb2228469 [0,2,0,0,0,0|1,0,1]=4 5491 B14R1.1017 CC(C(C(=O)O)C#N)c1ccccc1 Amb17089331 [0,2,0,0,0,0|1,0,1]=4 5492 B14R1.1017 CC(\C(=N\O)\C(O)=O)c1ccccc1 Amb25756389 [0,2,0,0,0,0|0,0,1]=3 5493 B14R1.1017 CCC(C(O)c1ccccc1)C(O)=O Amb19022377 [0,2,0,0,0,0|1,0,1]=4 5494 B14R1.1017 CO\C(\C(O)=O)=C(/F)\c1ccccc1 Amb25672650 [0,2,0,0,0,0|0,0,2]=4 5495 B14R1.1017 C\C=C(\C(O)=O)/S(=O)c1ccccc1 Amb24756691 [0,2,0,0,0,0|2,0,0]=4 5496 B14R1.1017 N#C\C(=C(/c1ccccc1)\C)\C(=O)O Amb17089312 [0,2,0,0,0,0|1,0,1]=4 5497 B14R1.1017 OC(=O)\C(=N/O)\C(F)c1ccccc1 Amb25279502 [0,2,0,0,0,0|0,0,1]=3 5498 B14R1.1027 CCN(C(=O)C(=O)C)c1ccccc1 Amb17401508 [0,2,0,0,0,0|2,0,0]=4 5499 B14R1.1027 CC\C(=C(\F)/C(O)=O)\c1ccccc1 Amb25677009 [0,2,0,0,0,0|1,0,1]=4 5500 B14R1.1027 OC(=O)C(=O)\C(=C\O)\c1ccccc1 Amb24580465 [0,2,0,0,0,0|0,0,1]=3 5501 B14R1.1027 OC(=O)\C(\O)=C(\C=O)/c1ccccc1 Amb24670446 [0,2,0,0,0,0|0,0,2]=4 5502 B14R1.6306 CC(=C)C(=O)C(C)(C)c1ccccc1 Amb25310729 [0,2,0,0,0,0|2,0,0]=4 5503 B14R1.6306 CC(=C)C(=O)C(C)(N)c1ccccc1 Amb24400960 [0,2,0,0,0,0|2,0,0]=4 5504 B14R1.6306 CC(C(O)=O)C(C)(O)c1ccccc1 Amb18990602 [0,2,0,0,0,0|1,0,1]=4 5505 B14R1.6306 CC(C)(C(O)C(O)=O)c1ccccc1 Amb18651885 [0,2,0,0,0,0|0,0,2]=4 5506 B14R1.6306 CC(C)(C(S)C(O)=O)c1ccccc1 Amb25119225 [0,2,0,0,0,0|0,1,1]=4 5507 B14R1.6306 CC(C)([C@H](C)C(O)=O)c1ccccc1 Amb24498135 [0,2,0,0,0,0|1,0,1]=4 5508 B14R1.6306 CC(F)(C(N)C(O)=O)c1ccccc1 Amb25341618 [0,2,0,0,0,0|1,0,1]=4 5509 B14R1.6306 CC(O)(C(Cl)C(O)=O)c1ccccc1 Amb24452133 [0,2,0,0,0,0|1,0,1]=4 5510 B14R1.6306 CC(O)(C(N)C(O)=O)c1ccccc1 Amb25672532 [0,2,0,0,0,0|1,0,1]=4 5511 B14R1.6306 C[C@@H](C(O)=O)[C@](C)(O)c1ccccc1 Amb25164442 [0,2,0,0,0,0|1,0,1]=4 5512 B14R1.6306 C[C@@](N)([C@H](C)C(O)=O)c1ccccc1 Amb19929617 [0,2,0,0,0,0|1,0,1]=4 5513 B14R1.6306 C[C@](N)([C@H](C)C(O)=O)c1ccccc1 Amb19929616 [0,2,0,0,0,0|1,0,1]=4 5514 B14R1.6306 C[C@](O)([C@@H](F)C(O)=O)c1ccccc1 Amb24498134 [0,2,0,0,0,0|1,0,1]=4 5515 B14R1.6306 NC(C(O)=O)C(F)(F)c1ccccc1 Amb22325271 [0,2,0,0,0,0|1,0,1]=4 5516 B14R1.6306 O=C(C(c1ccccc1)(F)F)C(=O)O Amb10841761 [0,2,0,0,0,0|0,0,0]=2 5517 B14R1.6306 OC(=O)C(=O)C(F)(F)c1ccccc1 Amb22325268 [0,2,0,0,0,0|0,0,0]=2 5518 B14R1.6306 [2H]C([2H])(C(N)C(O)=O)c1ccccc1 Amb22363149 [0,2,0,0,0,0|1,0,1]=4 5519 B14R1.6306 [2H]C([2H])([C@H](N)C(O)=O)c1ccccc1 Amb22367257 [0,2,0,0,0,0|1,0,1]=4 5520 B14R1.6391 CC(C(C(=O)O)(C)C)c1ccccc1 Amb17333790 [0,2,0,0,0,0|1,0,1]=4 5521 B14R1.6391 CC(C)(C(N)c1ccccc1)C(O)=O Amb18651525 [0,2,0,0,0,0|1,0,1]=4 5522 B14R1.6391 CC(C)(C(N)c1ccccc1)C(O)=O Amb20623909 [0,2,0,0,0,0|1,0,1]=4 5523 B14R1.6391 CC(C)([C@H](C)c1ccccc1)C(O)=O Amb24498119 [0,2,0,0,0,0|1,0,1]=4 5524 B14R1.6391 CC(C)([C@H](N)c1ccccc1)C(O)=O Amb25183035 [0,2,0,0,0,0|1,0,1]=4 5525 B14R1.6391 CC(Cl)(C(O)c1ccccc1)C(O)=O Amb24574677 [0,2,0,0,0,0|1,0,1]=4 5526 B14R1.6391 CC(c1ccccc1)C(C)(O)C(O)=O Amb20623542 [0,2,0,0,0,0|0,0,2]=4 5527 B14R1.6391 C[C@@](O)([C@H](N)c1ccccc1)C(O)=O Amb22748830 [0,2,0,0,0,0|0,0,2]=4 5528 B14R1.6391 C[C@](N)([C@H](C)c1ccccc1)C(O)=O Amb24739555 [0,2,0,0,0,0|1,0,1]=4 5529 B14R1.6391 C[C@](N)([C@H](O)c1ccccc1)C(O)=O Amb25279530 [0,2,0,0,0,0|1,0,1]=4 5530 B14R1.6391 C[C@](O)([C@@H](N)c1ccccc1)C(O)=O Amb24373205 [0,2,0,0,0,0|0,0,2]=4 5531 B14R1.6391 N[C@@H](c1ccccc1)C(F)(F)C(O)=O Amb19929520 [0,2,0,0,0,0|1,0,1]=4 5532 B14R1.6391 N[C@@H](c1ccccc1)C(F)(F)C(O)=O Amb24499222 [0,2,0,0,0,0|1,0,1]=4 5533 B14R1.6391 N[C@H](c1ccccc1)C(F)(F)C(O)=O Amb19929519 [0,2,0,0,0,0|1,0,1]=4 5534 B14R1.6391 N[C@H](c1ccccc1)C(F)(F)C(O)=O Amb25117836 [0,2,0,0,0,0|1,0,1]=4 5535 B14R1.6391 OC(=O)C(O)(O)C(F)c1ccccc1 Amb25756176 [0,2,0,0,0,0|0,0,2]=4 5536 B14R1.10526 OC(C(=O)C(O)(C)C)c1ccccc1 Amb10564681 [0,2,0,0,0,0|1,0,1]=4 5537 B14R1.550 C=C=C(Cc1ccccc1F)C(O)=O Amb25363205 [0,2,0,0,0,0|1,0,0]=3 5538 B14R1.550 CCC(C(=O)O)Cc1ccccc1Br Amb17605817 [0,2,0,0,0,0|1,0,1]=4 5539 B14R1.550 CC\C(=C/c1ccccc1O)\C(O)=O Amb24355404 [0,2,0,0,0,0|1,0,1]=4 5540 B14R1.550 COC(Cc1ccccc1Cl)C(O)=O Amb23320999 [0,2,0,0,0,0|0,0,2]=4 5541 B14R1.550 COC(Cc1ccccc1F)C(O)=O Amb23320945 [0,2,0,0,0,0|0,0,2]=4 5542 B14R1.550 CO\C(=C/c1ccccc1Cl)\C(O)=O Amb25055864 [0,2,0,0,0,0|0,0,2]=4 5543 B14R1.550 CO\C(=C/c1ccccc1N)\C(O)=O Amb24498070 [0,2,0,0,0,0|0,0,2]=4 5544 B14R1.550 CO\C(=C/c1ccccc1O)\C(O)=O Amb23512577 [0,2,0,0,0,0|0,0,2]=4 5545 B14R1.550 CO\C(=C\c1ccccc1Cl)\C(O)=O Amb24680302 [0,2,0,0,0,0|0,0,2]=4 5546 B14R1.550 CS\C(=C\c1ccccc1O)\C(O)=O Amb25844441 [0,2,0,0,0,0|0,1,1]=4 5547 B14R1.550 C\C=C(/Oc1ccccc1F)\C(O)=O Amb25109334 [0,2,0,0,0,0|2,0,0]=4 5548 B14R1.550 C\C=C(\Oc1ccccc1O)/C(O)=O Amb18651672 [0,2,0,0,0,0|2,0,0]=4 5549 B14R1.550 Cc1ccccc1CC(CN)C(O)=O Amb20622916 [0,2,0,0,0,0|1,0,1]=4 5550 B14R1.550 Cc1ccccc1CC(OC)C(O)=O Amb23320703 [0,2,0,0,0,0|0,0,2]=4 5551 B14R1.550 N#CC(C(=O)O)Cc1ccccc1C Amb17090110 [0,2,0,0,0,0|1,0,1]=4 5552 B14R1.550 N#CC(C(=O)O)Cc1ccccc1F Amb17090113 [0,2,0,0,0,0|1,0,1]=4 5553 B14R1.550 N#CC(Cc1ccccc1O)C(O)=O Amb24602491 [0,2,0,0,0,0|1,0,1]=4 5554 B14R1.550 N#C\C(=C/c1ccccc1Cl)\C(=O)O Amb1129050 [0,2,0,0,0,0|1,0,1]=4 5555 B14R1.550 NCC(Cc1ccccc1Cl)C(O)=O Amb19419125 [0,2,0,0,0,0|1,0,1]=4 5556 B14R1.550 NC\C(=C/c1ccccc1Cl)\C(O)=O Amb25185808 [0,2,0,0,0,0|1,0,1]=4 5557 B14R1.550 NC\C(=C/c1ccccc1F)\C(O)=O Amb25321899 [0,2,0,0,0,0|1,0,1]=4 5558 B14R1.550 NC\C(=C\c1ccccc1F)\C(O)=O Amb25176149 [0,2,0,0,0,0|1,0,1]=4 5559 B14R1.550 OC(=O)\C(\Cc1ccccc1Cl)=N/O Amb24741771 [0,2,0,0,0,0|0,0,1]=3 5560 B14R1.3135 CCc1ccccc1CC(Br)C(O)=O Amb23320611 [0,2,0,0,0,0|1,0,1]=4 5561 B14R1.3135 CCc1ccccc1\C=C(\F)/C(O)=O Amb25089778 [0,2,0,0,0,0|1,0,1]=4 5562 B14R1.3135 CCc1ccccc1\C=C(\N)/C(O)=O Amb25170655 [0,2,0,0,0,0|1,0,1]=4 5563 B14R1.3135 COc1ccccc1CC(=O)C(=O)O Amb1135187 [0,2,0,0,0,0|0,0,0]=2 5564 B14R1.3135 COc1ccccc1CC(Br)C(O)=O Amb23320635 [0,2,0,0,0,0|1,0,1]=4 5565 B14R1.3135 COc1ccccc1CC(C(=O)O)O Amb17139587 [0,2,0,0,0,0|0,0,2]=4 5566 B14R1.3135 COc1ccccc1C[C@@H](N)C(O)=O Amb19063345 [0,2,0,0,0,0|1,0,1]=4 5567 B14R1.3135 COc1ccccc1C[C@H](N)C(O)=O Amb22641421 [0,2,0,0,0,0|1,0,1]=4 5568 B14R1.3135 COc1ccccc1NC(=N)C(O)=O Amb18651744 [0,2,0,0,0,0|2,0,0]=4 5569 B14R1.3135 COc1ccccc1NC(=O)C(=O)C Amb17401706 [0,2,0,0,0,0|2,0,0]=4 5570 B14R1.3135 COc1ccccc1NC(=O)C(=O)N Amb1859558 [0,2,0,0,0,0|2,0,0]=4 5571 B14R1.3135 COc1ccccc1NC(=S)C(O)=O Amb19895263 [0,2,0,0,0,0|1,1,0]=4 5572 B14R1.3135 COc1ccccc1\C=C(/Cl)\C(O)=O Amb24451785 [0,2,0,0,0,0|1,0,1]=4 5573 B14R1.3135 C\C(=C/c1ccccc1SC)\C(O)=O Amb24526983 [0,2,0,0,0,0|1,0,1]=4 5574 B14R1.3135 C\C(=C\c1ccccc1C#C)\C(O)=O Amb25210681 [0,2,0,0,0,0|1,0,1]=4 5575 B14R1.3135 N#Cc1ccc[n]c1NC(=O)C(O)=O Amb24651124 [0,2,0,0,0,0|2,0,0]=4 5576 B14R1.3135 N#Cc1ccccc1NC(=O)C(=O)C Amb17401162 [0,2,0,0,0,0|2,0,0]=4 5577 B14R1.3135 N#Cc1ccccc1\C=C(/F)\C(O)=O Amb25743184 [0,2,0,0,0,0|1,0,1]=4 5578 B14R1.3135 NC(Cc1ccccc1C#N)C(O)=O Amb21858527 [0,2,0,0,0,0|1,0,1]=4 5579 B14R1.3135 OC(=O)C(=O)Nc1ccccc1C=O Amb25818456 [0,2,0,0,0,0|1,0,0]=3 5580 B14R1.5881 Cc1ccccc1CC(=O)C(C)(C)O Amb25340993 [0,2,0,0,0,0|1,0,1]=4 5581 B14R1.5882 CC(C)(Cc1ccccc1Br)C(O)=O Amb18586155 [0,2,0,0,0,0|1,0,1]=4 5582 B14R1.5882 CC(F)(Cc1ccccc1O)C(O)=O Amb25223949 [0,2,0,0,0,0|1,0,1]=4 5583 B14R1.5882 CC(N)(Cc1ccccc1I)C(O)=O Amb24575213 [0,2,0,0,0,0|1,0,1]=4 5584 B14R1.5882 CC(N)(Cc1ccccc1N)C(O)=O Amb18651899 [0,2,0,0,0,0|1,0,1]=4 5585 B14R1.5882 CC(O)(Cc1ccccc1Br)C(O)=O Amb25770677 [0,2,0,0,0,0|0,0,2]=4 5586 B14R1.5882 C[C@@](N)(Cc1ccccc1F)C(O)=O Amb25853608 [0,2,0,0,0,0|1,0,1]=4 5587 B14R1.5882 C[C@@](N)(Cc1ccccc1O)C(O)=O Amb25036864 [0,2,0,0,0,0|1,0,1]=4 5588 B14R1.5882 C[C@@](O)(Cc1ccccc1F)C(O)=O Amb25672596 [0,2,0,0,0,0|0,0,2]=4 5589 B14R1.5882 C[C@](N)(Cc1ccccc1F)C(O)=O Amb24355369 [0,2,0,0,0,0|1,0,1]=4 5590 B14R1.5882 C[C@](N)(Cc1ccccc1O)C(O)=O Amb24499040 [0,2,0,0,0,0|1,0,1]=4 5591 B14R1.5882 C[C@](O)(Cc1ccccc1F)C(O)=O Amb25076779 [0,2,0,0,0,0|0,0,2]=4 5592 B14R1.5882 Cc1ccccc1CC(C)(O)C(O)=O Amb25683429 [0,2,0,0,0,0|0,0,2]=4 5593 B14R1.5882 Cc1ccccc1C[C@@](C)(N)C(O)=O Amb24390266 [0,2,0,0,0,0|1,0,1]=4 5594 B14R1.5882 Cc1ccccc1C[C@](C)(O)C(O)=O Amb25265236 [0,2,0,0,0,0|0,0,2]=4 5595 B14R1.5882 OC(=O)C(Cc1ccccc1C)(C)C Amb17235386 [0,2,0,0,0,0|1,0,1]=4 5596 B14R1.5882 OC(=O)C(Cc1ccccc1C)(N)C Amb17235614 [0,2,0,0,0,0|1,0,1]=4 5597 B14R1.5882 OC(=O)C(Cc1ccccc1Cl)(C)C Amb17241246 [0,2,0,0,0,0|1,0,1]=4 5598 B14R1.5882 OC(=O)C(Cc1ccccc1Cl)(N)C Amb17241538 [0,2,0,0,0,0|1,0,1]=4 5599 B14R1.5882 OC(=O)C(Cc1ccccc1F)(C)C Amb17236374 [0,2,0,0,0,0|1,0,1]=4 5600 B14R1.5882 OC(=O)C(Cc1ccccc1F)(N)C Amb17236543 [0,2,0,0,0,0|1,0,1]=4 5601 B14R1.5882 OC(=O)[C@](Cc1ccccc1Br)(N)C Amb10066902 [0,2,0,0,0,0|1,0,1]=4 5602 B14R1.5882 OC(=O)[C@](Cc1ccccc1I)(N)C Amb10066903 [0,2,0,0,0,0|1,0,1]=4 5603 B14R1.5971 CC(=C)C(=O)Cc1c(Cl)cccc1Cl Amb24421200 [0,2,0,0,0,0|2,0,0]=4 5604 B14R1.5971 CC(=C)C(=O)Cc1c(F)cccc1Cl Amb24521718 [0,2,0,0,0,0|2,0,0]=4 5605 B14R1.5971 CC(=O)C(=O)Nc1c(F)cccc1F Amb25828461 [0,2,0,0,0,0|2,0,0]=4 5606 B14R1.5971 CC(Cc1c(C)cccc1C)C(O)=O Amb24429140 [0,2,0,0,0,0|1,0,1]=4 5607 B14R1.5971 CC(Cc1c(Cl)cccc1Br)C(O)=O Amb24659007 [0,2,0,0,0,0|1,0,1]=4 5608 B14R1.5971 CC(Cc1c(Cl)cccc1Cl)C(O)=O Amb24360048 [0,2,0,0,0,0|1,0,1]=4 5609 B14R1.5971 CC(Cc1c(F)cccc1O)C(O)=O Amb25311434 [0,2,0,0,0,0|1,0,1]=4 5610 B14R1.5971 CC1=CC=CC(=O)N1CC(=C)C(O)=O Amb24670194 [0,2,0,0,0,0|2,0,0]=4 5611 B14R1.5971 C\C(=C/c1c(Cl)cccc1C)\C(O)=O Amb24664320 [0,2,0,0,0,0|1,0,1]=4 5612 B14R1.5971 C\C(=C/c1c(Cl)cccc1Cl)\C(O)=O Amb24451109 [0,2,0,0,0,0|1,0,1]=4 5613 B14R1.5971 C\C(=C\c1c(C)cccc1C)\C(O)=O Amb24506298 [0,2,0,0,0,0|1,0,1]=4 5614 B14R1.5971 C\C(=C\c1c(Cl)cccc1Cl)\C(O)=O Amb25181900 [0,2,0,0,0,0|1,0,1]=4 5615 B14R1.5971 C\C(=C\c1c(F)cccc1Cl)\C(O)=O Amb24380220 [0,2,0,0,0,0|1,0,1]=4 5616 B14R1.5971 Cc1cc[n]c(C)c1NC(=O)C(O)=O Amb25801366 [0,2,0,0,0,0|2,0,0]=4 5617 B14R1.5971 Cc1cccc(C)c1CC(Br)C(O)=O Amb23320607 [0,2,0,0,0,0|1,0,1]=4 5618 B14R1.5971 Cc1cccc(C)c1CC(O)C(O)=O Amb24731706 [0,2,0,0,0,0|0,0,2]=4 5619 B14R1.5971 Cc1cccc(C)c1C[C@@H](N)C(O)=O Amb22747546 [0,2,0,0,0,0|1,0,1]=4 5620 B14R1.5971 Cc1cccc(C)c1C[C@H](N)C(O)=O Amb24062379 [0,2,0,0,0,0|1,0,1]=4 5621 B14R1.5971 Cc1cccc(C)c1NC(=N)C(O)=O Amb18651187 [0,2,0,0,0,0|2,0,0]=4 5622 B14R1.5971 Cc1cccc(C)c1\C=C(\F)/C(O)=O Amb24576058 [0,2,0,0,0,0|1,0,1]=4 5623 B14R1.5971 Cc1cccc(F)c1CC(C)C(O)=O Amb25228030 [0,2,0,0,0,0|1,0,1]=4 5624 B14R1.5971 Cc1cccc(F)c1CC(N)C(O)=O Amb24426809 [0,2,0,0,0,0|1,0,1]=4 5625 B14R1.5971 Cc1cccc(O)c1C[C@@H](N)C(O)=O Amb25278345 [0,2,0,0,0,0|1,0,1]=4 5626 B14R1.5971 Cc1cccc(O)c1C[C@H](N)C(O)=O Amb24551602 [0,2,0,0,0,0|1,0,1]=4 5627 B14R1.5971 NC(Cc1c(Br)cccc1Br)C(O)=O Amb25124682 [0,2,0,0,0,0|1,0,1]=4 5628 B14R1.5971 NC(Cc1c(Br)cccc1O)C(O)=O Amb18668186 [0,2,0,0,0,0|1,0,1]=4 5629 B14R1.5971 NC(Cc1c(O)cccc1O)C(O)=O Amb22228380 [0,2,0,0,0,0|1,0,1]=4 5630 B14R1.5971 N[C@@H](Cc1c(Cl)cccc1Br)C(O)=O Amb24392808 [0,2,0,0,0,0|1,0,1]=4 5631 B14R1.5971 N[C@@H](Cc1c(Cl)cccc1Cl)C(O)=O Amb22228372 [0,2,0,0,0,0|1,0,1]=4 5632 B14R1.5971 N[C@@H](Cc1c(Cl)cccc1I)C(O)=O Amb24608649 [0,2,0,0,0,0|1,0,1]=4 5633 B14R1.5971 N[C@@H](Cc1c(F)cccc1Br)C(O)=O Amb25076170 [0,2,0,0,0,0|1,0,1]=4 5634 B14R1.5971 N[C@@H](Cc1c(F)cccc1Cl)C(O)=O Amb24521960 [0,2,0,0,0,0|1,0,1]=4 5635 B14R1.5971 N[C@@H](Cc1c(F)cccc1F)C(O)=O Amb19889726 [0,2,0,0,0,0|1,0,1]=4 5636 B14R1.5971 N[C@@H](Cc1c(O)cccc1O)C(O)=O Amb22228382 [0,2,0,0,0,0|1,0,1]=4 5637 B14R1.5971 N[C@H](Cc1c(Br)cccc1O)C(O)=O Amb24686797 [0,2,0,0,0,0|1,0,1]=4 5638 B14R1.5971 N[C@H](Cc1c(Cl)cccc1Br)C(O)=O Amb25817718 [0,2,0,0,0,0|1,0,1]=4 5639 B14R1.5971 N[C@H](Cc1c(Cl)cccc1Cl)C(O)=O Amb22228371 [0,2,0,0,0,0|1,0,1]=4 5640 B14R1.5971 N[C@H](Cc1c(Cl)cccc1I)C(O)=O Amb24424890 [0,2,0,0,0,0|1,0,1]=4 5641 B14R1.5971 N[C@H](Cc1c(F)cccc1Br)C(O)=O Amb24511236 [0,2,0,0,0,0|1,0,1]=4 5642 B14R1.5971 N[C@H](Cc1c(F)cccc1F)C(O)=O Amb19887663 [0,2,0,0,0,0|1,0,1]=4 5643 B14R1.5971 N[C@H](Cc1c(F)cccc1I)C(O)=O Amb25305766 [0,2,0,0,0,0|1,0,1]=4 5644 B14R1.5971 N[C@H](Cc1c(O)cccc1O)C(O)=O Amb22228381 [0,2,0,0,0,0|1,0,1]=4 5645 B14R1.5971 N\C(=C\c1c(F)cccc1F)\C(O)=O Amb25035967 [0,2,0,0,0,0|1,0,1]=4 5646 B14R1.5971 Nc1cccc(Br)c1C[C@@H](N)C(O)=O Amb25711352 [0,2,0,0,0,0|1,0,1]=4 5647 B14R1.5971 Nc1cccc(Br)c1C[C@H](N)C(O)=O Amb24530375 [0,2,0,0,0,0|1,0,1]=4 5648 B14R1.5971 Nc1cccc(Cl)c1CC(N)C(O)=O Amb18657751 [0,2,0,0,0,0|1,0,1]=4 5649 B14R1.5971 Nc1cccc(F)c1C[C@H](N)C(O)=O Amb24428730 [0,2,0,0,0,0|1,0,1]=4 5650 B14R1.5971 O=C(C(=O)C)Nc1c(C)cccc1C Amb17401505 [0,2,0,0,0,0|2,0,0]=4 5651 B14R1.5971 O=C(C(=O)O)Cc1c(Cl)cccc1Cl Amb17477772 [0,2,0,0,0,0|0,0,0]=2 5652 B14R1.5971 O=C(C(=O)O)Cc1c(F)cccc1Cl Amb1134065 [0,2,0,0,0,0|0,0,0]=2 5653 B14R1.5971 O=C(C(=O)O)Cc1c(F)cccc1F Amb1128545 [0,2,0,0,0,0|0,0,0]=2 5654 B14R1.5971 O=C(C(=O)O)Nc1c(Cl)cccc1Cl Amb17048378 [0,2,0,0,0,0|1,0,0]=3 5655 B14R1.5971 OC(=O)C(=O)Cc1c(Br)c[n]cc1Br Amb24532318 [0,2,0,0,0,0|1,0,0]=3 5656 B14R1.5971 OC(=O)C(=O)Cc1c(F)cccc1Br Amb24565546 [0,2,0,0,0,0|0,0,0]=2 5657 B14R1.5971 OC(=O)C(=O)Nc1c(F)cccc1Cl Amb25789855 [0,2,0,0,0,0|1,0,0]=3 5658 B14R1.5971 OC(=O)C(=S)Cc1c(Cl)cccc1Cl Amb22466834 [0,2,0,0,0,0|0,1,0]=3 5659 B14R1.5971 OC(=O)C(F)Cc1c(Cl)cccc1F Amb24563194 [0,2,0,0,0,0|1,0,1]=4 5660 B14R1.5971 OC(=O)C(O)Cc1c(F)cccc1F Amb24459613 [0,2,0,0,0,0|0,0,2]=4 5661 B14R1.5971 OC(C(=O)O)Cc1c(F)cccc1Cl Amb17141137 [0,2,0,0,0,0|0,0,2]=4 5662 B14R1.548 OS(=O)(=O)\C(\Cc1ccccc1)=C/Cl Amb22364613 [0,2,0,0,0,0|2,0,0]=4 5663 B14R1.980 CCOC(Cc1ccccc1)C(O)=O Amb23320687 [0,2,0,0,0,0|0,0,2]=4 5664 B14R1.980 N#CC\C(=C/c1ccccc1)\C(O)=O Amb25106907 [0,2,0,0,0,0|1,0,1]=4 5665 B14R1.980 NCCC(Cc1ccccc1)C(O)=O Amb22371119 [0,2,0,0,0,0|1,0,1]=4 5666 B14R1.980 O=CN[C@H](C(=O)O)Cc1ccccc1 Amb16231666 [0,2,0,0,0,0|0,0,1]=3 5667 B14R1.980 OC(=O)C(Cc1ccccc1)CC=O Amb18817543 [0,2,0,0,0,0|0,0,1]=3 5668 B14R1.980 OC(=O)[C@@H](Cc1ccccc1)NC=O Amb19050931 [0,2,0,0,0,0|0,0,1]=3 5669 B14R1.980 OC(=O)\C(=C\c1ccccc1)\NC=O Amb25065270 [0,2,0,0,0,0|0,0,1]=3 5670 B14R1.980 [N-]=[N+]=N\C(=C/c1ccccc1)\C(O)=O Amb25277806 [0,2,0,0,0,0|1,0,1]=4 5671 B14R1.980 [N-]=[N+]=N\C(=C\c1ccccc1)\C(O)=O Amb25789986 [0,2,0,0,0,0|1,0,1]=4 5672 B14R1.4513 CC(=N)\C(=C\c1ccccc1)\C(O)=O Amb24512212 [0,2,0,0,0,0|1,0,1]=4 5673 B14R1.4513 CC(=O)C(=Nc1ccccc1)C(C)=O Amb22232232 [0,2,0,0,0,0|2,0,0]=4 5674 B14R1.4513 CC(=O)C(Cc1ccccc1)C(C)=O Amb17778962 [0,2,0,0,0,0|1,0,1]=4 5675 B14R1.4513 CC(=O)N(Cc1ccccc1)C(N)=O Amb24469539 [0,2,0,0,0,0|2,0,0]=4 5676 B14R1.4513 CC(=O)[C-](Cc1ccccc1)C(N)=O Amb22464989 [0,2,0,0,0,0|1,0,1]=4 5677 B14R1.4513 CC(=O)\C(\Cc1ccccc1)=C(/C)\N Amb24571680 [0,2,0,0,0,0|2,0,0]=4 5678 B14R1.4513 CC(=O)\C(\Cc1ccccc1)=C(/C)\O Amb25236905 [0,2,0,0,0,0|1,0,0]=3 5679 B14R1.4513 CC(C(C(=O)O)Cc1ccccc1)C Amb17235377 [0,2,0,0,0,0|1,0,1]=4 5680 B14R1.4513 CC(C)=C(Oc1ccccc1)C(O)=O Amb18651146 [0,2,0,0,0,0|2,0,0]=4 5681 B14R1.4513 CC(C)=C(Sc1ccccc1)C(O)=O Amb18656292 [0,2,0,0,0,0|2,0,0]=4 5682 B14R1.4513 CC(\C(=C/c1ccccc1)\C(=O)O)C Amb17234888 [0,2,0,0,0,0|1,0,1]=4 5683 B14R1.4513 CS(=O)\C(=C\c1ccccc1)\C(O)=O Amb24513090 [0,2,0,0,0,0|0,0,1]=3 5684 B14R1.4513 C[C@@H](O)[C@@H](Cc1ccccc1)C(O)=O Amb19883969 [0,2,0,0,0,0|0,0,2]=4 5685 B14R1.4513 OC(=O)C(=Cc1c[n]ccc1)C(O)=O Amb25809321 [0,2,0,0,0,0|1,0,1]=4 5686 B14R1.4513 OC(=O)C(=Cc1cc[n]cc1)C(O)=O Amb24498152 [0,2,0,0,0,0|1,0,1]=4 5687 B14R1.4513 OC(=O)C(=Cc1ccccc1)C(=O)O Amb17595021 [0,2,0,0,0,0|0,0,1]=3 5688 B14R1.4513 OC(=O)C(Cc1ccccc1)=C(F)F Amb24390374 [0,2,0,0,0,0|1,0,0]=3 5689 B14R1.4513 OC(=O)C(Nc1ccccc1)C(O)=O Amb24106401 [0,2,0,0,0,0|1,0,1]=4 5690 B14R1.8844 C#C[C@](N)(Cc1ccccc1)C(O)=O Amb25336547 [0,2,0,0,0,0|1,0,1]=4 5691 B14R1.8844 CC(Cc1ccccc1)(NC)C(O)=O Amb19036440 [0,2,0,0,0,0|1,0,1]=4 5692 B14R1.8844 C[C@@](Cc1ccccc1)(C#N)C(O)=O Amb24347930 [0,2,0,0,0,0|1,0,1]=4 5693 B14R1.8844 NNC(C(=O)O)(Cc1ccccc1)C Amb17401882 [0,2,0,0,0,0|1,0,1]=4 5694 B14R1.8844 N[C@@](Cc1ccccc1)(CO)C(O)=O Amb22233141 [0,2,0,0,0,0|0,0,2]=4 5695 B12R1.264 OC(=O)C(=O)CCc1cccs1 Amb16754796 [0,0,1,1,0,0|1,0,1]=4 5696 B12R1.264 OC(=O)C(=O)\C=C\c1c[nH]cc1 Amb24461838 [0,0,1,1,0,0|1,0,1]=4 5697 B12R1.264 OC(=O)C(=O)\C=C\c1c[s]cc1 Amb24457188 [0,0,1,1,0,0|1,0,1]=4 5698 B12R1.264 OC(=O)C(=O)\C=C\c1ccco1 Amb17470462 [0,0,1,1,0,0|1,0,1]=4 5699 B12R1.2197 NC(C1C=CC=CC=C1)C(O)=O Amb25751352 [0,0,1,1,0,0|1,0,1]=4 5700 B12R2.18 C=C1C(=O)Nc2ccccc12 Amb17779246 [1,0,0,1,0,0|2,0,0]=4 5701 B12R2.18 C=C1Cc2ccccc2C1=O Amb18062660 [1,0,0,1,0,0|1,0,0]=3 5702 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [1,0,0,1,0,0|1,0,1]=4 5703 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [1,0,0,1,0,0|1,0,1]=4 5704 B12R2.18 CC=1C(=O)CN2C=CC=CC21 Amb25151212 [1,0,0,1,0,0|2,0,0]=4 5705 B12R2.18 CC=1c2ccccc2CC1C Amb21948330 [1,0,0,1,0,0|2,0,0]=4 5706 B12R2.18 C[C@@H]1Cc2ccccc2C1=O Amb25282759 [1,0,0,1,0,0|1,0,1]=4 5707 B12R2.18 NC1=Nc2ccccc2C1=O Amb24078927 [1,0,0,1,0,0|2,0,0]=4 5708 B12R2.18 NC1Cc2ccccc2C1=O Amb19958907 [1,0,0,1,0,0|1,0,1]=4 5709 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb22747360 [1,0,0,1,0,0|1,0,1]=4 5710 B12R2.18 N[C@@H]1Cc2ccccc2C1=O Amb24390795 [1,0,0,1,0,0|1,0,1]=4 5711 B12R2.18 O=C1C(=Nc2c1cccc2)Cl Amb17594117 [1,0,0,1,0,0|2,0,0]=4 5712 B12R2.18 O=C1C(=O)N=C2C=CC=CN12 Amb18528339 [1,0,0,1,0,0|2,0,0]=4 5713 B12R2.18 O=C1C(=S)Nc2c1cccc2 Amb17594053 [1,0,0,1,0,0|1,1,0]=4 5714 B12R2.18 O=C1C(Cl)=Cc2ccccc21 Amb24736271 [1,0,0,1,0,0|1,0,1]=4 5715 B12R2.18 O=C1C(F)Cc2c1cccc2 Amb17593723 [1,0,0,1,0,0|1,0,1]=4 5716 B12R2.18 O=C1C(I)Cc2c1cccc2 Amb16232280 [1,0,0,1,0,0|1,0,1]=4 5717 B12R2.18 O=C1C(N)Cc2c1cccc2 Amb17470380 [1,0,0,1,0,0|1,0,1]=4 5718 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [1,0,0,1,0,0|2,0,0]=4 5719 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [1,0,0,1,0,0|2,0,0]=4 5720 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [1,0,0,1,0,0|1,0,1]=4 5721 B12R2.18 O=C1Cc2ccccc2C1F Amb25142685 [1,0,0,1,0,0|1,0,1]=4 5722 B12R2.18 O=C1Cc2ccccc2C1[Na] Amb24605330 [1,0,0,1,0,0|1,0,1]=4 5723 B12R2.18 O=C1Nc2c(C1=O)cccn2 Amb10976067 [1,0,0,1,0,0|2,0,0]=4 5724 B12R2.18 O=C1Nc2c(C1=O)cncc2 Amb16191932 [1,0,0,1,0,0|2,0,0]=4 5725 B12R2.18 O=C1[C@@H](Br)Cc2ccccc21 Amb24669064 [1,0,0,1,0,0|1,0,1]=4 5726 B12R2.18 O=C1[C@H](Br)Cc2ccccc21 Amb25827588 [1,0,0,1,0,0|1,0,1]=4 5727 B12R2.18 O=C1c2[n]cccc2NC1=O Amb22753936 [1,0,0,1,0,0|2,0,0]=4 5728 B12R2.18 O=C1c2cc[n]cc2NC1=O Amb22754397 [1,0,0,1,0,0|2,0,0]=4 5729 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [1,0,0,1,0,0|1,0,1]=4 5730 B12R2.18 OC1Cc2ccccc2C1=O Amb25342077 [1,0,0,1,0,0|0,0,2]=4 5731 B12R2.18 ON1C(=O)Cc2ccc[n]c12 Amb24082462 [1,0,0,1,0,0|2,0,0]=4 5732 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [1,0,0,1,0,0|1,0,0]=3 5733 B12R2.18 O[C@@H]1Cc2ccccc2C1=O Amb24725355 [1,0,0,1,0,0|0,0,2]=4 5734 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [1,0,0,1,0,0|1,0,1]=4 5735 B12R2.18 Oc1c(Br)[s]c2ccccc21 Amb25309520 [1,0,0,1,0,0|2,0,0]=4 5736 B12R2.18 Oc1c(S)[nH]c2ccccc21 Amb24085063 [1,0,0,1,0,0|1,1,0]=4 5737 B12R2.18 Oc1c(S)[s]c2ccccc21 Amb24518700 [1,0,0,1,0,0|1,1,0]=4 5738 B12R2.18 Oc1c2ccccc2oc1O Amb24060920 [1,0,0,1,0,0|1,0,1]=4 5739 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [1,0,0,1,0,0|1,0,1]=4 5740 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [1,0,0,1,0,0|1,0,1]=4 5741 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [1,0,0,1,0,0|0,0,1]=3 5742 B12R2.24 C=C1Cc2ccccc2OC1 Amb25087646 [1,0,0,1,0,0|1,0,1]=4 5743 B12R2.24 CC=1Cc2ccccc2ON1 Amb25077210 [1,0,0,1,0,0|2,0,0]=4 5744 B12R2.24 O=C1C=Cc2ccccc2N1 Amb18546039 [1,0,0,1,0,0|2,0,0]=4 5745 B12R2.24 O=C1C=Cc2ccccc2O1 Amb18511466 [1,0,0,1,0,0|2,0,0]=4 5746 B12R2.24 O=C1C=Cc2ccccc2S1 Amb20663396 [1,0,0,1,0,0|2,0,0]=4 5747 B12R2.24 O=C1C=Cc2ccccc2[N-]1 Amb21940629 [1,0,0,1,0,0|2,0,0]=4 5748 B12R2.24 O=C1C=Nc2ccccc2N1 Amb18372452 [1,0,0,1,0,0|2,0,0]=4 5749 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [1,0,0,1,0,0|1,0,1]=4 5750 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [1,0,0,1,0,0|0,0,1]=3 5751 B12R2.24 O=C1COc2c(N1)cccc2 Amb1011836 [1,0,0,1,0,0|1,0,1]=4 5752 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [1,0,0,1,0,0|2,0,0]=4 5753 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [1,0,0,1,0,0|1,0,0]=3 5754 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [1,0,0,1,0,0|1,0,1]=4 5755 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [1,0,0,1,0,0|2,0,0]=4 5756 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [1,0,0,1,0,0|0,1,1]=4 5757 B12R2.24 O=c1ccc2c(o1)cccc2 Amb1802468 [1,0,0,1,0,0|2,0,0]=4 5758 B12R2.24 O=c1cnc2c([nH]1)cccc2 Amb1352017 [1,0,0,1,0,0|2,0,0]=4 5759 B12R2.24 OC1=COc2ccccc2O1 Amb24060689 [1,0,0,1,0,0|1,0,1]=4 5760 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [1,0,0,1,0,0|1,0,1]=4 5761 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [1,0,0,1,0,0|1,0,1]=4 5762 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [1,0,0,1,0,0|0,0,2]=4 5763 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [1,0,0,1,0,0|1,0,1]=4 5764 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [1,0,0,1,0,0|1,0,1]=4 5765 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [1,0,0,1,0,0|1,0,1]=4 5766 B12R2.32 O=CC1Cc2ccccc2C1 Amb18124789 [1,0,0,1,0,0|1,0,1]=4 5767 B12R2.32 O=CC=1Cc2ccccc2C1 Amb18644150 [1,0,0,1,0,0|1,0,0]=3 5768 B12R2.32 O=CC=1Cc2ccccc2N1 Amb24078943 [1,0,0,1,0,0|1,0,0]=3 5769 B12R2.32 O=Cc1cc2c(o1)cccc2 Amb1156936 [1,0,0,1,0,0|0,0,2]=4 5770 B12R2.32 O=Cc1cc2c(s1)cccc2 Amb2447439 [1,0,0,1,0,0|0,1,1]=4 5771 B12R2.32 OCC=1Cc2ccccc2C1 Amb22494117 [1,0,0,1,0,0|1,0,1]=4 5772 B12R2.32 O\N=C/1\Cc2ccccc2O1 Amb24727728 [1,0,0,1,0,0|1,0,1]=4 5773 B12R2.37 CC1=C(C1=O)c2ccccc2 Amb1914070 [1,0,0,1,0,0|1,0,1]=4 5774 B12R2.37 Cc1c(-c2ccccc2)c1=O Amb17917365 [1,0,0,1,0,0|1,0,1]=4 5775 B12R2.37 NC=1C(=O)C1c2ccccc2 Amb24509252 [1,0,0,1,0,0|1,0,1]=4 5776 B12R2.37 O=C1C(Cl)=C1c2ccccc2 Amb25759566 [1,0,0,1,0,0|1,0,1]=4 5777 B12R2.37 OC=1C(=O)C1c2ccccc2 Amb24631580 [1,0,0,1,0,0|0,0,1]=3 5778 B12R2.3511 COC(=O)C1c2ccccc21 Amb25270277 [1,0,0,1,0,0|2,0,0]=4 5779 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [1,0,0,1,0,0|1,0,1]=4 5780 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [1,0,0,1,0,0|1,0,1]=4 5781 B12R2.2403 OP1(=O)OCc2ccccc12 Amb25149207 [1,0,0,1,0,0|2,0,0]=4 5782 B12R2.3190 CC(=O)N1Cc2ccccc12 Amb25148191 [1,0,0,1,0,0|2,0,0]=4 5783 B12R2.3190 NC(=O)C1=Cc2ccccc21 Amb25169267 [1,0,0,1,0,0|1,0,1]=4 5784 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [1,0,0,1,0,0|1,0,1]=4 5785 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [1,0,0,1,0,0|1,0,1]=4 5786 B12R2.3190 O=C(Cl)C=1C=C2C=CC=CC21 Amb25779648 [1,0,0,1,0,0|1,0,1]=4 5787 B12R2.3190 OC(=O)C1=Cc2c1cccc2 Amb17593654 [1,0,0,1,0,0|0,0,1]=3 5788 B12R2.2075 O=C(C1CO1)c2ccccc2 Amb24376086 [0,0,0,1,1,0|1,0,1]=4 5789 B12R2.2075 O=C([C@@H]1CO1)c2ccccc2 Amb25735777 [0,0,0,1,1,0|1,0,1]=4 5790 B14R2.19 Brc1[n]c(Cc2ccccc2)[n]o1 Amb24672529 [0,0,0,1,0,1|2,0,0]=4 5791 B14R2.19 Cc1[n]c(Cc2ccccc2)[n]o1 Amb25760165 [0,0,0,1,0,1|2,0,0]=4 5792 B14R2.19 Clc1[n]c(Cc2ccccc2)[n]o1 Amb18324818 [0,0,0,1,0,1|2,0,0]=4 5793 B14R2.19 Nc1[n]c(Cc2ccccc2)[n]o1 Amb18961686 [0,0,0,1,0,1|2,0,0]=4 5794 B14R2.19 Nc1[n]c(Cc2ccccc2)co1 Amb22499416 [0,0,0,1,0,1|2,0,0]=4 5795 B14R2.19 Nc1onc(c1)Cc2ccccc2 Amb17233004 [0,0,0,1,0,1|2,0,0]=4 5796 B14R2.19 O=C1C=C(CO1)Nc2ccccc2 Amb22481357 [0,0,0,1,0,1|2,0,0]=4 5797 B14R2.19 O=C1C=C(CO1)Sc2ccccc2 Amb21928058 [0,0,0,1,0,1|2,0,0]=4 5798 B14R2.19 O=C1C=C(Cc2ccccc2)NN1 Amb25299854 [0,0,0,1,0,1|2,0,0]=4 5799 B14R2.19 O=C1C=C(Nc2ccccc2)NO1 Amb24741763 [0,0,0,1,0,1|2,0,0]=4 5800 B14R2.19 O=C1CC(Cc2ccccc2)=CC1 Amb24422432 [0,0,0,1,0,1|2,0,0]=4 5801 B14R2.19 O=C1CC(Nc2ccccc2)=NO1 Amb25192239 [0,0,0,1,0,1|2,0,0]=4 5802 B14R2.19 O=C1CN=C(Cc2ccccc2)N1 Amb24534416 [0,0,0,1,0,1|2,0,0]=4 5803 B14R2.19 O=C1C\C(\CO1)=C\c2ccccc2 Amb24712490 [0,0,0,1,0,1|1,0,1]=4 5804 B14R2.19 O=C1NC(Cc2c[n]ccc2)=NO1 Amb18184129 [0,0,0,1,0,1|2,0,0]=4 5805 B14R2.19 O=C1NC(Cc2cc[n]cc2)=NO1 Amb18184131 [0,0,0,1,0,1|2,0,0]=4 5806 B14R2.19 O=C1NC(Cc2cccc[n]2)=NO1 Amb18184130 [0,0,0,1,0,1|2,0,0]=4 5807 B14R2.19 O=C1NC(Cc2ccccc2)=NO1 Amb18184032 [0,0,0,1,0,1|1,0,0]=3 5808 B14R2.19 O=C1NC(Cc2ccccc2)=NS1 Amb25192668 [0,0,0,1,0,1|1,1,0]=4 5809 B14R2.19 O=C1NC(Nc2ccccc2)=NO1 Amb25366198 [0,0,0,1,0,1|2,0,0]=4 5810 B14R2.19 O=C1ON=C(C1)Cc2ccccc2 Amb1099037 [0,0,0,1,0,1|1,0,0]=3 5811 B14R2.19 Oc1[n][n]c(Cc2ccccc2)o1 Amb18065599 [0,0,0,1,0,1|2,0,0]=4 5812 B14R2.19 Oc1c[nH]c(Cc2ccccc2)[n]1 Amb24675070 [0,0,0,1,0,1|2,0,0]=4 5813 B14R2.19 Oc1cc(Cc2ccccc2)[n]o1 Amb20672899 [0,0,0,1,0,1|1,0,1]=4 5814 B14R2.19 Sc1[n]c(Cc2ccccc2)[n]o1 Amb18317690 [0,0,0,1,0,1|1,1,0]=4 5815 B14R2.19 Sc1[n]c(Cc2ccccc2)co1 Amb25205496 [0,0,0,1,0,1|1,1,0]=4 5816 B14R2.598 CC1=CC(=O)CC1c2ccccc2 Amb17594322 [0,0,0,1,0,1|2,0,0]=4 5817 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,0,0,1,0,1|1,0,1]=4 5818 B14R2.598 CC1OC(=O)OC1c2ccccc2 Amb25263220 [0,0,0,1,0,1|1,0,1]=4 5819 B14R2.598 CC=1NC(=O)C(N1)c2ccccc2 Amb25041137 [0,0,0,1,0,1|2,0,0]=4 5820 B14R2.598 C[C@@H]1CC(=O)[C@@H](O1)c2ccccc2 Amb24583525 [0,0,0,1,0,1|1,0,1]=4 5821 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,0,0,1,0,1|1,0,1]=4 5822 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,0,0,1,0,1|1,0,1]=4 5823 B14R2.598 C[C@H]1CC(=O)[C@@H](O1)c2ccccc2 Amb25179569 [0,0,0,1,0,1|1,0,1]=4 5824 B14R2.598 C[C@H]1NC(=O)OC1c2ccccc2 Amb24534608 [0,0,0,1,0,1|1,0,1]=4 5825 B14R2.598 N=C1CC(C(=O)N1)c2ccccc2 Amb25237582 [0,0,0,1,0,1|2,0,0]=4 5826 B14R2.598 NC1=NC(=O)C(S1)c2ccccc2 Amb19866692 [0,0,0,1,0,1|1,1,0]=4 5827 B14R2.598 NC1=NC(=O)[C@H](O1)c2ccccc2 Amb25045609 [0,0,0,1,0,1|1,0,0]=3 5828 B14R2.598 NC1=NC(C(=O)O1)c2ccccc2 Amb24587284 [0,0,0,1,0,1|2,0,0]=4 5829 B14R2.598 NC1=NC(C(=O)S1)c2ccccc2 Amb24635696 [0,0,0,1,0,1|2,0,0]=4 5830 B14R2.598 NC=1NC(C(=O)N1)c2ccccc2 Amb24079423 [0,0,0,1,0,1|2,0,0]=4 5831 B14R2.598 O=C1CC(=O)N(C1)c2ccccc2 Amb20622677 [0,0,0,1,0,1|2,0,0]=4 5832 B14R2.598 O=C1CC(=O)NC1c2ccccc2 Amb18197455 [0,0,0,1,0,1|1,0,0]=3 5833 B14R2.598 O=C1CC(=O)NN1c2ccccc2 Amb2388599 [0,0,0,1,0,1|2,0,0]=4 5834 B14R2.598 O=C1C[C@@H](Cl)[C@@H](O1)c2ccccc2 Amb25210899 [0,0,0,1,0,1|1,0,1]=4 5835 B14R2.598 O=C1NC(=O)C(C1)c2cccnc2 Amb17233167 [0,0,0,1,0,1|2,0,0]=4 5836 B14R2.598 O=C1NC(=O)C(N1)c2ccccn2 Amb17335157 [0,0,0,1,0,1|2,0,0]=4 5837 B14R2.598 O=C1NC(=O)C(N1)c2cccnc2 Amb1139940 [0,0,0,1,0,1|2,0,0]=4 5838 B14R2.598 O=C1NC(=O)C=C1c2ccccc2 Amb17334915 [0,0,0,1,0,1|1,0,1]=4 5839 B14R2.598 O=C1NC(=O)N(N1)c2ccccc2 Amb18186049 [0,0,0,1,0,1|2,0,0]=4 5840 B14R2.598 O=C1NC(=O)NC1c2ccncc2 Amb1131144 [0,0,0,1,0,1|2,0,0]=4 5841 B14R2.598 O=C1NC(=O)SC1c2ccccc2 Amb23558941 [0,0,0,1,0,1|0,1,0]=3 5842 B14R2.598 O=C1NC(=S)NC1c2ccccc2 Amb16767171 [0,0,0,1,0,1|1,1,0]=4 5843 B14R2.598 O=C1NC(=S)OC1c2cccc[n]2 Amb25102599 [0,0,0,1,0,1|1,1,0]=4 5844 B14R2.598 O=C1NC(=S)SC1c2ccccc2 Amb22486838 [0,0,0,1,0,1|0,2,0]=4 5845 B14R2.598 O=C1N[C@@H](c2ccccc2)C(=O)N1 Amb24451070 [0,0,0,1,0,1|1,0,0]=3 5846 B14R2.598 O=C1OC(=O)C(C1)c2ccccn2 Amb17400588 [0,0,0,1,0,1|2,0,0]=4 5847 B14R2.598 O=C1OC(=O)C(C1)c2cccnc2 Amb17233240 [0,0,0,1,0,1|2,0,0]=4 5848 B14R2.598 O=C1OC(=O)C=C1c2ccccc2 Amb2431774 [0,0,0,1,0,1|1,0,1]=4 5849 B14R2.598 O=C1OC(=O)CC1c2ccncc2 Amb17400589 [0,0,0,1,0,1|2,0,0]=4 5850 B14R2.598 O=C1OC(=O)CN1c2ccccc2 Amb25084575 [0,0,0,1,0,1|2,0,0]=4 5851 B14R2.598 O=C1OC(=O)C[C@@H]1c2ccccc2 Amb23401547 [0,0,0,1,0,1|1,0,0]=3 5852 B14R2.598 O=C1OC(=O)NC1c2ccccc2 Amb25772896 [0,0,0,1,0,1|1,0,0]=3 5853 B14R2.598 O=C1OC(=O)N[C@H]1c2ccccc2 Amb25039558 [0,0,0,1,0,1|1,0,0]=3 5854 B14R2.598 O=C1OC(=S)N[C@@H]1c2ccccc2 Amb25809486 [0,0,0,1,0,1|1,1,0]=4 5855 B14R2.598 O=C1OC(=S)N[C@H]1c2ccccc2 Amb25111619 [0,0,0,1,0,1|1,1,0]=4 5856 B14R2.598 O=C1O[C@H](c2ccccc2)C(=O)O1 Amb25073739 [0,0,0,1,0,1|0,0,0]=2 5857 B14R2.598 O=C1SC(=O)NC1c2ccccc2 Amb25759072 [0,0,0,1,0,1|1,0,0]=3 5858 B14R2.598 OC1=CC(=O)N(N1)c2ccccc2 Amb22171490 [0,0,0,1,0,1|2,0,0]=4 5859 B14R2.598 OC1CC(=O)OC1c2ccccc2 Amb25831819 [0,0,0,1,0,1|0,0,2]=4 5860 B14R2.598 OC1OC(=O)OC1c2ccccc2 Amb25788943 [0,0,0,1,0,1|0,0,2]=4 5861 B14R2.598 O[C@@H]1CC(=O)O[C@@H]1c2ccccc2 Amb24671435 [0,0,0,1,0,1|0,0,2]=4 5862 B14R2.642 CC(=O)C1c2ccccc2OC1=O Amb24086439 [0,0,0,1,0,1|2,0,0]=4 5863 B14R2.642 CC(=O)N1c2ccccc2OC1=O Amb19805965 [0,0,0,1,0,1|2,0,0]=4 5864 B14R2.642 CC(=O)N1c2ccccc2SC1=O Amb20665367 [0,0,0,1,0,1|2,0,0]=4 5865 B14R2.642 CC(=O)n1c(=O)sc2c1cccc2 Amb16205819 [0,0,0,1,0,1|2,0,0]=4 5866 B14R2.642 CC1Cc2ccccc2C1C(O)=O Amb18127734 [0,0,0,1,0,1|1,0,1]=4 5867 B14R2.642 CC=1Cc2ccccc2C1C(C)=O Amb24492413 [0,0,0,1,0,1|2,0,0]=4 5868 B14R2.642 CC=1Cc2ccccc2C1C(O)=O Amb18127221 [0,0,0,1,0,1|1,0,0]=3 5869 B14R2.642 C[C@H]1Cc2ccccc2[C@H]1C(O)=O Amb24558175 [0,0,0,1,0,1|1,0,1]=4 5870 B14R2.642 C\C(\O)=C/1\C(=O)Cc2ccccc12 Amb24614826 [0,0,0,1,0,1|1,0,0]=3 5871 B14R2.642 C\C(\O)=C/1\C(=O)Nc2ccccc21 Amb25200001 [0,0,0,1,0,1|2,0,0]=4 5872 B14R2.642 N=C1Nc2ccccc2C1C(O)=O Amb25696676 [0,0,0,1,0,1|2,0,0]=4 5873 B14R2.642 N=C1Sc2ccccc2C1C(O)=O Amb24398611 [0,0,0,1,0,1|2,0,0]=4 5874 B14R2.642 NC(=O)N1c2ccccc2CC1=O Amb24069364 [0,0,0,1,0,1|1,0,0]=3 5875 B14R2.642 N\C(\O)=C/1\C(=O)Sc2ccccc21 Amb25038920 [0,0,0,1,0,1|2,0,0]=4 5876 B14R2.642 Nc1[n]c2ccccc2[n]1C(O)=O Amb24078483 [0,0,0,1,0,1|2,0,0]=4 5877 B14R2.642 Nc1[s]c2ccccc2c1C(O)=O Amb24710310 [0,0,0,1,0,1|2,0,0]=4 5878 B14R2.642 Nc1oc2ccccc2c1C(O)=O Amb25381130 [0,0,0,1,0,1|2,0,0]=4 5879 B14R2.642 O=C1Nc2ccccc2N1C(=O)Cl Amb25785585 [0,0,0,1,0,1|2,0,0]=4 5880 B14R2.642 OC(=O)C1=C(Cl)Cc2ccccc12 Amb25772788 [0,0,0,1,0,1|1,0,0]=3 5881 B14R2.642 OC(=O)C1=C2C=CC=CN2OC1=O Amb25708508 [0,0,0,1,0,1|2,0,0]=4 5882 B14R2.642 OC(=O)C1C(O)Cc2ccccc21 Amb24366682 [0,0,0,1,0,1|0,0,2]=4 5883 B14R2.642 OC(=O)C1c2[n]cccc2NC1=O Amb24330674 [0,0,0,1,0,1|2,0,0]=4 5884 B14R2.642 OC(=O)[C@@H]1[C@@H](O)Cc2ccccc21 Amb25321980 [0,0,0,1,0,1|0,0,2]=4 5885 B14R2.642 OC(=O)[n]1c(I)cc2ccccc12 Amb24067772 [0,0,0,1,0,1|1,0,1]=4 5886 B14R2.642 OC(=O)c1c(Cl)[s]c2ccccc21 Amb24490222 [0,0,0,1,0,1|2,0,0]=4 5887 B14R2.642 OC(=O)c1c(F)[s]c2ccccc21 Amb25783998 [0,0,0,1,0,1|2,0,0]=4 5888 B14R2.642 Oc1[s]c2ccccc2c1C(O)=O Amb25240870 [0,0,0,1,0,1|1,0,1]=4 5889 B14R2.738 CC1=CC(=O)Cc2ccccc2O1 Amb24646596 [0,0,0,1,0,1|1,0,0]=3 5890 B14R2.738 O=C1CC(=O)Nc2c(N1)cccc2 Amb1678046 [0,0,0,1,0,1|2,0,0]=4 5891 B14R2.738 O=C1CS(=O)Cc2ccccc2N1 Amb24598242 [0,0,0,1,0,1|2,0,0]=4 5892 B14R2.738 O=C1CS(=O)Oc2ccccc2N1 Amb25689516 [0,0,0,1,0,1|2,0,0]=4 5893 B14R2.738 OC1=CC(=O)Nc2ccccc2O1 Amb25685946 [0,0,0,1,0,1|1,0,1]=4 5894 B14R2.764 OC(=O)C/1C\C1=C/c2ccccc2 Amb24654997 [0,0,0,1,0,1|1,0,1]=4 5895 B14R2.764 OC(=O)C1CC1Cc2ccccc2 Amb18990227 [0,0,0,1,0,1|1,0,1]=4 5896 B14R2.764 OC(=O)[C@@H]1C[C@H]1Cc2ccccc2 Amb25179092 [0,0,0,1,0,1|1,0,1]=4 5897 B14R2.768 CC(=O)C=C1Cc2ccccc2C1 Amb24490905 [0,0,0,1,0,1|2,0,0]=4 5898 B14R2.768 OC(=O)CC1Cc2c(O1)cccc2 Amb17606149 [0,0,0,1,0,1|0,0,2]=4 5899 B14R2.768 OC(=O)CC1Cc2ccccc2S1 Amb18189899 [0,0,0,1,0,1|0,1,1]=4 5900 B14R2.768 OC(=O)CC=1Cc2ccccc2C1 Amb18127210 [0,0,0,1,0,1|1,0,0]=3 5901 B14R2.768 OC(=O)CN1Cc2c(C1)cccc2 Amb13948972 [0,0,0,1,0,1|2,0,0]=4 5902 B14R2.768 OC(=O)Cc1[nH]c2ccccc2[n]1 Amb22495289 [0,0,0,1,0,1|2,0,0]=4 5903 B14R2.768 OC(=O)Cc1cc2c([nH]1)cccc2 Amb10071586 [0,0,0,1,0,1|1,0,1]=4 5904 B14R2.768 OC(=O)Cc1cc2c(o1)cccc2 Amb2371823 [0,0,0,1,0,1|0,0,2]=4 5905 B14R2.768 OC(=O)Cc1cc2ccccc2[s]1 Amb18651226 [0,0,0,1,0,1|0,1,1]=4 5906 B14R2.768 OC(=O)Sc1[n]c2ccccc2[s]1 Amb25145464 [0,0,0,1,0,1|1,1,0]=4 5907 B14R2.768 OC(=O)\C=C/1\Oc2ccccc2S1 Amb24726302 [0,0,0,1,0,1|1,0,1]=4 5908 B14R2.790 OC(=O)CC1CC1c2ccccc2 Amb17233181 [0,0,0,1,0,1|1,0,1]=4 5909 B14R2.790 OC(=O)CC1OC1c2ccccc2 Amb25794476 [0,0,0,1,0,1|0,0,2]=4 5910 B14R2.790 OC(=O)C[C@@H]1C[C@H]1c2ccccc2 Amb24467878 [0,0,0,1,0,1|1,0,1]=4 5911 B14R2.790 OC(=O)C[C@H]1C[C@@H]1c2ccccc2 Amb25209939 [0,0,0,1,0,1|1,0,1]=4 5912 B14R2.4586 CC1C(C1C(O)=O)c2ccccc2 Amb24440802 [0,0,0,1,0,1|1,0,1]=4 5913 B14R2.4586 C[C@@H]1[C@@H]([C@@H]1C(O)=O)c2ccccc2 Amb25209963 [0,0,0,1,0,1|1,0,1]=4 5914 B14R2.4586 C[C@@H]1[C@H]([C@@H]1C(O)=O)c2ccccc2 Amb25274087 [0,0,0,1,0,1|1,0,1]=4 5915 B14R2.4586 C[C@H]1[C@H]([C@H]1C(O)=O)c2ccccc2 Amb24591205 [0,0,0,1,0,1|1,0,1]=4 5916 B14R2.4586 OC(=O)C1C(C1Br)c2ccccc2 Amb25292716 [0,0,0,1,0,1|1,0,1]=4 5917 B14R2.8189 O=C1Cc2ccccc2S(=O)(=O)N1 Amb25198536 [0,0,0,1,0,1|1,0,1]=4 5918 B14R2.260 C=C1CC(NC1=O)c2ccccc2 Amb24529607 [0,0,0,1,0,1|2,0,0]=4 5919 B14R2.260 C=C1CC(OC1=O)c2ccccc2 Amb24534660 [0,0,0,1,0,1|1,0,0]=3 5920 B14R2.260 C=C1C[C@@H](NC1=O)c2ccccc2 Amb25857087 [0,0,0,1,0,1|2,0,0]=4 5921 B14R2.260 CC1OC(NC1=O)c2ccccc2 Amb10562255 [0,0,0,1,0,1|1,0,1]=4 5922 B14R2.260 C[C@@H]1NC(OC1=O)c2ccccc2 Amb25238712 [0,0,0,1,0,1|1,0,1]=4 5923 B14R2.260 C[C@@H]1O[C@@H](NC1=O)c2ccccc2 Amb24513100 [0,0,0,1,0,1|1,0,1]=4 5924 B14R2.260 NC1=NN(CC1=O)c2ccccc2 Amb22330405 [0,0,0,1,0,1|2,0,0]=4 5925 B14R2.260 NC1CC(OC1=O)c2ccccc2 Amb17470561 [0,0,0,1,0,1|1,0,1]=4 5926 B14R2.260 O=C1C=C(CC1=O)c2ccccc2 Amb24492584 [0,0,0,1,0,1|1,0,0]=3 5927 B14R2.260 O=C1CC(CC1=O)c2ccccc2 Amb24590974 [0,0,0,1,0,1|1,0,0]=3 5928 B14R2.260 O=C1N=C(SC1=O)c2ccccc2 Amb2384441 [0,0,0,1,0,1|0,1,1]=4 5929 B14R2.260 O=C1OC(CC1=O)c2ccccc2 Amb25718939 [0,0,0,1,0,1|0,0,0]=2 5930 B14R2.260 O=C1OC(CC1Cl)c2ccccc2 Amb24710095 [0,0,0,1,0,1|1,0,1]=4 5931 B14R2.260 O=C1O[C@@H](CC1=O)c2ccccc2 Amb25833624 [0,0,0,1,0,1|0,0,0]=2 5932 B14R2.260 OC1=CC(CC1=O)c2ccccc2 Amb24662315 [0,0,0,1,0,1|1,0,0]=3 5933 B14R2.260 OC1=CC(OC1=O)c2ccccc2 Amb23571856 [0,0,0,1,0,1|0,0,1]=3 5934 B14R2.260 OC1CC(NC1=O)c2ccccc2 Amb25325087 [0,0,0,1,0,1|1,0,1]=4 5935 B14R2.260 OC1CC(OC1=O)c2ccccc2 Amb24414844 [0,0,0,1,0,1|0,0,2]=4 5936 B14R2.260 O[C@@H]1CC(OC1=O)c2ccccc2 Amb25846190 [0,0,0,1,0,1|0,0,2]=4 5937 B14R2.260 O[C@@H]1C[C@H](OC1=O)c2ccccc2 Amb25176996 [0,0,0,1,0,1|0,0,2]=4 5938 B14R2.260 O[C@H]1C[C@@H](OC1=O)c2ccccc2 Amb24520002 [0,0,0,1,0,1|0,0,2]=4 5939 B14R2.427 C=C1C(Cc2ccccc2)CC1=O Amb25263562 [0,0,0,1,0,1|2,0,0]=4 5940 B14R2.427 C=C1CN(Cc2ccccc2)C1=O Amb25117844 [0,0,0,1,0,1|2,0,0]=4 5941 B14R2.427 O=C1C=C(Nc2ccccc2)C1=O Amb22171800 [0,0,0,1,0,1|1,0,1]=4 5942 B14R2.427 O=C1C=C(Sc2ccccc2)C1=O Amb25815276 [0,0,0,1,0,1|1,0,1]=4 5943 B14R2.427 O=C1CN(Cc2ccccc2)C1=O Amb25770465 [0,0,0,1,0,1|1,0,0]=3 5944 B14R2.441 CC1(O)C(NC1=O)c2ccccc2 Amb25767695 [0,0,0,1,0,1|1,0,1]=4 5945 B14R2.441 C[C@@]1(O)[C@H](NC1=O)c2ccccc2 Amb25195952 [0,0,0,1,0,1|1,0,1]=4 5946 B14R2.441 C[C@]1(O)[C@@H](NC1=O)c2ccccc2 Amb24581271 [0,0,0,1,0,1|1,0,1]=4 5947 B14R2.741 O=C1C=Cc2ccccc2NC1=O Amb25190176 [0,0,0,1,0,1|1,0,1]=4 5948 B14R2.741 O=C1C=Cc2ccccc2OC1=O Amb24721695 [0,0,0,1,0,1|0,0,1]=3 5949 B14R2.743 CC1(O)C(=O)CCc2ccccc12 Amb24578288 [0,0,0,1,0,1|1,0,1]=4 5950 B14R2.743 C[C@@]1(O)C(=O)CCc2ccccc12 Amb25353382 [0,0,0,1,0,1|1,0,1]=4 5951 B14R2.779 OC(=O)C1CC(C1)c2ccccc2 Amb13951336 [0,0,0,1,0,1|1,0,1]=4 5952 B14R2.779 OC(=O)[C@@H]1C[C@H](C1)c2ccccc2 Amb24607374 [0,0,0,1,0,1|1,0,1]=4 5953 B14R2.781 CC(=O)C=1Cc2ccccc2CC1 Amb25334979 [0,0,0,1,0,1|2,0,0]=4 5954 B14R2.781 OC(=O)C1=COc2ccccc2O1 Amb18128045 [0,0,0,1,0,1|0,0,2]=4 5955 B14R2.781 OC(=O)C1=CSc2ccccc2S1 Amb24682852 [0,0,0,1,0,1|0,1,1]=4 5956 B14R2.781 OC(=O)C1=Cc2c(OC1)cccc2 Amb1215611 [0,0,0,1,0,1|1,0,0]=3 5957 B14R2.781 OC(=O)C1=Cc2ccccc2SN1 Amb22228836 [0,0,0,1,0,1|2,0,0]=4 5958 B14R2.781 OC(=O)C1=NNc2ccccc2S1 Amb18130074 [0,0,0,1,0,1|1,1,0]=4 5959 B14R2.781 OC(=O)C1CCc2c(N1)cccc2 Amb10604189 [0,0,0,1,0,1|1,0,1]=4 5960 B14R2.781 OC(=O)C1CCc2ccccc2N1 Amb18560475 [0,0,0,1,0,1|1,0,1]=4 5961 B14R2.781 OC(=O)C1CNc2ccccc2N1 Amb25074609 [0,0,0,1,0,1|1,0,1]=4 5962 B14R2.781 OC(=O)C1CNc2ccccc2O1 Amb22266726 [0,0,0,1,0,1|0,0,2]=4 5963 B14R2.781 OC(=O)C1COc2c(C1)cccc2 Amb1657619 [0,0,0,1,0,1|1,0,1]=4 5964 B14R2.781 OC(=O)C1COc2c(S1)cccc2 Amb17570762 [0,0,0,1,0,1|0,1,1]=4 5965 B14R2.781 OC(=O)C1COc2ccccc2N1 Amb18061976 [0,0,0,1,0,1|1,0,1]=4 5966 B14R2.781 OC(=O)C1COc2ccccc2O1 Amb24060687 [0,0,0,1,0,1|0,0,2]=4 5967 B14R2.781 OC(=O)C1CSc2c(C1)cccc2 Amb17595111 [0,0,0,1,0,1|1,0,1]=4 5968 B14R2.781 OC(=O)C1CSc2c(O1)cccc2 Amb13951585 [0,0,0,1,0,1|0,0,2]=4 5969 B14R2.781 OC(=O)C1Cc2ccccc2CN1 Amb22494613 [0,0,0,1,0,1|1,0,1]=4 5970 B14R2.781 OC(=O)C1Cc2ccccc2CO1 Amb22642211 [0,0,0,1,0,1|1,0,1]=4 5971 B14R2.781 OC(=O)C1Cc2ccccc2NC1 Amb22436789 [0,0,0,1,0,1|1,0,1]=4 5972 B14R2.781 OC(=O)C1NCc2c(C1)cccc2 Amb1058838 [0,0,0,1,0,1|1,0,1]=4 5973 B14R2.781 OC(=O)C1OCc2ccccc2O1 Amb24693894 [0,0,0,1,0,1|0,0,2]=4 5974 B14R2.781 OC(=O)C=1CCc2c[n]ccc2C1 Amb25815294 [0,0,0,1,0,1|2,0,0]=4 5975 B14R2.781 OC(=O)C=1CCc2ccccc2C1 Amb18127224 [0,0,0,1,0,1|1,0,0]=3 5976 B14R2.781 OC(=O)C=1CNc2ccccc2C1 Amb24513665 [0,0,0,1,0,1|1,0,0]=3 5977 B14R2.781 OC(=O)C=1COc2[n]cccc2C1 Amb25078088 [0,0,0,1,0,1|2,0,0]=4 5978 B14R2.781 OC(=O)C=1CSc2ccccc2C1 Amb25060752 [0,0,0,1,0,1|1,0,0]=3 5979 B14R2.781 OC(=O)C=1CSc2ccccc2N1 Amb24727714 [0,0,0,1,0,1|1,0,0]=3 5980 B14R2.781 OC(=O)C=1Cc2cccc[n+]2CC1 Amb25835658 [0,0,0,1,0,1|2,0,0]=4 5981 B14R2.781 OC(=O)C=1Cc2ccccc2CC1 Amb18127205 [0,0,0,1,0,1|1,0,0]=3 5982 B14R2.781 OC(=O)[C@@H]1CCc2ccccc2N1 Amb19887699 [0,0,0,1,0,1|1,0,1]=4 5983 B14R2.781 OC(=O)[C@@H]1CCc2ccccc2N1 Amb22754395 [0,0,0,1,0,1|1,0,1]=4 5984 B14R2.781 OC(=O)[C@@H]1Cc2ccccc2CO1 Amb24365966 [0,0,0,1,0,1|1,0,1]=4 5985 B14R2.781 OC(=O)[C@@H]1Cc2ccccc2OC1 Amb25074534 [0,0,0,1,0,1|1,0,1]=4 5986 B14R2.781 OC(=O)[C@H]1CCc2ccccc2N1 Amb19888454 [0,0,0,1,0,1|1,0,1]=4 5987 B14R2.781 OC(=O)[C@H]1CCc2ccccc2O1 Amb25807936 [0,0,0,1,0,1|0,0,2]=4 5988 B14R2.781 OC(=O)[C@H]1CNc2ccccc2N1 Amb25043219 [0,0,0,1,0,1|1,0,1]=4 5989 B14R2.781 OC(=O)[C@H]1COc2ccccc2O1 Amb19889734 [0,0,0,1,0,1|0,0,2]=4 5990 B14R2.781 OC(=O)[C@H]1Cc2ccccc2OC1 Amb24376637 [0,0,0,1,0,1|1,0,1]=4 5991 B14R2.781 OC(=O)c1[n]c2ccccc2[n][n]1 Amb18647881 [0,0,0,1,0,1|2,0,0]=4 5992 B14R2.781 OC(=O)c1cc[13c]2[13cH][13cH][13cH][13cH][13c]2c1 Amb22055899 [0,0,0,1,0,1|1,0,1]=4 5993 B14R2.781 OC(=O)c1ccc2c(n1)cccc2 Amb1233401 [0,0,0,1,0,1|1,0,1]=4 5994 B14R2.781 OC(=O)c1ccc2ccccc2[n]1 Amb21858747 [0,0,0,1,0,1|1,0,1]=4 5995 B14R2.781 OC(=O)c1ccc2ccccc2c1 Amb17678851 [0,0,0,1,0,1|1,0,1]=4 5996 B14R2.781 OC(=O)c1cnc2c(c1)cccc2 Amb1995107 [0,0,0,1,0,1|1,0,1]=4 5997 B14R2.781 OC(=O)c1ncc2c(n1)cccc2 Amb10241300 [0,0,0,1,0,1|1,0,1]=4 5998 B14R2.786 CC1(C[C@@H]1c2ccccc2)C(O)=O Amb25684837 [0,0,0,1,0,1|1,0,1]=4 5999 B14R2.786 C[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb24552946 [0,0,0,1,0,1|1,0,1]=4 6000 B14R2.786 C[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb25179070 [0,0,0,1,0,1|1,0,1]=4 6001 B14R2.786 C[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb25022674 [0,0,0,1,0,1|1,0,1]=4 6002 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb19374730 [0,0,0,1,0,1|1,0,1]=4 6003 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb22546302 [0,0,0,1,0,1|1,0,1]=4 6004 B14R2.786 N[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb25359928 [0,0,0,1,0,1|1,0,1]=4 6005 B14R2.786 N[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519858 [0,0,0,1,0,1|1,0,1]=4 6006 B14R2.786 N[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519225 [0,0,0,1,0,1|1,0,1]=4 6007 B14R2.786 OC(=O)C1(C)CC1c2ccccc2 Amb17335110 [0,0,0,1,0,1|1,0,1]=4 6008 B14R2.786 OC(=O)[C@@]1(F)C[C@@H]1c2ccccc2 Amb24538836 [0,0,0,1,0,1|1,0,1]=4 6009 B14R2.2899 O=C(OCc1ccccc1)[C@@H]2CO2 Amb25141523 [0,0,0,1,0,1|1,0,1]=4 6010 B14R2.2899 O=C(OCc1ccccc1)[C@H]2CO2 Amb24489595 [0,0,0,1,0,1|1,0,1]=4 6011 B14R2.9535 CC1(COc2ccccc12)C(O)=O Amb25102512 [0,0,0,1,0,1|1,0,1]=4 6012 B14R2.9535 N[C@]1(COc2ccccc12)C(O)=O Amb24453199 [0,0,0,1,0,1|1,0,1]=4 6013 B14R2.9535 OC(=O)C1(C)CCc2c1cccc2 Amb10843978 [0,0,0,1,0,1|1,0,1]=4 6014 B14R2.9535 OC(=O)C1(N)CCc2c1cccc2 Amb10601665 [0,0,0,1,0,1|1,0,1]=4 6015 B14R2.9535 OC(=O)C1(N)CCc2c1cccc2 Amb10610396 [0,0,0,1,0,1|1,0,1]=4 6016 B14R2.9535 OC(=O)C1(O)CCc2ccccc12 Amb18944703 [0,0,0,1,0,1|0,0,2]=4 6017 B14R2.9535 OC(=O)C1(O)COc2ccccc12 Amb24569519 [0,0,0,1,0,1|0,0,2]=4 6018 B14R2.4400 Cc1ccc(cc1)C2=CC(=O)C2=O Amb22171534 [0,1,0,1,0,0|1,0,1]=4 6019 B14R2.4400 O=C1C=C(c2ccc(Cl)cc2)C1=O Amb22171902 [0,1,0,1,0,0|1,0,1]=4 6020 B14R2.4400 O=C1C=C(c2ccc(F)cc2)C1=O Amb24456706 [0,1,0,1,0,0|1,0,1]=4 6021 B14R2.4400 O=C1C=C(c2ccc(I)cc2)C1=O Amb22172113 [0,1,0,1,0,0|1,0,1]=4 6022 B14R2.4402 Cc1ccc(cc1)C2OC2C(O)=O Amb19929991 [0,1,0,1,0,0|0,0,2]=4 6023 B14R2.4402 Cc1ccc(cc1)[C@@H]2C[C@@H]2C(O)=O Amb24512171 [0,1,0,1,0,0|1,0,1]=4 6024 B14R2.4402 Nc1ccc(cc1)[C@@H]2C[C@H]2C(O)=O Amb25799160 [0,1,0,1,0,0|1,0,1]=4 6025 B14R2.4402 Nc1ccc(cc1)[C@H]2C[C@@H]2C(O)=O Amb25176098 [0,1,0,1,0,0|1,0,1]=4 6026 B14R2.4402 OC(=O)C1CC1c2ccc(I)cc2 Amb25343384 [0,1,0,1,0,0|1,0,1]=4 6027 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)Cl Amb1935060 [0,1,0,1,0,0|1,0,1]=4 6028 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)F Amb17073012 [0,1,0,1,0,0|1,0,1]=4 6029 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)O Amb17568130 [0,1,0,1,0,0|1,0,1]=4 6030 B14R2.4402 OC(=O)C1OC1c2ccc(Br)cc2 Amb19929977 [0,1,0,1,0,0|0,0,2]=4 6031 B14R2.4402 OC(=O)C1OC1c2ccc(Cl)cc2 Amb19929982 [0,1,0,1,0,0|0,0,2]=4 6032 B14R2.4402 OC(=O)C1OC1c2ccc(F)cc2 Amb19929985 [0,1,0,1,0,0|0,0,2]=4 6033 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb25175756 [0,1,0,1,0,0|1,0,1]=4 6034 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24742590 [0,1,0,1,0,0|1,0,1]=4 6035 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24557857 [0,1,0,1,0,0|1,0,1]=4 6036 B14R2.4402 OC(=O)[C@@H]1O[C@@H]1c2ccc(F)cc2 Amb24571724 [0,1,0,1,0,0|0,0,2]=4 6037 B14R2.4402 OC(=O)[C@@H]1O[C@H]1c2ccc(Cl)cc2 Amb24602468 [0,1,0,1,0,0|0,0,2]=4 6038 B14R2.4402 OC(=O)[C@H]1C[C@@H]1c2ccc(F)cc2 Amb24600834 [0,1,0,1,0,0|1,0,1]=4 6039 B14R2.4402 OC(=O)[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb24739770 [0,1,0,1,0,0|1,0,1]=4 6040 B14R2.4402 Oc1ccc(cc1)[C@H]2C[C@H]2C(O)=O Amb25236047 [0,1,0,1,0,0|1,0,1]=4 6041 B14R2.4529 Brc1ccc2c(c1)[nH]c(c2)C(=O)O Amb1094011 [0,1,0,1,0,0|1,0,1]=4 6042 B14R2.4529 Brc1ccc2c(c1)cc([nH]2)C(=O)O Amb2234812 [0,1,0,1,0,0|1,0,1]=4 6043 B14R2.4529 Brc1ccc2c(c1)cc(o2)C(=O)O Amb1091880 [0,1,0,1,0,0|0,0,2]=4 6044 B14R2.4529 Brc1ccc2c(c1)cc(s2)C(=O)O Amb2423290 [0,1,0,1,0,0|0,1,1]=4 6045 B14R2.4529 Brc1ccc2c(c1)nc([nH]2)C(=O)O Amb10070853 [0,1,0,1,0,0|2,0,0]=4 6046 B14R2.4529 Brc1ccc2c(c1)oc(c2)C(=O)O Amb2446994 [0,1,0,1,0,0|0,0,2]=4 6047 B14R2.4529 CC(=O)C=1Cc2cc(F)ccc2C1 Amb24736304 [0,1,0,1,0,0|2,0,0]=4 6048 B14R2.4529 Cc1cc2CC(Cc2cc1)C(O)=O Amb25762849 [0,1,0,1,0,0|1,0,1]=4 6049 B14R2.4529 Cc1cc2NC(Cc2cc1)C(O)=O Amb25137184 [0,1,0,1,0,0|1,0,1]=4 6050 B14R2.4529 Cc1cc2N[C@@H](Cc2cc1)C(O)=O Amb25743962 [0,1,0,1,0,0|1,0,1]=4 6051 B14R2.4529 Cc1cc2OC(Cc2cc1)C(O)=O Amb22755246 [0,1,0,1,0,0|0,0,2]=4 6052 B14R2.4529 Cc1cc2[n]c([s]c2cc1)C(O)=O Amb22886603 [0,1,0,1,0,0|1,1,0]=4 6053 B14R2.4529 Cc1cc2[n]c(oc2cc1)C(O)=O Amb24580656 [0,1,0,1,0,0|1,0,1]=4 6054 B14R2.4529 Cc1cc2[s]c([n]c2cc1)C(O)=O Amb18138680 [0,1,0,1,0,0|1,1,0]=4 6055 B14R2.4529 Cc1ccc2N[C@@H](Cc2c1)C(O)=O Amb25293968 [0,1,0,1,0,0|1,0,1]=4 6056 B14R2.4529 Cc1ccc2c(c1)[nH]c(c2)C(=O)O Amb1106155 [0,1,0,1,0,0|1,0,1]=4 6057 B14R2.4529 Cc1ccc2c(c1)cc([nH]2)C(=O)O Amb1853352 [0,1,0,1,0,0|1,0,1]=4 6058 B14R2.4529 Cc1ccc2c(c1)cc(o2)C(=O)O Amb1950844 [0,1,0,1,0,0|0,0,2]=4 6059 B14R2.4529 Clc1ccc2c(c1)[nH]c(c2)C(=O)O Amb1227045 [0,1,0,1,0,0|1,0,1]=4 6060 B14R2.4529 Clc1ccc2c(c1)[nH]c(n2)C(=O)O Amb1102597 [0,1,0,1,0,0|2,0,0]=4 6061 B14R2.4529 Clc1ccc2c(c1)cc([nH]2)C(=O)O Amb1124439 [0,1,0,1,0,0|1,0,1]=4 6062 B14R2.4529 Clc1ccc2c(c1)cc(o2)C(=O)O Amb1154613 [0,1,0,1,0,0|0,0,2]=4 6063 B14R2.4529 Clc1ccc2c(c1)sc(c2)C(=O)O Amb2237307 [0,1,0,1,0,0|0,1,1]=4 6064 B14R2.4529 Fc1ccc2c(c1)[nH]c(c2)C(=O)O Amb2235022 [0,1,0,1,0,0|1,0,1]=4 6065 B14R2.4529 Fc1ccc2c(c1)[nH]c(n2)C(=O)O Amb1102547 [0,1,0,1,0,0|2,0,0]=4 6066 B14R2.4529 Fc1ccc2c(c1)cc([nH]2)C(=O)O Amb1131240 [0,1,0,1,0,0|1,0,1]=4 6067 B14R2.4529 Fc1ccc2c(c1)cc(s2)C(=O)O Amb1154250 [0,1,0,1,0,0|0,1,1]=4 6068 B14R2.4529 Fc1ccc2c(c1)sc(c2)C(=O)O Amb1106075 [0,1,0,1,0,0|0,1,1]=4 6069 B14R2.4529 Ic1ccc2c(c1)[nH]c(c2)C(=O)O Amb2235876 [0,1,0,1,0,0|1,0,1]=4 6070 B14R2.4529 Nc1cc2N[C@H](Cc2cc1)C(O)=O Amb24641574 [0,1,0,1,0,0|1,0,1]=4 6071 B14R2.4529 Nc1cc2[nH]c(cc2cc1)C(O)=O Amb18196971 [0,1,0,1,0,0|1,0,1]=4 6072 B14R2.4529 Nc1cc2[n]c([nH]c2cc1)C(O)=O Amb22500033 [0,1,0,1,0,0|2,0,0]=4 6073 B14R2.4529 Nc1cc2[s]c(cc2cc1)C(O)=O Amb18670820 [0,1,0,1,0,0|0,1,1]=4 6074 B14R2.4529 Nc1cc2oc([n]c2cc1)C(O)=O Amb23455742 [0,1,0,1,0,0|1,0,1]=4 6075 B14R2.4529 Nc1cc2oc(cc2cc1)C(O)=O Amb18670711 [0,1,0,1,0,0|0,0,2]=4 6076 B14R2.4529 Nc1ccc2N[C@@H](Cc2c1)C(O)=O Amb24331856 [0,1,0,1,0,0|1,0,1]=4 6077 B14R2.4529 Nc1ccc2OC(Cc2c1)C(O)=O Amb18670745 [0,1,0,1,0,0|0,0,2]=4 6078 B14R2.4529 Nc1ccc2c(c1)cc(o2)C(=O)O Amb10975495 [0,1,0,1,0,0|0,0,2]=4 6079 B14R2.4529 Nc1ccc2c(c1)cc(s2)C(=O)O Amb2196730 [0,1,0,1,0,0|0,1,1]=4 6080 B14R2.4529 Nc1ccc2c(c1)cc(s2)C(=O)O Amb2455030 [0,1,0,1,0,0|0,1,1]=4 6081 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)C Amb10607438 [0,1,0,1,0,0|1,0,1]=4 6082 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)C Amb13949031 [0,1,0,1,0,0|1,0,1]=4 6083 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)Cl Amb10607441 [0,1,0,1,0,0|1,0,1]=4 6084 B14R2.4529 OC(=O)C1Cc2c(N1)ccc(c2)Cl Amb11012593 [0,1,0,1,0,0|1,0,1]=4 6085 B14R2.4529 OC(=O)C1Cc2c(O1)ccc(c2)C Amb17605544 [0,1,0,1,0,0|0,0,2]=4 6086 B14R2.4529 OC(=O)C1Cc2c(S1)cc(cc2)Cl Amb2372509 [0,1,0,1,0,0|0,1,1]=4 6087 B14R2.4529 OC(=O)C1Cc2c(S1)cc(cc2)F Amb17606057 [0,1,0,1,0,0|0,1,1]=4 6088 B14R2.4529 OC(=O)C1Cc2c(S1)ccc(c2)F Amb2372511 [0,1,0,1,0,0|0,1,1]=4 6089 B14R2.4529 OC(=O)C1Cc2cc(Br)ccc2C1 Amb18156517 [0,1,0,1,0,0|1,0,1]=4 6090 B14R2.4529 OC(=O)C1Cc2cc(Br)ccc2O1 Amb22751595 [0,1,0,1,0,0|0,0,2]=4 6091 B14R2.4529 OC(=O)C1Cc2cc(F)ccc2C1 Amb24055929 [0,1,0,1,0,0|1,0,1]=4 6092 B14R2.4529 OC(=O)C1Cc2cc(F)ccc2N1 Amb23538786 [0,1,0,1,0,0|1,0,1]=4 6093 B14R2.4529 OC(=O)C1Cc2cc(I)ccc2O1 Amb22751604 [0,1,0,1,0,0|0,0,2]=4 6094 B14R2.4529 OC(=O)C1Cc2cc(S)ccc2O1 Amb24739285 [0,1,0,1,0,0|0,0,2]=4 6095 B14R2.4529 OC(=O)C1Cc2ccc(Br)cc2N1 Amb18561156 [0,1,0,1,0,0|1,0,1]=4 6096 B14R2.4529 OC(=O)C1Cc2ccc(Cl)cc2N1 Amb18561158 [0,1,0,1,0,0|1,0,1]=4 6097 B14R2.4529 OC(=O)C1Cc2ccc(Cl)cc2O1 Amb22751591 [0,1,0,1,0,0|0,0,2]=4 6098 B14R2.4529 OC(=O)C1Cc2ccc(F)cc2N1 Amb24740897 [0,1,0,1,0,0|1,0,1]=4 6099 B14R2.4529 OC(=O)C1Cc2ccc(F)cc2O1 Amb22755265 [0,1,0,1,0,0|0,0,2]=4 6100 B14R2.4529 OC(=O)C1Cc2ccc(I)cc2N1 Amb25377147 [0,1,0,1,0,0|1,0,1]=4 6101 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Br)ccc2C1 Amb25675093 [0,1,0,1,0,0|1,0,1]=4 6102 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Br)ccc2N1 Amb24331855 [0,1,0,1,0,0|1,0,1]=4 6103 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Cl)ccc2N1 Amb24331853 [0,1,0,1,0,0|1,0,1]=4 6104 B14R2.4529 OC(=O)[C@@H]1Cc2cc(Cl)ccc2O1 Amb25775019 [0,1,0,1,0,0|0,0,2]=4 6105 B14R2.4529 OC(=O)[C@@H]1Cc2cc(F)ccc2N1 Amb24574098 [0,1,0,1,0,0|1,0,1]=4 6106 B14R2.4529 OC(=O)[C@@H]1Cc2cc(I)ccc2N1 Amb25733578 [0,1,0,1,0,0|1,0,1]=4 6107 B14R2.4529 OC(=O)[C@@H]1Cc2ccc(Br)cc2N1 Amb25067972 [0,1,0,1,0,0|1,0,1]=4 6108 B14R2.4529 OC(=O)[C@@H]1Cc2ccc(I)cc2N1 Amb25809045 [0,1,0,1,0,0|1,0,1]=4 6109 B14R2.4529 OC(=O)[C@H]1Cc2cc(Br)ccc2N1 Amb24494019 [0,1,0,1,0,0|1,0,1]=4 6110 B14R2.4529 OC(=O)[C@H]1Cc2cc(F)ccc2N1 Amb24494197 [0,1,0,1,0,0|1,0,1]=4 6111 B14R2.4529 OC(=O)[C@H]1Cc2ccc(I)cc2N1 Amb24436041 [0,1,0,1,0,0|1,0,1]=4 6112 B14R2.4529 OC(=O)c1[nH]c2cc(Cl)ccc2[n]1 Amb22284161 [0,1,0,1,0,0|2,0,0]=4 6113 B14R2.4529 OC(=O)c1[nH]c2cc(F)ccc2[n]1 Amb22284152 [0,1,0,1,0,0|2,0,0]=4 6114 B14R2.4529 OC(=O)c1[n]c2cc(Br)ccc2[s]1 Amb25364002 [0,1,0,1,0,0|1,1,0]=4 6115 B14R2.4529 OC(=O)c1[n]c2cc(Br)ccc2o1 Amb21858304 [0,1,0,1,0,0|1,0,1]=4 6116 B14R2.4529 OC(=O)c1[n]c2cc(Cl)ccc2o1 Amb19889554 [0,1,0,1,0,0|1,0,1]=4 6117 B14R2.4529 OC(=O)c1[n]c2cc(F)ccc2o1 Amb22756785 [0,1,0,1,0,0|1,0,1]=4 6118 B14R2.4529 OC(=O)c1[n]c2ccc(Br)cc2[s]1 Amb22000905 [0,1,0,1,0,0|1,1,0]=4 6119 B14R2.4529 OC(=O)c1[n]c2ccc(Br)cc2o1 Amb22002388 [0,1,0,1,0,0|1,0,1]=4 6120 B14R2.4529 OC(=O)c1[n]c2ccc(Cl)cc2[s]1 Amb18671232 [0,1,0,1,0,0|1,1,0]=4 6121 B14R2.4529 OC(=O)c1[n]c2ccc(F)cc2[s]1 Amb18671241 [0,1,0,1,0,0|1,1,0]=4 6122 B14R2.4529 OC(=O)c1[n]c2ccc(F)cc2o1 Amb22756056 [0,1,0,1,0,0|1,0,1]=4 6123 B14R2.4529 OC(=O)c1[n]c2ccc(I)cc2[s]1 Amb25304302 [0,1,0,1,0,0|1,1,0]=4 6124 B14R2.4529 OC(=O)c1cc2cc(I)ccc2[s]1 Amb22736036 [0,1,0,1,0,0|0,1,1]=4 6125 B14R2.4529 OC(=O)c1cc2cc(I)ccc2o1 Amb22751603 [0,1,0,1,0,0|0,0,2]=4 6126 B14R2.4529 OC(=O)c1cc2ccc(Cl)cc2o1 Amb18188661 [0,1,0,1,0,0|0,0,2]=4 6127 B14R2.4529 OC(=O)c1cc2ccc(F)cc2o1 Amb18824570 [0,1,0,1,0,0|0,0,2]=4 6128 B14R2.4529 Oc1cc2cc([s]c2cc1)C(O)=O Amb18130069 [0,1,0,1,0,0|0,1,1]=4 6129 B14R2.4529 Oc1cc2oc(cc2cc1)C(O)=O Amb21864630 [0,1,0,1,0,0|0,0,2]=4 6130 B14R2.4529 Oc1ccc2CC(Nc2c1)C(O)=O Amb24649443 [0,1,0,1,0,0|1,0,1]=4 6131 B14R2.4529 Oc1ccc2CC(Oc2c1)C(O)=O Amb21837686 [0,1,0,1,0,0|0,0,2]=4 6132 B14R2.4529 Oc1ccc2C[C@@H](Nc2c1)C(O)=O Amb25082481 [0,1,0,1,0,0|1,0,1]=4 6133 B14R2.4529 Oc1ccc2NC(Cc2c1)C(O)=O Amb25044784 [0,1,0,1,0,0|1,0,1]=4 6134 B14R2.4529 Oc1ccc2N[C@@H](Cc2c1)C(O)=O Amb25131207 [0,1,0,1,0,0|1,0,1]=4 6135 B14R2.4529 Oc1ccc2N[C@H](Cc2c1)C(O)=O Amb24411023 [0,1,0,1,0,0|1,0,1]=4 6136 B14R2.4529 Oc1ccc2OC(Cc2c1)C(O)=O Amb21864638 [0,1,0,1,0,0|0,0,2]=4 6137 B14R2.4529 Oc1ccc2[nH]c([n]c2c1)C(O)=O Amb21858278 [0,1,0,1,0,0|2,0,0]=4 6138 B14R2.4529 Oc1ccc2[n]c([s]c2c1)C(O)=O Amb25849190 [0,1,0,1,0,0|1,1,0]=4 6139 B14R2.4529 Oc1ccc2[s]c([n]c2c1)C(O)=O Amb24400525 [0,1,0,1,0,0|1,1,0]=4 6140 B14R2.4529 Oc1ccc2c(c1)[nH]c(c2)C(=O)O Amb10879705 [0,1,0,1,0,0|1,0,1]=4 6141 B14R2.4529 Oc1ccc2c(c1)cc(o2)C(=O)O Amb13881926 [0,1,0,1,0,0|0,0,2]=4 6142 B14R2.4529 Oc1ccc2oc([n]c2c1)C(O)=O Amb25295446 [0,1,0,1,0,0|1,0,1]=4 6143 B14R2.8239 CC1=Cc2cc(O)ccc2OC1=O Amb24492395 [0,1,0,1,0,0|1,0,1]=4 6144 B14R2.8239 CC1=Cc2ccc(N)cc2OC1=O Amb24424532 [0,1,0,1,0,0|1,0,1]=4 6145 B14R2.8239 CC1=Cc2ccc(O)cc2OC1=O Amb18127560 [0,1,0,1,0,0|1,0,1]=4 6146 B14R2.8239 CC1=Nc2ccc(C)cc2CC1=O Amb25334939 [0,1,0,1,0,0|2,0,0]=4 6147 B14R2.8239 CC1=Nc2ccc(N)cc2OC1=O Amb18028962 [0,1,0,1,0,0|2,0,0]=4 6148 B14R2.8239 CC1=Nc2ccc(O)cc2OC1=O Amb18127819 [0,1,0,1,0,0|2,0,0]=4 6149 B14R2.8239 CC1Cc2cc(O)ccc2OC1=O Amb25729135 [0,1,0,1,0,0|1,0,1]=4 6150 B14R2.8239 CN1Cc2cc(Br)ccc2OC1=O Amb17844347 [0,1,0,1,0,0|2,0,0]=4 6151 B14R2.8239 Cc1cc2C=C(Br)C(=O)Oc2cc1 Amb23580464 [0,1,0,1,0,0|1,0,1]=4 6152 B14R2.8239 Cc1cc2C=C(Cl)C(=O)Oc2cc1 Amb24084284 [0,1,0,1,0,0|1,0,1]=4 6153 B14R2.8239 Cc1cc2C=C(O)C(=O)Nc2cc1 Amb22752606 [0,1,0,1,0,0|2,0,0]=4 6154 B14R2.8239 Cc1cc2N=C(N)C(=O)Oc2cc1 Amb18647952 [0,1,0,1,0,0|2,0,0]=4 6155 B14R2.8239 Cc1cc2NC(=O)C(=O)Nc2cc1 Amb18043058 [0,1,0,1,0,0|2,0,0]=4 6156 B14R2.8239 Cc1cc2NC(=O)C(O)=Cc2cc1 Amb22752604 [0,1,0,1,0,0|2,0,0]=4 6157 B14R2.8239 Clc1ccc2c(c1)[nH]c(=O)c(=O)[nH]2 Amb2405481 [0,1,0,1,0,0|2,0,0]=4 6158 B14R2.8239 N=C1Cc2ccc(O)cc2OC1=O Amb24544658 [0,1,0,1,0,0|1,0,0]=3 6159 B14R2.8239 NC1=CC2=NC(=O)C(=O)N=C2C=C1 Amb24367324 [0,1,0,1,0,0|2,0,0]=4 6160 B14R2.8239 NC1=Cc2cc(Br)ccc2OC1=O Amb25116013 [0,1,0,1,0,0|1,0,1]=4 6161 B14R2.8239 NC1=Cc2cc(O)ccc2OC1=O Amb25189956 [0,1,0,1,0,0|1,0,1]=4 6162 B14R2.8239 NC1=Cc2ccc(F)cc2OC1=O Amb25127899 [0,1,0,1,0,0|1,0,1]=4 6163 B14R2.8239 NC1=Cc2ccc(O)cc2OC1=O Amb19958301 [0,1,0,1,0,0|1,0,1]=4 6164 B14R2.8239 NC1=Cc2ccc(O)cc2OC1=O Amb22899519 [0,1,0,1,0,0|1,0,1]=4 6165 B14R2.8239 NC1=Nc2cc(Cl)ccc2OC1=O Amb24309782 [0,1,0,1,0,0|2,0,0]=4 6166 B14R2.8239 Nc1cc2C=C(O)C(=O)Oc2cc1 Amb24433960 [0,1,0,1,0,0|0,0,2]=4 6167 B14R2.8239 Nc1cc2NC(=O)C(=O)Nc2cc1 Amb18038531 [0,1,0,1,0,0|2,0,0]=4 6168 B14R2.8239 Nc1cc2NC(=O)C(=O)Nc2cc1 Amb21955545 [0,1,0,1,0,0|2,0,0]=4 6169 B14R2.8239 O=C1Nc2cc(Br)ccc2NC1=O Amb18541037 [0,1,0,1,0,0|2,0,0]=4 6170 B14R2.8239 O=C1Nc2cc(Cl)ccc2NC1=O Amb18043060 [0,1,0,1,0,0|2,0,0]=4 6171 B14R2.8239 O=C1Nc2cc(F)ccc2NC1=O Amb18043059 [0,1,0,1,0,0|2,0,0]=4 6172 B14R2.8239 O=C1Nc2cc(I)ccc2NC1=O Amb24488714 [0,1,0,1,0,0|2,0,0]=4 6173 B14R2.8239 O=C1Nc2cc(S)ccc2NC1=O Amb25088247 [0,1,0,1,0,0|2,0,0]=4 6174 B14R2.8239 O=C1Oc2cc(F)ccc2C=C1Br Amb24611080 [0,1,0,1,0,0|1,0,1]=4 6175 B14R2.8239 O=C1Oc2cc(F)ccc2C=C1I Amb25178755 [0,1,0,1,0,0|1,0,1]=4 6176 B14R2.8239 O=C1Oc2cc(F)ccc2NC1=O Amb25245855 [0,1,0,1,0,0|1,0,0]=3 6177 B14R2.8239 O=C1Oc2ccc(Cl)cc2C=C1Br Amb23580471 [0,1,0,1,0,0|1,0,1]=4 6178 B14R2.8239 O=C1Oc2ccc(Cl)cc2C=C1Cl Amb24084282 [0,1,0,1,0,0|1,0,1]=4 6179 B14R2.8239 O=C1Oc2ccc(Cl)cc2N=C1Cl Amb24084257 [0,1,0,1,0,0|2,0,0]=4 6180 B14R2.8239 O=C1Oc2ccc(Cl)cc2NC1=O Amb25190428 [0,1,0,1,0,0|1,0,0]=3 6181 B14R2.8239 O=C1Oc2ccc(Cl)cc2NC1=S Amb24490403 [0,1,0,1,0,0|1,1,0]=4 6182 B14R2.8239 O=C1Oc2ccc(F)cc2C=C1Br Amb23580472 [0,1,0,1,0,0|1,0,1]=4 6183 B14R2.8239 O=C1Oc2ccc(F)cc2NC1=O Amb25721183 [0,1,0,1,0,0|1,0,0]=3 6184 B14R2.8239 OC1=Cc2cc(Br)ccc2OC1=O Amb22734842 [0,1,0,1,0,0|0,0,2]=4 6185 B14R2.8239 OC1=Cc2cc(Cl)ccc2NC1=O Amb24658218 [0,1,0,1,0,0|2,0,0]=4 6186 B14R2.8239 OC1=Cc2cc(F)ccc2NC1=O Amb25124313 [0,1,0,1,0,0|2,0,0]=4 6187 B14R2.8239 OC1=Cc2ccc(Br)cc2NC1=O Amb25041039 [0,1,0,1,0,0|2,0,0]=4 6188 B14R2.8239 OC1=Cc2ccc(F)cc2NC1=O Amb24443312 [0,1,0,1,0,0|2,0,0]=4 6189 B14R2.8239 Oc1cc2CC(=O)C(=O)Oc2cc1 Amb24492602 [0,1,0,1,0,0|0,0,0]=2 6190 B14R2.8239 Oc1cc2NC(=O)C(=O)Nc2cc1 Amb18128049 [0,1,0,1,0,0|2,0,0]=4 6191 B14R2.8239 Oc1cc2OC(=O)C(=O)Nc2cc1 Amb18128302 [0,1,0,1,0,0|1,0,0]=3 6192 B14R2.8239 Oc1cc2OC(=O)C(Br)=Cc2cc1 Amb24556387 [0,1,0,1,0,0|1,0,1]=4 6193 B14R2.8239 Oc1cc2OC(=O)C(Cl)=Cc2cc1 Amb25280609 [0,1,0,1,0,0|1,0,1]=4 6194 B14R2.30 Nc1[n]o[n]c1Cc2ccccc2 Amb18633335 [0,1,0,1,0,0|2,0,0]=4 6195 B14R2.30 Nc1nocc1Cc2ccccc2 Amb17104814 [0,1,0,1,0,0|2,0,0]=4 6196 B14R2.30 Nc1oc[n]c1Cc2ccccc2 Amb22296988 [0,1,0,1,0,0|2,0,0]=4 6197 B14R2.30 Nc1oncc1Cc2ccccc2 Amb17104784 [0,1,0,1,0,0|2,0,0]=4 6198 B14R2.30 O=C1OCC=C1Nc2ccccc2 Amb25216120 [0,1,0,1,0,0|2,0,0]=4 6199 B14R2.30 O=C1OCC=C1Sc2ccccc2 Amb21928057 [0,1,0,1,0,0|2,0,0]=4 6200 B14R2.30 O=C1OCCC1=Cc2ccccc2 Amb24097489 [0,1,0,1,0,0|1,0,1]=4 6201 B14R2.30 O=C1OCCN1Cc2ccccc2 Amb25808956 [0,1,0,1,0,0|2,0,0]=4 6202 B14R2.30 Oc1[n][nH]cc1Cc2ccccc2 Amb23515252 [0,1,0,1,0,0|2,0,0]=4 6203 B14R2.30 Oc1nsnc1Cc2ccccc2 Amb10072033 [0,1,0,1,0,0|1,1,0]=4 6204 B14R2.447 CC=1C(=O)C(O)C1c2ccccc2 Amb25282743 [0,1,0,1,0,0|1,0,1]=4 6205 B14R2.447 O=C1C(=O)C(c2ccccc2)C1=O Amb25034285 [0,1,0,1,0,0|0,0,1]=3 6206 B14R2.447 OC1=C(c2ccccc2)C(=O)C1=O Amb24496716 [0,1,0,1,0,0|0,0,1]=3 6207 B14R2.447 OC1C(=O)C(Cl)=C1c2ccccc2 Amb24495798 [0,1,0,1,0,0|1,0,1]=4 6208 B14R2.958 COC(=O)N1CC1c2ccccc2 Amb1039317 [0,1,0,1,0,0|2,0,0]=4 6209 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,1,0,1,0,0|1,0,1]=4 6210 B14R2.958 ONC(=O)C1CC1c2ccccc2 Amb25332697 [0,1,0,1,0,0|1,0,1]=4 6211 B14R2.972 COC(=O)C1Cc2ccccc2C1 Amb21859222 [0,1,0,1,0,0|1,0,1]=4 6212 B14R2.972 COC(=O)C=1Cc2ccccc2C1 Amb25776174 [0,1,0,1,0,0|1,0,0]=3 6213 B14R2.972 COC(=O)[C@@H]1Cc2ccccc2N1 Amb18180641 [0,1,0,1,0,0|1,0,1]=4 6214 B14R2.972 COC(=O)[C@H]1Cc2ccccc2N1 Amb25751911 [0,1,0,1,0,0|1,0,1]=4 6215 B14R2.972 COC(=O)c1[nH]c2ccccc2[n]1 Amb22899964 [0,1,0,1,0,0|2,0,0]=4 6216 B14R2.972 COC(=O)c1[n]c2ccccc2o1 Amb19958887 [0,1,0,1,0,0|1,0,1]=4 6217 B14R2.972 COC(=O)c1cc2c([nH]1)cccc2 Amb1030871 [0,1,0,1,0,0|1,0,1]=4 6218 B14R2.972 COC(=O)c1cc2c(o1)cccc2 Amb2438530 [0,1,0,1,0,0|0,0,2]=4 6219 B14R2.972 COC(=O)c1cc2c(s1)cccc2 Amb1089421 [0,1,0,1,0,0|0,1,1]=4 6220 B14R2.972 NNC(=O)C=1Cc2ccccc2C1 Amb24377731 [0,1,0,1,0,0|2,0,0]=4 6221 B14R2.972 OCC(=O)c1cc2ccccc2[nH]1 Amb24744518 [0,1,0,1,0,0|1,0,1]=4 6222 B14R2.972 OCC(=O)c1cc2ccccc2o1 Amb18808836 [0,1,0,1,0,0|0,0,2]=4 6223 B14R2.972 ONC(=O)C1Cc2ccccc2N1 Amb25803952 [0,1,0,1,0,0|1,0,1]=4 6224 B14R2.972 ONC(=O)c1cc2ccccc2[nH]1 Amb24658826 [0,1,0,1,0,0|1,0,1]=4 6225 B14R2.972 ONC(=O)c1cc2ccccc2[s]1 Amb19079315 [0,1,0,1,0,0|0,1,1]=4 6226 B14R2.1128 C=CC1=Cc2ccccc2OC1=O Amb25830590 [0,1,0,1,0,0|1,0,1]=4 6227 B14R2.1128 CC=1Oc2ccccc2SC1C=O Amb24534419 [0,1,0,1,0,0|2,0,0]=4 6228 B14R2.1128 COC1=Cc2ccccc2OC1=O Amb23512578 [0,1,0,1,0,0|0,0,2]=4 6229 B14R2.1128 COc1[n]c2ccccc2[nH]c1=O Amb24102316 [0,1,0,1,0,0|2,0,0]=4 6230 B14R2.1128 N#CC1=Cc2ccccc2OC1=O Amb18531768 [0,1,0,1,0,0|1,0,1]=4 6231 B14R2.1128 NC=1Oc2ccccc2CC1C#N Amb19337145 [0,1,0,1,0,0|2,0,0]=4 6232 B14R2.1128 NCC1=Cc2ccccc2OC1=O Amb18908987 [0,1,0,1,0,0|1,0,1]=4 6233 B14R2.1128 O=C1Nc2ccccc2C=C1C=O Amb18014582 [0,1,0,1,0,0|1,0,1]=4 6234 B14R2.1128 O=C1Oc2ccccc2C=C1C=O Amb18647793 [0,1,0,1,0,0|0,0,1]=3 6235 B14R2.1128 O=C1Oc2ccccc2C=C1CCl Amb21937093 [0,1,0,1,0,0|1,0,1]=4 6236 B14R2.1128 O=CC=1Cc2ccccc2CC1Cl Amb24620144 [0,1,0,1,0,0|2,0,0]=4 6237 B14R2.1128 O=CC=1Cc2ccccc2NC1Cl Amb24753701 [0,1,0,1,0,0|2,0,0]=4 6238 B14R2.1128 O=Cc1cc2ccccc2nc1O Amb1794818 [0,1,0,1,0,0|1,0,1]=4 6239 B14R2.1128 O=Cc1nc2ccccc2nc1O Amb17594377 [0,1,0,1,0,0|2,0,0]=4 6240 B14R2.1128 OCC1=Cc2ccccc2NC1=O Amb18528795 [0,1,0,1,0,0|2,0,0]=4 6241 B14R2.1128 OCC1=Cc2ccccc2OC1=O Amb24495416 [0,1,0,1,0,0|0,0,2]=4 6242 B14R2.1128 OCC1=Nc2ccccc2NC1=O Amb18184029 [0,1,0,1,0,0|2,0,0]=4 6243 B14R2.1128 ONC1=Nc2ccccc2NC1=O Amb20641462 [0,1,0,1,0,0|2,0,0]=4 6244 B14R2.1128 ONC1=Nc2ccccc2OC1=O Amb20641490 [0,1,0,1,0,0|1,0,1]=4 6245 B14R2.1128 ONC1=Nc2ccccc2SC1=O Amb20641550 [0,1,0,1,0,0|2,0,0]=4 6246 B14R2.1128 Oc1cc2ccccc2[n]c1C=O Amb24104528 [0,1,0,1,0,0|2,0,0]=4 6247 B14R2.1128 Oc1cc2ccccc2cc1N=O Amb25190069 [0,1,0,1,0,0|1,0,1]=4 6248 B14R2.1134 O\N=C/1\C=C(C1=O)c2ccccc2 Amb24578274 [0,1,0,1,0,0|1,0,1]=4 6249 B14R2.4514 C=C1C(COC1=O)c2ccccc2 Amb24417074 [0,1,0,1,0,0|1,0,0]=3 6250 B14R2.4514 CC1C(OCC1=O)c2ccccc2 Amb25370856 [0,1,0,1,0,0|1,0,1]=4 6251 B14R2.4514 CN1C(COC1=O)c2ccccc2 Amb25191541 [0,1,0,1,0,0|2,0,0]=4 6252 B14R2.4514 CN1[C@H](COC1=O)c2ccccc2 Amb24362005 [0,1,0,1,0,0|2,0,0]=4 6253 B14R2.4514 C[C@H]1[C@@H](OCC1=O)c2ccccc2 Amb24512682 [0,1,0,1,0,0|1,0,1]=4 6254 B14R2.4514 N[C@@H]1[C@H](ONC1=O)c2ccccc2 Amb24744776 [0,1,0,1,0,0|1,0,1]=4 6255 B14R2.4514 O=C1C(=CNC1=O)c2ccccc2 Amb25192458 [0,1,0,1,0,0|1,0,1]=4 6256 B14R2.4514 O=C1C(=NOC1=O)c2ccccc2 Amb25265573 [0,1,0,1,0,0|0,0,1]=3 6257 B14R2.4514 O=C1C(=O)OCN1c2ccccc2 Amb24378061 [0,1,0,1,0,0|1,0,0]=3 6258 B14R2.4514 O=C1C=NN(c2ccccc2)C1=O Amb24467562 [0,1,0,1,0,0|2,0,0]=4 6259 B14R2.4514 O=C1CCN(c2ccccc2)C1=O Amb18795566 [0,1,0,1,0,0|2,0,0]=4 6260 B14R2.4514 O=C1ONC(=C1Cl)c2ccccc2 Amb25244131 [0,1,0,1,0,0|1,0,1]=4 6261 B14R2.4514 O=c1o[nH]c(c1Br)c2ccccc2 Amb10552907 [0,1,0,1,0,0|1,0,1]=4 6262 B14R2.4514 O=c1o[nH]c(c1C)c2ccccc2 Amb10553850 [0,1,0,1,0,0|1,0,1]=4 6263 B14R2.8188 CC1=C(N)C(=O)Oc2ccccc21 Amb18127405 [0,1,0,1,0,0|1,0,1]=4 6264 B14R2.8188 CC1=C(N)c2ccccc2OC1=O Amb18127404 [0,1,0,1,0,0|1,0,1]=4 6265 B14R2.8188 CC1=C(O)C(=O)Nc2ccccc21 Amb22752590 [0,1,0,1,0,0|2,0,0]=4 6266 B14R2.8188 CC1=C(O)c2ccccc2NC1=O Amb22752589 [0,1,0,1,0,0|2,0,0]=4 6267 B14R2.8188 CC1=C(O)c2ccccc2OC1=O Amb20247475 [0,1,0,1,0,0|1,0,1]=4 6268 B14R2.8188 CC1Oc2ccccc2C(C)C1=O Amb25128967 [0,1,0,1,0,0|1,0,1]=4 6269 B14R2.8188 CC=1C(=O)Oc2ccccc2C1C Amb20247473 [0,1,0,1,0,0|1,0,1]=4 6270 B14R2.8188 CC=1Cc2ccccc2C(=O)C1O Amb25066311 [0,1,0,1,0,0|1,0,0]=3 6271 B14R2.8188 CC=1Nc2ccccc2C(=O)C1O Amb20171457 [0,1,0,1,0,0|2,0,0]=4 6272 B14R2.8188 CC=1Oc2ccccc2C(=O)C1O Amb24633658 [0,1,0,1,0,0|2,0,0]=4 6273 B14R2.8188 CN1C(=O)C(O)=Cc2ccccc12 Amb22751143 [0,1,0,1,0,0|2,0,0]=4 6274 B14R2.8188 CN1C(O)c2ccccc2OC1=O Amb25115917 [0,1,0,1,0,0|2,0,0]=4 6275 B14R2.8188 CN1c2ccccc2CC(=O)C1=O Amb24492727 [0,1,0,1,0,0|1,0,0]=3 6276 B14R2.8188 CN1c2ccccc2NC(=O)C1=O Amb19516760 [0,1,0,1,0,0|2,0,0]=4 6277 B14R2.8188 NC1=C(O)c2ccccc2OC1=O Amb18127826 [0,1,0,1,0,0|1,0,1]=4 6278 B14R2.8188 NC1Cc2ccccc2N(O)C1=O Amb22372298 [0,1,0,1,0,0|1,0,1]=4 6279 B14R2.8188 NC=1C(=O)Oc2ccccc2C1N Amb18647951 [0,1,0,1,0,0|1,0,1]=4 6280 B14R2.8188 NN1c2ccccc2NC(=O)C1=O Amb25828466 [0,1,0,1,0,0|2,0,0]=4 6281 B14R2.8188 N[C@@H]1Cc2ccccc2N(O)C1=O Amb22746376 [0,1,0,1,0,0|1,0,1]=4 6282 B14R2.8188 N[C@H]1Cc2ccccc2N(O)C1=O Amb25039392 [0,1,0,1,0,0|1,0,1]=4 6283 B14R2.8188 O=C1C(=Cc2c(C1=O)cccc2)O Amb17594373 [0,1,0,1,0,0|1,0,1]=4 6284 B14R2.8188 O=C1C(=O)Cc2ccccc2C1=O Amb24575959 [0,1,0,1,0,0|0,0,1]=3 6285 B14R2.8188 O=C1C(=O)Oc2ccccc2C1=O Amb24492787 [0,1,0,1,0,0|0,0,1]=3 6286 B14R2.8188 O=C1Cc2ccccc2C(=O)N1C Amb2406825 [0,1,0,1,0,0|2,0,0]=4 6287 B14R2.8188 O=C1Cc2ccccc2C(=O)N1O Amb10553629 [0,1,0,1,0,0|1,0,0]=3 6288 B14R2.8188 O=C1Oc2ccccc2C(Br)=C1Br Amb24084280 [0,1,0,1,0,0|1,0,1]=4 6289 B14R2.8188 O=C1Oc2ccccc2C(C1Br)Br Amb2137043 [0,1,0,1,0,0|1,0,1]=4 6290 B14R2.8188 O=C1Oc2ccccc2C(Cl)=C1Cl Amb20001572 [0,1,0,1,0,0|1,0,1]=4 6291 B14R2.8188 O=c1[nH]c2ccccc2c(c1Br)O Amb1303079 [0,1,0,1,0,0|2,0,0]=4 6292 B14R2.8188 O=c1oc2ccccc2c(c1Br)O Amb1883962 [0,1,0,1,0,0|1,0,1]=4 6293 B14R2.8188 OC1=C(Br)C(=O)Nc2ccccc21 Amb19667944 [0,1,0,1,0,0|2,0,0]=4 6294 B14R2.8188 OC1=C(Br)C(=O)Oc2ccccc21 Amb19517267 [0,1,0,1,0,0|1,0,1]=4 6295 B14R2.8188 OC1=C(Cl)C(=O)Nc2ccccc21 Amb22433700 [0,1,0,1,0,0|2,0,0]=4 6296 B14R2.8188 OC1=C(F)C(=O)Nc2ccccc21 Amb19667464 [0,1,0,1,0,0|2,0,0]=4 6297 B14R2.8188 OC=1C(=O)Nc2ccccc2C1O Amb21912810 [0,1,0,1,0,0|1,0,1]=4 6298 B14R2.8188 OC=1C(=O)Oc2ccccc2C1I Amb22488353 [0,1,0,1,0,0|0,0,2]=4 6299 B14R2.8188 OC=1C(=O)c2ccccc2SC1Br Amb25315767 [0,1,0,1,0,0|2,0,0]=4 6300 B14R2.8188 ON1C(=O)Nc2ccccc2C1=O Amb25743026 [0,1,0,1,0,0|2,0,0]=4 6301 B14R2.8188 ON1c2ccccc2OC(=O)C1=O Amb20663543 [0,1,0,1,0,0|1,0,0]=3 6302 B14R2.8188 Oc1nc2ccccc2n(c1=O)C Amb10553642 [0,1,0,1,0,0|2,0,0]=4 6303 B14R2.10659 CC1(Cc2ccccc12)C(=O)OC Amb25341517 [0,1,0,1,0,0|1,0,1]=4 6304 B14R2.17474 C=CC1(O)C(=O)Cc2ccccc12 Amb25713561 [0,1,0,1,0,0|1,0,1]=4 6305 B14R2.4476 Cc1cc(ccc1)C2OC2C(O)=O Amb19929990 [0,1,0,1,0,0|0,0,2]=4 6306 B14R2.4476 Cc1cc(ccc1)[C@H]2C[C@@H]2C(O)=O Amb24567212 [0,1,0,1,0,0|1,0,1]=4 6307 B14R2.4476 Nc1cc(ccc1)C2CC2C(O)=O Amb25238282 [0,1,0,1,0,0|1,0,1]=4 6308 B14R2.4476 OC(=O)C1CC1c2cccc(c2)O Amb17568185 [0,1,0,1,0,0|1,0,1]=4 6309 B14R2.4476 OC(=O)C1OC1c2cc(Br)ccc2 Amb19929979 [0,1,0,1,0,0|0,0,2]=4 6310 B14R2.4476 OC(=O)C1OC1c2cc(Cl)ccc2 Amb19929981 [0,1,0,1,0,0|0,0,2]=4 6311 B14R2.4476 OC(=O)C1OC1c2cc(F)ccc2 Amb19929984 [0,1,0,1,0,0|0,0,2]=4 6312 B14R2.4476 OC(=O)[C@@H]1CC1c2cc(Br)ccc2 Amb24058242 [0,1,0,1,0,0|1,0,1]=4 6313 B14R2.4476 OC(=O)[C@@H]1C[C@H]1c2cc(F)ccc2 Amb25322492 [0,1,0,1,0,0|1,0,1]=4 6314 B14R2.4476 OC(=O)[C@H]1C[C@@H]1c2cc(Cl)ccc2 Amb25322133 [0,1,0,1,0,0|1,0,1]=4 6315 B14R2.4476 Oc1cccc(c1)[C@H]2C[C@@H]2C(O)=O Amb24738654 [0,1,0,1,0,0|1,0,1]=4 6316 B14R2.7969 CC(=O)C=1Cc2c(F)cccc2C1 Amb25238920 [0,1,0,1,0,0|2,0,0]=4 6317 B14R2.7969 Cc1cccc2CC(Nc21)C(O)=O Amb25689483 [0,1,0,1,0,0|1,0,1]=4 6318 B14R2.7969 Cc1cccc2CC(Oc21)C(O)=O Amb22755216 [0,1,0,1,0,0|0,0,2]=4 6319 B14R2.7969 Cc1cccc2C[C@H](Nc21)C(O)=O Amb25328482 [0,1,0,1,0,0|1,0,1]=4 6320 B14R2.7969 Cc1cccc2NC(Cc21)C(O)=O Amb25758824 [0,1,0,1,0,0|1,0,1]=4 6321 B14R2.7969 Cc1cccc2N[C@H](Cc21)C(O)=O Amb25726903 [0,1,0,1,0,0|1,0,1]=4 6322 B14R2.7969 Cc1cccc2OC(Cc21)C(O)=O Amb22755232 [0,1,0,1,0,0|0,0,2]=4 6323 B14R2.7969 Cc1cccc2[n]c([s]c21)C(O)=O Amb22886593 [0,1,0,1,0,0|1,1,0]=4 6324 B14R2.7969 Cc1cccc2[s]c([n]c21)C(O)=O Amb18138640 [0,1,0,1,0,0|1,1,0]=4 6325 B14R2.7969 Cc1cccc2oc(cc21)C(O)=O Amb18197060 [0,1,0,1,0,0|0,0,2]=4 6326 B14R2.7969 Nc1cccc2CC(Cc21)C(O)=O Amb25736233 [0,1,0,1,0,0|1,0,1]=4 6327 B14R2.7969 Nc1cccc2CC(Nc21)C(O)=O Amb24440929 [0,1,0,1,0,0|1,0,1]=4 6328 B14R2.7969 Nc1cccc2CC(Oc21)C(O)=O Amb24685607 [0,1,0,1,0,0|0,0,2]=4 6329 B14R2.7969 Nc1cccc2NC(Cc21)C(O)=O Amb25758657 [0,1,0,1,0,0|1,0,1]=4 6330 B14R2.7969 Nc1cccc2N[C@H](Cc21)C(O)=O Amb25786215 [0,1,0,1,0,0|1,0,1]=4 6331 B14R2.7969 Nc1cccc2[nH]c([n]c21)C(O)=O Amb24664532 [0,1,0,1,0,0|2,0,0]=4 6332 B14R2.7969 Nc1cccc2[nH]c(cc21)C(O)=O Amb22494133 [0,1,0,1,0,0|1,0,1]=4 6333 B14R2.7969 Nc1cccc2[s]c(cc21)C(O)=O Amb18138384 [0,1,0,1,0,0|0,1,1]=4 6334 B14R2.7969 Nc1cccc2oc([n]c21)C(O)=O Amb25793583 [0,1,0,1,0,0|1,0,1]=4 6335 B14R2.7969 Nc1cccc2oc(cc21)C(O)=O Amb18670700 [0,1,0,1,0,0|0,0,2]=4 6336 B14R2.7969 OC(=O)C1Cc2c(Cl)cccc2N1 Amb24381409 [0,1,0,1,0,0|1,0,1]=4 6337 B14R2.7969 OC(=O)C1Cc2c(I)cccc2N1 Amb25351458 [0,1,0,1,0,0|1,0,1]=4 6338 B14R2.7969 OC(=O)C1Cc2cccc(Br)c2C1 Amb18156516 [0,1,0,1,0,0|1,0,1]=4 6339 B14R2.7969 OC(=O)C1Cc2cccc(Br)c2N1 Amb25296472 [0,1,0,1,0,0|1,0,1]=4 6340 B14R2.7969 OC(=O)C1Cc2cccc(Br)c2S1 Amb24386012 [0,1,0,1,0,0|0,1,1]=4 6341 B14R2.7969 OC(=O)C1Cc2cccc(Cl)c2C1 Amb24740757 [0,1,0,1,0,0|1,0,1]=4 6342 B14R2.7969 OC(=O)C1Cc2cccc(Cl)c2O1 Amb22235978 [0,1,0,1,0,0|0,0,2]=4 6343 B14R2.7969 OC(=O)C1Cc2cccc(F)c2O1 Amb19148286 [0,1,0,1,0,0|0,0,2]=4 6344 B14R2.7969 OC(=O)C1Sc2c(C1)c(C)ccc2 Amb17606054 [0,1,0,1,0,0|0,1,1]=4 6345 B14R2.7969 OC(=O)C1Sc2c(C1)c(Cl)ccc2 Amb17606055 [0,1,0,1,0,0|0,1,1]=4 6346 B14R2.7969 OC(=O)C1Sc2c(C1)c(F)ccc2 Amb2372510 [0,1,0,1,0,0|0,1,1]=4 6347 B14R2.7969 OC(=O)C=1Cc2cccc(F)c2C1 Amb25174454 [0,1,0,1,0,0|1,0,0]=3 6348 B14R2.7969 OC(=O)[C@@H]1Cc2c(Br)cccc2N1 Amb25062422 [0,1,0,1,0,0|1,0,1]=4 6349 B14R2.7969 OC(=O)[C@@H]1Cc2c(F)cccc2N1 Amb24385948 [0,1,0,1,0,0|1,0,1]=4 6350 B14R2.7969 OC(=O)[C@@H]1Cc2cccc(F)c2N1 Amb24341239 [0,1,0,1,0,0|1,0,1]=4 6351 B14R2.7969 OC(=O)[C@H]1Cc2c(Br)cccc2N1 Amb25067361 [0,1,0,1,0,0|1,0,1]=4 6352 B14R2.7969 OC(=O)[C@H]1Cc2c(I)cccc2N1 Amb25067860 [0,1,0,1,0,0|1,0,1]=4 6353 B14R2.7969 OC(=O)[C@H]1Cc2cccc(I)c2N1 Amb25301749 [0,1,0,1,0,0|1,0,1]=4 6354 B14R2.7969 OC(=O)c1[nH]c2c(Br)cccc2[n]1 Amb25670164 [0,1,0,1,0,0|2,0,0]=4 6355 B14R2.7969 OC(=O)c1[nH]c2cccc(Cl)c2[n]1 Amb24529364 [0,1,0,1,0,0|2,0,0]=4 6356 B14R2.7969 OC(=O)c1[nH]c2cccc(I)c2[n]1 Amb25267935 [0,1,0,1,0,0|2,0,0]=4 6357 B14R2.7969 OC(=O)c1[nH]c2cccc(S)c2[n]1 Amb25270326 [0,1,0,1,0,0|2,0,0]=4 6358 B14R2.7969 OC(=O)c1[n]c2c(Br)cccc2[s]1 Amb18671236 [0,1,0,1,0,0|1,1,0]=4 6359 B14R2.7969 OC(=O)c1[n]c2c(Br)cccc2o1 Amb21858305 [0,1,0,1,0,0|1,0,1]=4 6360 B14R2.7969 OC(=O)c1[n]c2c(Cl)cccc2[s]1 Amb18671237 [0,1,0,1,0,0|1,1,0]=4 6361 B14R2.7969 OC(=O)c1[n]c2c(F)cccc2[s]1 Amb18671242 [0,1,0,1,0,0|1,1,0]=4 6362 B14R2.7969 OC(=O)c1[n]c2c(F)cccc2o1 Amb24658774 [0,1,0,1,0,0|1,0,1]=4 6363 B14R2.7969 OC(=O)c1[n]c2cccc(Br)c2o1 Amb21962695 [0,1,0,1,0,0|1,0,1]=4 6364 B14R2.7969 OC(=O)c1[n]c2cccc(Cl)c2o1 Amb25157758 [0,1,0,1,0,0|1,0,1]=4 6365 B14R2.7969 OC(=O)c1[n]c2cccc(F)c2[s]1 Amb22497281 [0,1,0,1,0,0|1,1,0]=4 6366 B14R2.7969 OC(=O)c1cc2c(Br)cccc2o1 Amb18730278 [0,1,0,1,0,0|0,0,2]=4 6367 B14R2.7969 OC(=O)c1cc2c(Cl)cccc2o1 Amb18652523 [0,1,0,1,0,0|0,0,2]=4 6368 B14R2.7969 OC(=O)c1cc2c(F)cccc2o1 Amb18824571 [0,1,0,1,0,0|0,0,2]=4 6369 B14R2.7969 OC(=O)c1cc2c(I)cccc2[s]1 Amb22499529 [0,1,0,1,0,0|0,1,1]=4 6370 B14R2.7969 OC(=O)c1cc2c([nH]1)c(Br)ccc2 Amb2236047 [0,1,0,1,0,0|1,0,1]=4 6371 B14R2.7969 OC(=O)c1cc2c([nH]1)c(C)ccc2 Amb1132816 [0,1,0,1,0,0|1,0,1]=4 6372 B14R2.7969 OC(=O)c1cc2c([nH]1)c(Cl)ccc2 Amb2236135 [0,1,0,1,0,0|1,0,1]=4 6373 B14R2.7969 OC(=O)c1cc2c([nH]1)c(F)ccc2 Amb1136408 [0,1,0,1,0,0|1,0,1]=4 6374 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2Br Amb1243238 [0,1,0,1,0,0|1,0,1]=4 6375 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2C Amb1227669 [0,1,0,1,0,0|1,0,1]=4 6376 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2Cl Amb1088976 [0,1,0,1,0,0|1,0,1]=4 6377 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2F Amb1675280 [0,1,0,1,0,0|1,0,1]=4 6378 B14R2.7969 OC(=O)c1cc2c([nH]1)cccc2O Amb10879707 [0,1,0,1,0,0|1,0,1]=4 6379 B14R2.7969 OC(=O)c1cc2c(o1)c(N)ccc2 Amb17606143 [0,1,0,1,0,0|0,0,2]=4 6380 B14R2.7969 OC(=O)c1cc2c(o1)c(O)ccc2 Amb13881925 [0,1,0,1,0,0|0,0,2]=4 6381 B14R2.7969 OC(=O)c1cc2cccc(Br)c2[s]1 Amb19894989 [0,1,0,1,0,0|0,1,1]=4 6382 B14R2.7969 OC(=O)c1cc2cccc(I)c2[s]1 Amb25304312 [0,1,0,1,0,0|0,1,1]=4 6383 B14R2.7969 OC(=O)c1nc2c([nH]1)cccc2C Amb10603797 [0,1,0,1,0,0|2,0,0]=4 6384 B14R2.7969 OC(=O)c1nc2c(s1)c(Br)ccc2 Amb10603901 [0,1,0,1,0,0|1,1,0]=4 6385 B14R2.7969 OC(=O)c1sc2c(c1)c(F)ccc2 Amb1215726 [0,1,0,1,0,0|0,1,1]=4 6386 B14R2.7969 Oc1cccc2CC(Cc12)C(O)=O Amb22233765 [0,1,0,1,0,0|1,0,1]=4 6387 B14R2.7969 Oc1cccc2CC(Nc12)C(O)=O Amb25858200 [0,1,0,1,0,0|1,0,1]=4 6388 B14R2.7969 Oc1cccc2CC(Oc12)C(O)=O Amb23555615 [0,1,0,1,0,0|0,0,2]=4 6389 B14R2.7969 Oc1cccc2C[C@@H](Nc12)C(O)=O Amb24641425 [0,1,0,1,0,0|1,0,1]=4 6390 B14R2.7969 Oc1cccc2NC(Cc12)C(O)=O Amb25210916 [0,1,0,1,0,0|1,0,1]=4 6391 B14R2.7969 Oc1cccc2OC(Cc12)C(O)=O Amb25697111 [0,1,0,1,0,0|0,0,2]=4 6392 B14R2.7969 Oc1cccc2[n]c([nH]c12)C(O)=O Amb24078497 [0,1,0,1,0,0|2,0,0]=4 6393 B14R2.7969 Oc1cccc2[n]c([s]c12)C(O)=O Amb24726068 [0,1,0,1,0,0|1,1,0]=4 6394 B14R2.7969 Oc1cccc2[s]c([n]c12)C(O)=O Amb24648802 [0,1,0,1,0,0|1,1,0]=4 6395 B14R2.7969 Oc1cccc2[s]c(cc12)C(O)=O Amb24392528 [0,1,0,1,0,0|0,1,1]=4 6396 B14R2.7969 Oc1cccc2cc([s]c12)C(O)=O Amb18130068 [0,1,0,1,0,0|0,1,1]=4 6397 B14R2.7969 Oc1cccc2oc([n]c12)C(O)=O Amb25195144 [0,1,0,1,0,0|1,0,1]=4 6398 B14R2.28472 CC1=Cc2cccc(O)c2OC1=O Amb24424876 [0,1,0,1,0,0|1,0,1]=4 6399 B14R2.28472 CC1Cc2cccc(O)c2OC1=O Amb24378495 [0,1,0,1,0,0|1,0,1]=4 6400 B14R2.28472 Cc1[n]c2c(O)cccc2oc1=O Amb24071451 [0,1,0,1,0,0|2,0,0]=4 6401 B14R2.28472 Cc1cccc2C=C(O)C(=O)Nc21 Amb22752607 [0,1,0,1,0,0|2,0,0]=4 6402 B14R2.28472 Cc1cccc2NC(=O)C(O)=Cc21 Amb22752608 [0,1,0,1,0,0|2,0,0]=4 6403 B14R2.28472 Cc1cccc2OC(=O)C(=O)Nc21 Amb25816131 [0,1,0,1,0,0|1,0,0]=3 6404 B14R2.28472 NC1=Cc2cccc(N)c2OC1=O Amb25138617 [0,1,0,1,0,0|1,0,1]=4 6405 B14R2.28472 NC1=Cc2cccc(O)c2OC1=O Amb18127813 [0,1,0,1,0,0|1,0,1]=4 6406 B14R2.28472 Nc1cccc2C=C(O)C(=O)Oc21 Amb25274061 [0,1,0,1,0,0|0,0,2]=4 6407 B14R2.28472 Nc1cccc2NC(=O)C(=O)Nc21 Amb19813318 [0,1,0,1,0,0|2,0,0]=4 6408 B14R2.28472 Nc1cccc2NC(=O)C(O)=Cc21 Amb25123362 [0,1,0,1,0,0|2,0,0]=4 6409 B14R2.28472 OC1=Cc2c(Cl)cccc2NC1=O Amb24435883 [0,1,0,1,0,0|2,0,0]=4 6410 B14R2.28472 OC1=Cc2c(cccc2O)OC1=O Amb25190281 [0,1,0,1,0,0|0,0,2]=4 6411 B14R2.28472 OC1=Cc2cccc(Br)c2NC1=O Amb25800197 [0,1,0,1,0,0|2,0,0]=4 6412 B14R2.28472 OC1=Cc2cccc(F)c2NC1=O Amb24697603 [0,1,0,1,0,0|2,0,0]=4 6413 B14R2.28472 Oc1cccc2NC(=O)C(=O)Nc21 Amb22234954 [0,1,0,1,0,0|2,0,0]=4 6414 B14R2.450 CC(=C1Cc2c(C1=O)cccc2)C Amb1014344 [0,1,0,1,0,0|2,0,0]=4 6415 B14R2.450 CC(=O)C1Cc2ccccc2C1=O Amb18803911 [0,1,0,1,0,0|1,0,1]=4 6416 B14R2.450 CC(=O)N1Cc2ccccc2C1=O Amb24069499 [0,1,0,1,0,0|2,0,0]=4 6417 B14R2.450 CC1C(Cc2ccccc21)C(O)=O Amb18127727 [0,1,0,1,0,0|1,0,1]=4 6418 B14R2.450 CC1C(Sc2ccccc21)C(O)=O Amb25331829 [0,1,0,1,0,0|0,1,1]=4 6419 B14R2.450 C[C@@H]1[C@H](Cc2ccccc21)C(O)=O Amb24655063 [0,1,0,1,0,0|1,0,1]=4 6420 B14R2.450 NC(=O)C1Cc2ccccc2C1=O Amb25111277 [0,1,0,1,0,0|1,0,1]=4 6421 B14R2.450 NC(=O)N1Cc2ccccc2C1=O Amb25085883 [0,1,0,1,0,0|2,0,0]=4 6422 B14R2.450 NC1C(Cc2ccccc21)C(O)=O Amb22230227 [0,1,0,1,0,0|1,0,1]=4 6423 B14R2.450 N[C@H]1[C@@H](Cc2ccccc21)C(O)=O Amb25260069 [0,1,0,1,0,0|1,0,1]=4 6424 B14R2.450 N[C@H]1[C@H](Cc2ccccc21)C(O)=O Amb24519859 [0,1,0,1,0,0|1,0,1]=4 6425 B14R2.450 Nc1c([nH]c2ccccc21)C(O)=O Amb18127614 [0,1,0,1,0,0|1,0,1]=4 6426 B14R2.450 Nc1c(oc2ccccc21)C(O)=O Amb18118466 [0,1,0,1,0,0|0,0,2]=4 6427 B14R2.450 O=C1c2ccccc2CN1C(=O)Cl Amb25828634 [0,1,0,1,0,0|2,0,0]=4 6428 B14R2.450 OC(=O)C1Nc2c(C1=O)cccc2 Amb17594502 [0,1,0,1,0,0|1,0,1]=4 6429 B14R2.450 OC(=O)C1Nc2ccccc2C1S Amb24495084 [0,1,0,1,0,0|1,0,1]=4 6430 B14R2.450 OC(=O)C1Oc2ccccc2S1=O Amb25779265 [0,1,0,1,0,0|1,0,1]=4 6431 B14R2.450 OC(=O)C1Sc2ccccc2C1=O Amb18130070 [0,1,0,1,0,0|1,0,1]=4 6432 B14R2.450 OC(=O)[C@@H]1Cc2c([C@@H]1N)cccc2 Amb1993730 [0,1,0,1,0,0|1,0,1]=4 6433 B14R2.450 OC(=O)[C@@H]1Cc2c([C@@H]1N)cccc2 Amb1993769 [0,1,0,1,0,0|1,0,1]=4 6434 B14R2.450 OC(=O)[C@@H]1Oc2ccccc2S1=O Amb25288144 [0,1,0,1,0,0|1,0,1]=4 6435 B14R2.450 OC(=O)c1[nH]c2c(c1Br)cccc2 Amb1200063 [0,1,0,1,0,0|1,0,1]=4 6436 B14R2.450 OC(=O)c1[nH]c2ccccc2c1F Amb19894479 [0,1,0,1,0,0|1,0,1]=4 6437 B14R2.450 OC(=O)c1[nH]c2ccccc2c1S Amb18130014 [0,1,0,1,0,0|1,0,1]=4 6438 B14R2.450 OC(=O)c1[s]c2ccccc2c1Br Amb20672009 [0,1,0,1,0,0|0,1,1]=4 6439 B14R2.450 OC(=O)c1[s]c2ccccc2c1I Amb22751342 [0,1,0,1,0,0|0,1,1]=4 6440 B14R2.450 OC(=O)c1[s]c2ccccc2c1S Amb18131197 [0,1,0,1,0,0|0,1,1]=4 6441 B14R2.450 OC(=O)c1[se]c2c(c1Br)cccc2 Amb1147928 [0,1,0,1,0,0|0,1,1]=4 6442 B14R2.450 OC(=O)c1cc2c(n1C)cccc2 Amb1832457 [0,1,0,1,0,0|1,0,1]=4 6443 B14R2.450 OC(=O)c1oc2ccccc2c1Br Amb18136322 [0,1,0,1,0,0|0,0,2]=4 6444 B14R2.450 OC(=O)c1oc2ccccc2c1Cl Amb18188662 [0,1,0,1,0,0|0,0,2]=4 6445 B14R2.450 OC(=O)c1sc2c(c1C)cccc2 Amb1219874 [0,1,0,1,0,0|0,1,1]=4 6446 B14R2.450 OC(=O)c1sc2c(c1O)cccc2 Amb16230697 [0,1,0,1,0,0|0,1,1]=4 6447 B14R2.450 OC(O)=C1Nc2ccccc2C1=O Amb25704859 [0,1,0,1,0,0|1,0,1]=4 6448 B14R2.450 Oc1c2ccccc2oc1C(O)=O Amb25820192 [0,1,0,1,0,0|0,0,2]=4 6449 B14R2.657 CC1=CC(C)(C1=O)c2ccccc2 Amb25112606 [0,1,0,1,0,0|2,0,0]=4 6450 B14R2.780 OC(=O)C1CSC1c2ccccc2 Amb24624933 [0,1,0,1,0,0|0,1,1]=4 6451 B14R2.780 OC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24550645 [0,1,0,1,0,0|1,0,1]=4 6452 B14R2.780 OC(=O)[C@@H]1CC[C@H]1c2ccccc2 Amb24622779 [0,1,0,1,0,0|1,0,1]=4 6453 B14R2.780 OC(=O)[C@@H]1NC[C@H]1c2ccccc2 Amb24552426 [0,1,0,1,0,0|1,0,1]=4 6454 B14R2.780 OC(=O)[C@H]1NC[C@@H]1c2ccccc2 Amb24550614 [0,1,0,1,0,0|1,0,1]=4 6455 B14R2.9520 C[C@@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25176089 [0,1,0,1,0,0|1,0,1]=4 6456 B14R2.9520 C[C@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25366533 [0,1,0,1,0,0|1,0,1]=4 6457 B14R2.9520 OC(=O)C1OC1(C)c2ccccc2 Amb17594529 [0,1,0,1,0,0|0,0,2]=4 6458 B14R2.9520 OC(=O)[C@@H]1C[C@@]1(F)c2ccccc2 Amb25213297 [0,1,0,1,0,0|1,0,1]=4 6459 B14R2.9520 OC(=O)[C@@H]1C[C@]1(F)c2ccccc2 Amb24538835 [0,1,0,1,0,0|1,0,1]=4 6460 B14R2.789 CC1(Cc2ccccc2N1)C(O)=O Amb24443112 [0,1,0,1,0,0|1,0,1]=4 6461 B14R2.789 CC1(Cc2ccccc2O1)C(O)=O Amb18128109 [0,1,0,1,0,0|0,0,2]=4 6462 B14R2.789 OC(=O)C1(C)Cc2c(C1)cccc2 Amb10843969 [0,1,0,1,0,0|1,0,1]=4 6463 B14R2.789 OC(=O)C1(O)Cc2ccccc2C1 Amb18944711 [0,1,0,1,0,0|0,0,2]=4 6464 B14R2.5443 Cc1ccccc1C2OC2C(O)=O Amb19929989 [0,1,0,1,0,0|0,0,2]=4 6465 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(O)=O Amb25367196 [0,1,0,1,0,0|1,0,1]=4 6466 B14R2.5443 OC(=O)C1CC1c2ccccc2Cl Amb17073010 [0,1,0,1,0,0|1,0,1]=4 6467 B14R2.5443 OC(=O)C1CC1c2ccccc2F Amb17073011 [0,1,0,1,0,0|1,0,1]=4 6468 B14R2.5443 OC(=O)C1OC1c2ccccc2Br Amb19929978 [0,1,0,1,0,0|0,0,2]=4 6469 B14R2.5443 OC(=O)C1OC1c2ccccc2Cl Amb19929980 [0,1,0,1,0,0|0,0,2]=4 6470 B14R2.5443 OC(=O)C1OC1c2ccccc2F Amb19929983 [0,1,0,1,0,0|0,0,2]=4 6471 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2C Amb16233255 [0,1,0,1,0,0|1,0,1]=4 6472 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24571313 [0,1,0,1,0,0|1,0,1]=4 6473 B14R2.5443 Oc1ccccc1C2CC2C(O)=O Amb24455728 [0,1,0,1,0,0|1,0,1]=4 6474 B14R2.788 OC(=O)C1(CC1)Cc2ccccc2 Amb17335122 [0,1,0,1,0,0|1,0,1]=4 6475 B14R2.788 OC(=O)[C@]1(Cc2ccccc2)CO1 Amb25100998 [0,1,0,1,0,0|0,0,2]=4 6476 B10R1.15 BrCC(=O)c1ccccc1 Amb1102084 [1,0,0,0,1,0|1,0,1]=4 6477 B10R1.15 C#CC(=O)c1ccccc1 Amb1088846 [1,0,0,0,1,0|1,0,1]=4 6478 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [1,0,0,0,1,0|2,0,0]=4 6479 B10R1.15 C=CC(=O)c1cc[n]cc1 Amb24482055 [1,0,0,0,1,0|2,0,0]=4 6480 B10R1.15 C=CC(=O)c1ccc[n]c1 Amb25776729 [1,0,0,0,1,0|2,0,0]=4 6481 B10R1.15 C=CC(=O)c1ccccc1 Amb18062256 [1,0,0,0,1,0|1,0,0]=3 6482 B10R1.15 C=CS(=O)c1ccccc1 Amb15692858 [1,0,0,0,1,0|2,0,0]=4 6483 B10R1.15 C=C[S@@](=O)c1ccccc1 Amb22747463 [1,0,0,0,1,0|2,0,0]=4 6484 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [1,0,0,0,1,0|2,0,0]=4 6485 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [1,0,0,0,1,0|2,0,0]=4 6486 B10R1.15 CNC(=O)c1ccccc1 Amb1793916 [1,0,0,0,1,0|2,0,0]=4 6487 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [1,0,0,0,1,0|2,0,0]=4 6488 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [1,0,0,0,1,0|1,0,1]=4 6489 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [1,0,0,0,1,0|1,0,1]=4 6490 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [1,0,0,0,1,0|2,0,0]=4 6491 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [1,0,0,0,1,0|2,0,0]=4 6492 B10R1.15 C\C(=C\O)\c1cc[n]cc1 Amb24661195 [1,0,0,0,1,0|2,0,0]=4 6493 B10R1.15 C\C(=C\O)\c1cccc[n]1 Amb24100288 [1,0,0,0,1,0|2,0,0]=4 6494 B10R1.15 Cl\C(=C\Cl)\c1ccccc1 Amb25849275 [1,0,0,0,1,0|2,0,0]=4 6495 B10R1.15 FCC(=O)c1ccccc1 Amb10603600 [1,0,0,0,1,0|1,0,1]=4 6496 B10R1.15 F\C(=C/Cl)\c1ccccc1 Amb24589902 [1,0,0,0,1,0|2,0,0]=4 6497 B10R1.15 F\C(=C\F)\c1ccccc1 Amb25762778 [1,0,0,0,1,0|2,0,0]=4 6498 B10R1.15 NC(=S=O)c1ccccc1 Amb24406743 [1,0,0,0,1,0|2,0,0]=4 6499 B10R1.15 NCC(=O)c1ccccc1 Amb1073498 [1,0,0,0,1,0|1,0,1]=4 6500 B10R1.15 NNC(=O)c1ccccc1 Amb1208583 [1,0,0,0,1,0|2,0,0]=4 6501 B10R1.15 NOC(=O)c1ccccc1 Amb22054026 [1,0,0,0,1,0|2,0,0]=4 6502 B10R1.15 N\C(=C\N)\c1ccccc1 Amb25147590 [1,0,0,0,1,0|2,0,0]=4 6503 B10R1.15 N\C(=C\O)\c1ccccc1 Amb25675946 [1,0,0,0,1,0|1,0,0]=3 6504 B10R1.15 O/C=C(\O)c1ccccc1 Amb17943089 [1,0,0,0,1,0|0,0,1]=3 6505 B10R1.15 O/N=C(/O)c1ccccc1 Amb17843421 [1,0,0,0,1,0|1,0,1]=4 6506 B10R1.15 O=C(C=O)c1c[n]cc[n]1 Amb25169317 [1,0,0,0,1,0|2,0,0]=4 6507 B10R1.15 O=C(C=O)c1c[n]ccc1 Amb18642978 [1,0,0,0,1,0|1,0,0]=3 6508 B10R1.15 O=C(C=O)c1cccc[n]1 Amb25066902 [1,0,0,0,1,0|1,0,0]=3 6509 B10R1.15 O=C(CI)c1ccccc1 Amb23579972 [1,0,0,0,1,0|1,0,1]=4 6510 B10R1.15 O=C(N=O)c1ccccc1 Amb24096802 [1,0,0,0,1,0|1,0,0]=3 6511 B10R1.15 O=C(NCl)c1ccccc1 Amb25277317 [1,0,0,0,1,0|2,0,0]=4 6512 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [1,0,0,0,1,0|1,0,0]=3 6513 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [1,0,0,0,1,0|1,0,1]=4 6514 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [1,0,0,0,1,0|1,0,1]=4 6515 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [1,0,0,0,1,0|1,0,1]=4 6516 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [1,0,0,0,1,0|0,0,2]=4 6517 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [1,0,0,0,1,0|1,0,1]=4 6518 B10R1.15 OCC(=O)c1cc[n]cc1 Amb18063686 [1,0,0,0,1,0|1,0,1]=4 6519 B10R1.15 OCC(=O)c1ccc[n]c1 Amb18063681 [1,0,0,0,1,0|1,0,1]=4 6520 B10R1.15 OCC(=O)c1cccc[n]1 Amb18063640 [1,0,0,0,1,0|1,0,1]=4 6521 B10R1.15 ON(C=O)c1ccccc1 Amb25027443 [1,0,0,0,1,0|1,0,1]=4 6522 B10R1.15 ONC(=N)c1ccccc1 Amb17231893 [1,0,0,0,1,0|2,0,0]=4 6523 B10R1.15 ONC(=O)c1ccccc1 Amb1645521 [1,0,0,0,1,0|1,0,0]=3 6524 B10R1.15 OOC(=O)c1cc[n]cc1 Amb24066209 [1,0,0,0,1,0|2,0,0]=4 6525 B10R1.15 OOC(=O)c1ccc[n]c1 Amb24094187 [1,0,0,0,1,0|2,0,0]=4 6526 B10R1.15 OOC(=O)c1ccccc1 Amb17672281 [1,0,0,0,1,0|1,0,0]=3 6527 B10R1.15 O\C(=C/Cl)\c1ccccc1 Amb24068872 [1,0,0,0,1,0|1,0,1]=4 6528 B10R1.15 O\C(=C/F)\c1ccccc1 Amb24068873 [1,0,0,0,1,0|1,0,1]=4 6529 B10R1.15 O\C(=C\F)\c1ccccc1 Amb25094625 [1,0,0,0,1,0|1,0,1]=4 6530 B10R1.15 O\C=C(\Cl)/c1ccccc1 Amb25332181 [1,0,0,0,1,0|1,0,0]=3 6531 B10R1.15 O\N=C(/c1ccccc1)\N Amb2226909 [1,0,0,0,1,0|2,0,0]=4 6532 B10R1.15 O\N=C(\c1ccccc1)/C Amb2387477 [1,0,0,0,1,0|2,0,0]=4 6533 B10R1.15 O\N=C(\c1ccccc1)/Cl Amb10563288 [1,0,0,0,1,0|2,0,0]=4 6534 B10R1.15 O\N=C(\c1ccccc1)/N Amb1149046 [1,0,0,0,1,0|2,0,0]=4 6535 B10R1.15 SCC(=O)c1ccccc1 Amb16192503 [1,0,0,0,1,0|0,1,1]=4 6536 B10R1.15 [2H]\C(=C\[2H])\c1ccccc1 Amb22353430 [1,0,0,0,1,0|2,0,0]=4 6537 B10R1.15 [O-]NC(=O)c1ccccc1 Amb18800075 [1,0,0,0,1,0|1,0,1]=4 6538 B10R1.15 [O-]NC(=O)c1ccccc1 Amb22527267 [1,0,0,0,1,0|1,0,1]=4 6539 B10R1.27 C=CC(=O)Cc1cc[s]c1 Amb24745076 [1,0,0,0,1,0|2,0,0]=4 6540 B10R1.27 O=C(C=O)Nc1ccc[s]1 Amb25137097 [1,0,0,0,1,0|2,0,0]=4 6541 B10R1.27 OCC(=O)Cc1c[s]cc1 Amb25096464 [1,0,0,0,1,0|1,0,1]=4 6542 B10R1.27 OCC(=O)Cc1ccc[s]1 Amb24636460 [1,0,0,0,1,0|1,0,1]=4 6543 B10R1.27 ONC(=O)Cc1ccco1 Amb25050997 [1,0,0,0,1,0|2,0,0]=4 6544 B10R1.66 OC(=O)C=Cc1ccc[s]1 Amb24076486 [1,0,0,0,1,0|1,0,1]=4 6545 B10R1.66 OC(=O)CCC=1CC=CC1 Amb25264551 [1,0,0,0,1,0|0,0,2]=4 6546 B10R1.66 OC(=O)CCc1cc[nH]c1 Amb18562783 [1,0,0,0,1,0|1,0,1]=4 6547 B10R1.66 OC(=O)CCc1ccc[nH]1 Amb10602142 [1,0,0,0,1,0|1,0,1]=4 6548 B10R1.66 OC(=O)CCc1ccco1 Amb1153073 [1,0,0,0,1,0|1,0,1]=4 6549 B10R1.66 OC(=O)CCc1cccs1 Amb1154297 [1,0,0,0,1,0|1,0,1]=4 6550 B10R1.66 OC(=O)CCc1ccoc1 Amb18643489 [1,0,0,0,1,0|1,0,1]=4 6551 B10R1.66 OC(=O)CCc1cscc1 Amb1153814 [1,0,0,0,1,0|1,0,1]=4 6552 B10R1.66 OC(=O)CCn1cccc1 Amb1130611 [1,0,0,0,1,0|1,0,1]=4 6553 B10R1.66 OC(=O)\C=C/c1cscc1 Amb10071559 [1,0,0,0,1,0|1,0,1]=4 6554 B10R1.66 OC(=O)\C=C\[n]1cccc1 Amb18643139 [1,0,0,0,1,0|1,0,1]=4 6555 B10R1.66 OC(=O)\C=C\c1cc[nH]c1 Amb18643122 [1,0,0,0,1,0|1,0,1]=4 6556 B10R1.66 OC(=O)\C=C\c1ccc[nH]1 Amb18643136 [1,0,0,0,1,0|1,0,1]=4 6557 B10R1.66 OC(=O)\C=C\c1cscc1 Amb1154295 [1,0,0,0,1,0|1,0,1]=4 6558 B10R1.23 C=C(C(O)=O)c1cc[nH]c1 Amb18561328 [0,0,0,0,2,0|2,0,0]=4 6559 B10R1.23 C=C(C(O)=O)c1ccc[nH]1 Amb24502435 [0,0,0,0,2,0|2,0,0]=4 6560 B10R1.23 CC(=O)C(=O)c1c[nH]cc1 Amb18561513 [0,0,0,0,2,0|2,0,0]=4 6561 B10R1.23 CC(=O)C(=O)c1cccs1 Amb17399955 [0,0,0,0,2,0|2,0,0]=4 6562 B10R1.23 NC(=O)C(=O)c1ccc[nH]1 Amb24505162 [0,0,0,0,2,0|2,0,0]=4 6563 B10R1.23 O=C(c1c[nH]cc1)C(=O)Cl Amb24610655 [0,0,0,0,2,0|2,0,0]=4 6564 B10R1.23 O=C(c1ccc[s]1)C(=O)Cl Amb24608452 [0,0,0,0,2,0|2,0,0]=4 6565 B10R1.23 OC(=O)C(=C)c1cccs1 Amb17322162 [0,0,0,0,2,0|2,0,0]=4 6566 B10R1.23 OC(=O)C(=O)C1C=CC=C1 Amb25781759 [0,0,0,0,2,0|0,0,1]=3 6567 B10R1.23 OC(=O)C(=O)[n]1c[n]cc1 Amb20414325 [0,0,0,0,2,0|2,0,0]=4 6568 B10R1.23 OC(=O)C(=O)c1c[nH]cn1 Amb1907155 [0,0,0,0,2,0|2,0,0]=4 6569 B10R1.23 OC(=O)C(=O)c1c[n][s]c1 Amb18644892 [0,0,0,0,2,0|2,0,0]=4 6570 B10R1.23 OC(=O)C(=O)c1c[n]c[s]1 Amb18830659 [0,0,0,0,2,0|2,0,0]=4 6571 B10R1.23 OC(=O)C(=O)c1c[s]c[n]1 Amb18644891 [0,0,0,0,2,0|2,0,0]=4 6572 B10R1.23 OC(=O)C(=O)c1c[s]cc1 Amb18644784 [0,0,0,0,2,0|1,0,0]=3 6573 B10R1.23 OC(=O)C(=O)c1cc[n][s]1 Amb25765831 [0,0,0,0,2,0|2,0,0]=4 6574 B10R1.23 OC(=O)C(=O)c1ccc[nH]1 Amb17593524 [0,0,0,0,2,0|1,0,0]=3 6575 B12R1.1748 C=CC(=O)CC1C=CC=CC=C1 Amb25270988 [1,0,0,0,0,1|1,0,1]=4 6576 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [1,0,0,0,0,1|1,0,1]=4 6577 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [1,0,0,0,0,1|2,0,0]=4 6578 B12R1.252 CC(=O)NOCc1ccccc1 Amb10571914 [1,0,0,0,0,1|2,0,0]=4 6579 B12R1.252 CC(=O)O[Hg]Cc1ccccc1 Amb22347638 [1,0,0,0,0,1|2,0,0]=4 6580 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [1,0,0,0,0,1|1,0,1]=4 6581 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb10565265 [1,0,0,0,0,1|1,0,1]=4 6582 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb25735703 [1,0,0,0,0,1|1,0,1]=4 6583 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [1,0,0,0,0,1|1,0,0]=3 6584 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [1,0,0,0,0,1|1,0,1]=4 6585 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb25179665 [1,0,0,0,0,1|1,0,1]=4 6586 B12R1.252 CC(=O)\C=N/Nc1ccccc1 Amb11012875 [1,0,0,0,0,1|2,0,0]=4 6587 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [1,0,0,0,0,1|2,0,0]=4 6588 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [1,0,0,0,0,1|2,0,0]=4 6589 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [1,0,0,0,0,1|1,0,1]=4 6590 B12R1.252 ClC(Cl)=CCNc1ccccc1 Amb25160645 [1,0,0,0,0,1|2,0,0]=4 6591 B12R1.252 NC(=O)C\C=C\c1ccccc1 Amb24470049 [1,0,0,0,0,1|1,0,1]=4 6592 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [1,0,0,0,0,1|1,0,1]=4 6593 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [1,0,0,0,0,1|2,0,0]=4 6594 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [1,0,0,0,0,1|2,0,0]=4 6595 B12R1.252 NC(=O)N\C=C\c1ccccc1 Amb25362141 [1,0,0,0,0,1|1,0,1]=4 6596 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [1,0,0,0,0,1|1,0,0]=3 6597 B12R1.252 NC(=O)\C=N\Nc1ccccc1 Amb25241203 [1,0,0,0,0,1|2,0,0]=4 6598 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [1,0,0,0,0,1|1,0,1]=4 6599 B12R1.252 O=C(Cl)C\C=C\c1ccccc1 Amb25269722 [1,0,0,0,0,1|1,0,1]=4 6600 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [1,0,0,0,0,1|1,0,1]=4 6601 B12R1.252 OB(O)\C=C\Cc1ccccc1 Amb21856558 [1,0,0,0,0,1|1,0,1]=4 6602 B12R1.252 OC(=O)C#CCc1c[n]ccc1 Amb24684542 [1,0,0,0,0,1|1,0,1]=4 6603 B12R1.252 OC(=O)C#CCc1cc[n]cc1 Amb25299055 [1,0,0,0,0,1|1,0,1]=4 6604 B12R1.252 OC(=O)C#CCc1cccc[n]1 Amb25700659 [1,0,0,0,0,1|1,0,1]=4 6605 B12R1.252 OC(=O)C#COc1ccccc1 Amb24634223 [1,0,0,0,0,1|0,0,2]=4 6606 B12R1.252 OC(=O)C=C=Cc1ccccc1 Amb25102534 [1,0,0,0,0,1|0,0,1]=3 6607 B12R1.252 OC(=O)CC#Cc1ccccc1 Amb18296382 [1,0,0,0,0,1|0,0,2]=4 6608 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [1,0,0,0,0,1|0,0,1]=3 6609 B12R1.252 OC(=O)CCCc1cc[n]cc1 Amb19929548 [1,0,0,0,0,1|1,0,1]=4 6610 B12R1.252 OC(=O)CCCc1cccc[n]1 Amb19356883 [1,0,0,0,0,1|1,0,1]=4 6611 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [1,0,0,0,0,1|0,0,1]=3 6612 B12R1.252 OC(=O)CCCc1ccccn1 Amb1099328 [1,0,0,0,0,1|1,0,1]=4 6613 B12R1.252 OC(=O)CCCc1cccnc1 Amb17232526 [1,0,0,0,0,1|1,0,1]=4 6614 B12R1.252 OC(=O)CCCc1ccncc1 Amb1099336 [1,0,0,0,0,1|1,0,1]=4 6615 B12R1.252 OC(=O)CCNc1ccc[n]c1 Amb18269696 [1,0,0,0,0,1|1,0,1]=4 6616 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [1,0,0,0,0,1|0,0,1]=3 6617 B12R1.252 OC(=O)CCNc1ccccn1 Amb10609119 [1,0,0,0,0,1|1,0,1]=4 6618 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [1,0,0,0,0,1|0,0,1]=3 6619 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [1,0,0,0,0,1|0,0,1]=3 6620 B12R1.252 OC(=O)CCSc1ccccn1 Amb1133894 [1,0,0,0,0,1|1,0,1]=4 6621 B12R1.252 OC(=O)CNCc1ccccn1 Amb1111426 [1,0,0,0,0,1|1,0,1]=4 6622 B12R1.252 OC(=O)CNCc1ccccn1 Amb13951702 [1,0,0,0,0,1|1,0,1]=4 6623 B12R1.252 OC(=O)CNCc1cccnc1 Amb1111197 [1,0,0,0,0,1|1,0,1]=4 6624 B12R1.252 OC(=O)CNCc1ccncc1 Amb1110916 [1,0,0,0,0,1|1,0,1]=4 6625 B12R1.252 OC(=O)CNNc1ccccc1 Amb25258415 [1,0,0,0,0,1|1,0,1]=4 6626 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [1,0,0,0,0,1|1,0,1]=4 6627 B12R1.252 OC(=O)CSCc1ccccn1 Amb1126746 [1,0,0,0,0,1|1,0,1]=4 6628 B12R1.252 OC(=O)CSCc1cccnc1 Amb1129471 [1,0,0,0,0,1|1,0,1]=4 6629 B12R1.252 OC(=O)CSCc1ccncc1 Amb1134758 [1,0,0,0,0,1|1,0,1]=4 6630 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [1,0,0,0,0,1|0,0,1]=3 6631 B12R1.252 OC(=O)C\C=C\c1cc[n]cc1 Amb24571194 [1,0,0,0,0,1|1,0,1]=4 6632 B12R1.252 OC(=O)C\C=C\c1cccc[n]1 Amb25073201 [1,0,0,0,0,1|1,0,1]=4 6633 B12R1.252 OC(=O)C\N=C\c1ccccc1 Amb24627161 [1,0,0,0,0,1|0,0,2]=4 6634 B12R1.252 OC(=O)\C=C\Cc1ccc[n]c1 Amb25849857 [1,0,0,0,0,1|1,0,0]=3 6635 B12R1.252 OC(=O)\C=C\Cc1cccc[n]1 Amb25696841 [1,0,0,0,0,1|1,0,0]=3 6636 B12R1.252 OC(=O)\C=C\Nc1ccccc1 Amb25315667 [1,0,0,0,0,1|0,0,1]=3 6637 B12R1.252 OC(=O)\C=C\Oc1ccccc1 Amb18645970 [1,0,0,0,0,1|0,0,1]=3 6638 B12R1.252 OC(=O)\C=C\Sc1cc[n]cc1 Amb25856304 [1,0,0,0,0,1|1,0,1]=4 6639 B12R1.252 OC(=O)\C=C\Sc1ccccc1 Amb1661597 [1,0,0,0,0,1|0,0,1]=3 6640 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [1,0,0,0,0,1|0,0,0]=2 6641 B12R1.252 OC(=O)\C=N/Nc1ccccc1 Amb24068313 [1,0,0,0,0,1|1,0,0]=3 6642 B12R1.252 OC(=O)\C=N\Nc1cccc[n]1 Amb24100362 [1,0,0,0,0,1|2,0,0]=4 6643 B12R1.252 OC(=O)\C=N\Nc1ccccc1 Amb17594064 [1,0,0,0,0,1|1,0,0]=3 6644 B12R1.252 [O-]C(=O)/C=C/Sc1ccccc1 Amb17913132 [1,0,0,0,0,1|0,0,2]=4 6645 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [1,0,0,0,0,1|0,0,2]=4 6646 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [1,0,0,0,0,1|0,0,2]=4 6647 B12R1.260 NC(=O)NC(=O)C[n]1cccc1 Amb25111702 [0,0,0,0,1,1|2,0,0]=4 6648 B12R1.260 NC(=O)NC(=O)Cc1c[s]cc1 Amb24593462 [0,0,0,0,1,1|2,0,0]=4 6649 B12R1.260 NC(=O)NC(=O)Cc1ccc[s]1 Amb24666122 [0,0,0,0,1,1|2,0,0]=4 6650 B12R1.260 OC(=O)CC(=O)Nc1c[s]cc1 Amb25704555 [0,0,0,0,1,1|2,0,0]=4 6651 B14R1.423 CC(=O)COC(=O)Cc1ccccc1 Amb24084925 [0,0,0,0,0,2|1,0,0]=3 6652 B14R1.423 CC(=O)O\N=C(/N)\Cc1ccccc1 Amb23247777 [0,0,0,0,0,2|2,0,0]=4 6653 B14R1.423 CC(Cc1ccccc1)=NNC(N)=O Amb17777806 [0,0,0,0,0,2|2,0,0]=4 6654 B14R1.423 CN(Cc1ccccc1)CCC(=O)O Amb15740934 [0,0,0,0,0,2|2,0,0]=4 6655 B14R1.423 CN(Cc1ccccc1)\C=C\C(O)=O Amb24591316 [0,0,0,0,0,2|2,0,0]=4 6656 B14R1.423 NC(=O)NN=C(O)Cc1ccccc1 Amb17777871 [0,0,0,0,0,2|1,0,1]=4 6657 B14R1.423 NC(=O)ONC(=O)Nc1ccccc1 Amb25360830 [0,0,0,0,0,2|2,0,0]=4 6658 B14R1.423 NC(Cc1ccccc1)C#CC(O)=O Amb25124720 [0,0,0,0,0,2|1,0,1]=4 6659 B14R1.423 N[C@@H](Cc1ccccc1)C#CC(O)=O Amb25858142 [0,0,0,0,0,2|1,0,1]=4 6660 B14R1.423 N[C@@H](Cc1ccccc1)CCC(O)=O Amb22754385 [0,0,0,0,0,2|1,0,1]=4 6661 B14R1.423 N\C(=N/c1ccccc1)\SCC(=O)O Amb17595657 [0,0,0,0,0,2|2,0,0]=4 6662 B14R1.423 O=C(Cc1ccccc1)CC=C(C)C Amb17594894 [0,0,0,0,0,2|2,0,0]=4 6663 B14R1.423 O=C(Cc1ccccc1)NCC(=O)O Amb1218287 [0,0,0,0,0,2|0,0,0]=2 6664 B14R1.423 O=C(Cc1ccccc1)NNC([S-])=S Amb22471703 [0,0,0,0,0,2|0,2,0]=4 6665 B14R1.423 O=C(Nc1ccccc1)CCC(=O)Cl Amb17143518 [0,0,0,0,0,2|2,0,0]=4 6666 B14R1.423 O=C(Nc1ccccc1)CCC(=O)N Amb17143108 [0,0,0,0,0,2|2,0,0]=4 6667 B14R1.423 O=C(Nc1ccccc1)COC(=O)C Amb1210678 [0,0,0,0,0,2|2,0,0]=4 6668 B14R1.423 O=C(Nc1ccccc1)CSC(=O)N Amb1813477 [0,0,0,0,0,2|2,0,0]=4 6669 B14R1.423 O=C(Nc1ccccc1)NCC(=O)O Amb1196555 [0,0,0,0,0,2|1,0,0]=3 6670 B14R1.423 O=C(Nc1ccccc1)\C=C/C(=O)O Amb2459372 [0,0,0,0,0,2|1,0,0]=3 6671 B14R1.423 O=C(Nc1ccccc1)\C=C\C(=O)N Amb1234972 [0,0,0,0,0,2|2,0,0]=4 6672 B14R1.423 O=C(Nc1ccccc1)\C=C\C(=O)O Amb1227856 [0,0,0,0,0,2|1,0,0]=3 6673 B14R1.423 O=C(Nc1cccnc1)CCC(=O)O Amb1787562 [0,0,0,0,0,2|2,0,0]=4 6674 B14R1.423 O=C(\C=C\C(=O)Cl)Nc1ccccc1 Amb25221072 [0,0,0,0,0,2|2,0,0]=4 6675 B14R1.423 OC(=O)CCC(=S)Nc1ccccc1 Amb25216156 [0,0,0,0,0,2|1,1,0]=4 6676 B14R1.423 OC(=O)CNC(=O)Sc1ccccc1 Amb24065204 [0,0,0,0,0,2|1,0,0]=3 6677 B14R1.423 OC(=O)COC(=S)Nc1ccccc1 Amb25081370 [0,0,0,0,0,2|1,1,0]=4 6678 B14R1.423 OC(=O)CSC(=S)Cc1ccccc1 Amb23483000 [0,0,0,0,0,2|0,1,0]=3 6679 B14R1.423 S=C(Nc1ccccc1)NCC(=O)O Amb2436445 [0,0,0,0,0,2|1,1,0]=4 6680 B14R1.818 CC(=CC(C)=O)NCc1ccccc1 Amb24079060 [0,0,0,0,0,2|2,0,0]=4 6681 B14R1.818 CC(=N)NC(=O)OCc1ccccc1 Amb24410079 [0,0,0,0,0,2|2,0,0]=4 6682 B14R1.818 CC(=O)CC(=O)\C=C\c1ccccc1 Amb17594879 [0,0,0,0,0,2|1,0,1]=4 6683 B14R1.818 CC(=O)CC(=S)NCc1ccccc1 Amb24451576 [0,0,0,0,0,2|1,1,0]=4 6684 B14R1.818 CC(=O)NC(=C)CCc1ccccc1 Amb24741052 [0,0,0,0,0,2|2,0,0]=4 6685 B14R1.818 CC(=O)NC(=N)NCc1ccccc1 Amb25351673 [0,0,0,0,0,2|2,0,0]=4 6686 B14R1.818 CC(=O)NC(=O)CNc1ccccc1 Amb25814083 [0,0,0,0,0,2|1,0,0]=3 6687 B14R1.818 CC(=O)NC(=O)OCc1ccccc1 Amb24506532 [0,0,0,0,0,2|1,0,0]=3 6688 B14R1.818 CC(=O)NC(=O)SCc1ccccc1 Amb24639120 [0,0,0,0,0,2|1,0,0]=3 6689 B14R1.818 CC(=O)[CH-]C(=O)C=Cc1ccccc1 Amb22486320 [0,0,0,0,0,2|1,0,1]=4 6690 B14R1.818 CC(=O)[CH-]C(=O)NCc1ccccc1 Amb22445976 [0,0,0,0,0,2|1,0,0]=3 6691 B14R1.818 CC(C)=CC(=O)OCc1ccccc1 Amb25181986 [0,0,0,0,0,2|2,0,0]=4 6692 B14R1.818 CC(O)CC(=O)OCc1ccccc1 Amb25683507 [0,0,0,0,0,2|1,0,1]=4 6693 B14R1.818 C[C@@H](CC(O)=O)NCc1ccccc1 Amb25124067 [0,0,0,0,0,2|1,0,1]=4 6694 B14R1.818 C[C@@H](CC(O)=O)OCc1ccccc1 Amb24335959 [0,0,0,0,0,2|1,0,1]=4 6695 B14R1.818 C[C@@H](O)CC(=O)NCc1ccccc1 Amb24659273 [0,0,0,0,0,2|1,0,1]=4 6696 B14R1.818 C[C@H](O)CC(=O)NCc1ccccc1 Amb24410941 [0,0,0,0,0,2|1,0,1]=4 6697 B14R1.818 C[C@H](O)CC(=O)OCc1ccccc1 Amb24473364 [0,0,0,0,0,2|1,0,1]=4 6698 B14R1.818 C\C(=C/C(=O)O)\COc1ccccc1 Amb17235343 [0,0,0,0,0,2|1,0,0]=3 6699 B14R1.818 C\C(=C/C(O)=O)\C#Cc1ccccc1 Amb24426223 [0,0,0,0,0,2|1,0,1]=4 6700 B14R1.818 C\C(=C\C(N)=O)\NCc1ccccc1 Amb25179140 [0,0,0,0,0,2|2,0,0]=4 6701 B14R1.818 C\C(\CCc1ccccc1)=C\C(O)=O Amb22095783 [0,0,0,0,0,2|1,0,0]=3 6702 B14R1.818 C\C(\CNc1ccccc1)=C\C(O)=O Amb24405272 [0,0,0,0,0,2|1,0,0]=3 6703 B14R1.818 C\C(\N)=C\C(=O)OCc1ccccc1 Amb22224951 [0,0,0,0,0,2|2,0,0]=4 6704 B14R1.818 C\C(\O)=C\C(=S)NCc1ccccc1 Amb24619096 [0,0,0,0,0,2|1,1,0]=4 6705 B14R1.818 N=C(CC(O)=O)NCc1ccccc1 Amb24366621 [0,0,0,0,0,2|1,0,0]=3 6706 B14R1.818 NC(=N)CC(=O)NCc1ccccc1 Amb22913288 [0,0,0,0,0,2|2,0,0]=4 6707 B14R1.818 NC(=N)NC(=O)NCc1ccccc1 Amb24418755 [0,0,0,0,0,2|2,0,0]=4 6708 B14R1.818 NC(=N)NC(=O)OCc1ccccc1 Amb22167137 [0,0,0,0,0,2|2,0,0]=4 6709 B14R1.818 NC(=O)CC(=N)NCc1ccccc1 Amb24392315 [0,0,0,0,0,2|2,0,0]=4 6710 B14R1.818 NC(=O)CC(=O)NCc1ccccc1 Amb24433950 [0,0,0,0,0,2|1,0,0]=3 6711 B14R1.818 NC(=O)NC(=O)CCc1ccccc1 Amb24335936 [0,0,0,0,0,2|1,0,0]=3 6712 B14R1.818 NC(=O)NC(=O)COc1ccccc1 Amb22446938 [0,0,0,0,0,2|1,0,0]=3 6713 B14R1.818 NC(=O)NC(=O)NCc1ccccc1 Amb24710299 [0,0,0,0,0,2|1,0,0]=3 6714 B14R1.818 NC(=O)NC(=O)\C=C\c1ccccc1 Amb25291849 [0,0,0,0,0,2|1,0,1]=4 6715 B14R1.818 NC(=O)NC(=O)\N=C\c1ccccc1 Amb24519165 [0,0,0,0,0,2|1,0,1]=4 6716 B14R1.818 NC(=O)NC(=S)NCc1ccccc1 Amb25309579 [0,0,0,0,0,2|1,1,0]=4 6717 B14R1.818 NC(=S)CC(=O)OCc1ccccc1 Amb25114010 [0,0,0,0,0,2|1,1,0]=4 6718 B14R1.818 NC(CC(=O)O)CCc1ccccc1 Amb1993736 [0,0,0,0,0,2|1,0,1]=4 6719 B14R1.818 NC(N)=NC(=O)CNc1ccccc1 Amb24758858 [0,0,0,0,0,2|2,0,0]=4 6720 B14R1.818 N[C@@H](CCc1ccccc1)CC(O)=O Amb19887670 [0,0,0,0,0,2|1,0,1]=4 6721 B14R1.818 N[C@@H](CCc1ccccc1)CC(O)=O Amb22746249 [0,0,0,0,0,2|1,0,1]=4 6722 B14R1.818 N[C@H](CCc1ccccc1)CC(O)=O Amb19888418 [0,0,0,0,0,2|1,0,1]=4 6723 B14R1.818 O=C(C=C(C)C)NCc1ccccc1 Amb2573638 [0,0,0,0,0,2|2,0,0]=4 6724 B14R1.818 O=C(CC(=O)C)NCc1ccccc1 Amb1034892 [0,0,0,0,0,2|1,0,0]=3 6725 B14R1.818 O=C(CC(=O)Cl)NCc1ccccc1 Amb24347370 [0,0,0,0,0,2|1,0,0]=3 6726 B14R1.818 O=C(CC(=O)Cl)OCc1ccccc1 Amb25123154 [0,0,0,0,0,2|1,0,0]=3 6727 B14R1.818 O=C(CC(=O)O)CCc1ccccc1 Amb17235338 [0,0,0,0,0,2|0,0,0]=2 6728 B14R1.818 O=C(CC(=O)O)NCc1ccccc1 Amb17401704 [0,0,0,0,0,2|0,0,0]=2 6729 B14R1.818 O=C(CC(=O)O)NCc1ccccn1 Amb17401842 [0,0,0,0,0,2|1,0,0]=3 6730 B14R1.818 O=C(CC(=O)O)NCc1cccnc1 Amb17401843 [0,0,0,0,0,2|1,0,0]=3 6731 B14R1.818 O=C(CC(=O)O)NCc1ccncc1 Amb17401844 [0,0,0,0,0,2|1,0,0]=3 6732 B14R1.818 O=C(CC(=S)N)NCc1ccccc1 Amb1208405 [0,0,0,0,0,2|1,1,0]=4 6733 B14R1.818 O=C(NC(=O)C)CSc1ccccn1 Amb2231041 [0,0,0,0,0,2|2,0,0]=4 6734 B14R1.818 O=C(NC(=O)N)CSc1ccccc1 Amb2270478 [0,0,0,0,0,2|1,0,0]=3 6735 B14R1.818 OC(=O)CC(=O)NNc1cc[n]cc1 Amb24387517 [0,0,0,0,0,2|2,0,0]=4 6736 B14R1.818 OC(=O)\C=C(\Cl)/C=C/c1ccccc1 Amb24452241 [0,0,0,0,0,2|1,0,1]=4 6737 B14R1.818 OC(=O)\C=C(\Cl)/C=Cc1ccccc1 Amb25195875 [0,0,0,0,0,2|1,0,1]=4 6738 B14R1.818 OC(C=Cc1ccccc1)=CC(O)=O Amb22451276 [0,0,0,0,0,2|0,0,2]=4 6739 B14R1.818 OC(CC(=O)O)CCc1ccccc1 Amb17235897 [0,0,0,0,0,2|0,0,2]=4 6740 B14R1.818 OS(=O)CC(=O)OCc1ccccc1 Amb25374475 [0,0,0,0,0,2|1,0,0]=3 6741 B14R1.818 S=C(NC(=O)C)NCc1ccccc1 Amb2054418 [0,0,0,0,0,2|1,1,0]=4 6742 B14R1.6449 CC(=C)C(=O)NOCc1ccccc1 Amb24104638 [0,0,0,0,0,2|2,0,0]=4 6743 B14R1.6449 CC(=C)C(=O)OCCc1ccccc1 Amb17934134 [0,0,0,0,0,2|2,0,0]=4 6744 B14R1.6449 CC(=O)C(=O)CNCc1ccccc1 Amb25103178 [0,0,0,0,0,2|1,0,0]=3 6745 B14R1.6449 CC(=O)C(=O)NCCc1ccccc1 Amb17401500 [0,0,0,0,0,2|1,0,0]=3 6746 B14R1.6449 CC(=O)\C(\O)=C\NCc1ccccc1 Amb24758955 [0,0,0,0,0,2|1,0,1]=4 6747 B14R1.6449 CC(C(=O)O)CCOc1ccccc1 Amb17235913 [0,0,0,0,0,2|1,0,1]=4 6748 B14R1.6449 CC(CC#Cc1ccccc1)C(O)=O Amb24687303 [0,0,0,0,0,2|1,0,1]=4 6749 B14R1.6449 CC(CNCc1ccccc1)C(O)=O Amb20623866 [0,0,0,0,0,2|1,0,1]=4 6750 B14R1.6449 CC(NNCc1ccccc1)C(O)=O Amb25360955 [0,0,0,0,0,2|1,0,1]=4 6751 B14R1.6449 CC(NOCc1ccccc1)C(O)=O Amb18652109 [0,0,0,0,0,2|1,0,1]=4 6752 B14R1.6449 CC(O)C(=O)COCc1ccccc1 Amb25787287 [0,0,0,0,0,2|1,0,1]=4 6753 B14R1.6449 CC(O)C(=O)NOCc1ccccc1 Amb25846208 [0,0,0,0,0,2|1,0,1]=4 6754 B14R1.6449 CN(O)C(=O)CNCc1ccccc1 Amb25672401 [0,0,0,0,0,2|2,0,0]=4 6755 B14R1.6449 C[C@@H](C(=O)O)COCc1ccccc1 Amb10844261 [0,0,0,0,0,2|1,0,1]=4 6756 B14R1.6449 C[C@H](C(=O)O)COCc1ccccc1 Amb10844264 [0,0,0,0,0,2|1,0,1]=4 6757 B14R1.6449 C\C(=C\C=Cc1ccccc1)\C(O)=O Amb25214478 [0,0,0,0,0,2|1,0,1]=4 6758 B14R1.6449 C\C(=C\NCc1ccccc1)\C(C)=O Amb25672607 [0,0,0,0,0,2|2,0,0]=4 6759 B14R1.6449 C\C(=N/NCc1ccccc1)\C(O)=O Amb18651177 [0,0,0,0,0,2|1,0,0]=3 6760 B14R1.6449 C\C(=N\OCc1ccccc1)\C(O)=O Amb23512428 [0,0,0,0,0,2|1,0,0]=3 6761 B14R1.6449 NC(=O)C(=O)NCCc1cccc[n]1 Amb21953015 [0,0,0,0,0,2|2,0,0]=4 6762 B14R1.6449 NC(CC#Cc1ccccc1)C(O)=O Amb19020422 [0,0,0,0,0,2|1,0,1]=4 6763 B14R1.6449 NC(CCCc1ccccc1)C(O)=O Amb19342362 [0,0,0,0,0,2|1,0,1]=4 6764 B14R1.6449 N[C@@H](CCCc1ccccc1)C(O)=O Amb20241024 [0,0,0,0,0,2|1,0,1]=4 6765 B14R1.6449 N[C@@H](C\C=C\c1ccccc1)C(O)=O Amb22746168 [0,0,0,0,0,2|1,0,1]=4 6766 B14R1.6449 N[C@H](CC#Cc1ccccc1)C(O)=O Amb24535741 [0,0,0,0,0,2|1,0,1]=4 6767 B14R1.6449 N[C@H](COCc1ccccc1)C(O)=O Amb19944297 [0,0,0,0,0,2|1,0,1]=4 6768 B14R1.6449 O=C(C(O)C)NCCc1ccccc1 Amb17401758 [0,0,0,0,0,2|1,0,1]=4 6769 B14R1.6449 OC(=O)C(Br)COCc1ccccc1 Amb18668071 [0,0,0,0,0,2|1,0,1]=4 6770 B14R1.6449 OC(=O)C(Cl)COCc1ccccc1 Amb25734789 [0,0,0,0,0,2|1,0,1]=4 6771 B14R1.6449 OC(=O)C(F)=C\C=C\c1ccccc1 Amb24740676 [0,0,0,0,0,2|1,0,1]=4 6772 B14R1.6449 OC(=O)C(S)=C\C=C\c1ccccc1 Amb24536275 [0,0,0,0,0,2|0,1,1]=4 6773 B14R1.6449 OC(=O)[C@@H](Cl)COCc1ccccc1 Amb25752794 [0,0,0,0,0,2|1,0,1]=4 6774 B14R1.6449 OC(=O)[C@@H](O)CNCc1ccccc1 Amb24650939 [0,0,0,0,0,2|0,0,2]=4 6775 B14R1.6449 OC(=O)[C@@H](O)COCc1ccccc1 Amb25088415 [0,0,0,0,0,2|0,0,2]=4 6776 B14R1.6449 OC(=O)[C@@H](S)CNCc1ccccc1 Amb25381284 [0,0,0,0,0,2|0,1,1]=4 6777 B14R1.6449 OC(=O)[C@H](Cl)COCc1ccccc1 Amb25309625 [0,0,0,0,0,2|1,0,1]=4 6778 B14R1.6449 OC(=O)[C@H](O)COCc1ccccc1 Amb24428781 [0,0,0,0,0,2|0,0,2]=4 6779 B14R1.6449 OC(=O)\C(=C/C=C/c1ccccc1)\S Amb2480105 [0,0,0,0,0,2|0,1,1]=4 6780 B14R1.6449 OC(=O)\C(=C\C=C\c1ccccc1)\S Amb1218848 [0,0,0,0,0,2|0,1,1]=4 6781 B14R1.6449 OC(=O)\C(\F)=C\C=Cc1ccccc1 Amb24700151 [0,0,0,0,0,2|1,0,1]=4 6782 B14R1.6449 OC(=O)\C(\S)=C\C=Cc1ccccc1 Amb24603162 [0,0,0,0,0,2|0,1,1]=4 6783 B14R1.6449 [O-]C(=O)\C(\Cl)=N\OCc1ccccc1 Amb24711726 [0,0,0,0,0,2|1,0,1]=4 6784 B14R1.10072 N[C@@H](CC=1C=CC=CC=CC1)C(O)=O Amb24563813 [0,0,0,0,0,2|1,0,1]=4