0 B12R1.107 BrC(c1ccccc1)CN(C)C Amb10563751 [0,0,0,0,0,0|4,0,0]=4 1 B12R1.107 Br\C(=C/C(=O)O)\c1ccccc1 Amb10069265 [0,0,0,0,0,0|3,0,1]=4 2 B12R1.107 C=C(CC(N)=O)c1ccccc1 Amb25798918 [0,0,0,0,0,0|2,0,2]=4 3 B12R1.107 C=C(CC(O)=O)c1ccccc1 Amb18645643 [0,0,0,0,0,0|2,0,2]=4 4 B12R1.107 C=C(Cl)CC(O)c1ccccc1 Amb25359026 [0,0,0,0,0,0|3,0,1]=4 5 B12R1.107 C=C(Cl)C[C@H](O)c1ccccc1 Amb25362960 [0,0,0,0,0,0|3,0,1]=4 6 B12R1.107 C=C(F)CC(O)c1ccccc1 Amb25158203 [0,0,0,0,0,0|3,0,1]=4 7 B12R1.107 C=C(NC(N)=O)c1ccccc1 Amb25258325 [0,0,0,0,0,0|2,0,2]=4 8 B12R1.107 CC(=C)CC(=O)c1ccccc1 Amb18563490 [0,0,0,0,0,0|3,0,1]=4 9 B12R1.107 CC(=C)CC(N)c1ccccc1 Amb24423888 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.107 CC(=C)CC(O)c1cc[n]cc1 Amb24439149 [0,0,0,0,0,0|4,0,0]=4 11 B12R1.107 CC(=C)CC(O)c1ccc[n]c1 Amb25083900 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.107 CC(=C)CC(O)c1cccc[n]1 Amb25675378 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.107 CC(=C)CN(C)c1cc[n]cc1 Amb24459023 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.107 CC(=C)CN(C)c1cccc[n]1 Amb24619418 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.107 CC(=C)C[C@@H](N)c1ccc[n]c1 Amb24612157 [0,0,0,0,0,0|4,0,0]=4 16 B12R1.107 CC(=C)C[C@H](N)c1cccc[n]1 Amb24629000 [0,0,0,0,0,0|4,0,0]=4 17 B12R1.107 CC(=C)C[C@H](N)c1ccccc1 Amb25124122 [0,0,0,0,0,0|3,0,0]=3 18 B12R1.107 CC(=C)C[C@H](O)c1ccccc1 Amb24497632 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.107 CC(=C)NC(=O)c1ccccc1 Amb24096681 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.107 CC(=C)OC(=O)c1cccc[n]1 Amb24643969 [0,0,0,0,0,0|3,0,1]=4 21 B12R1.107 CC(=N)NC(C)c1c[n]ccc1 Amb25054353 [0,0,0,0,0,0|3,0,0]=3 22 B12R1.107 CC(=N)NC(C)c1cc[n]cc1 Amb25242908 [0,0,0,0,0,0|3,0,0]=3 23 B12R1.107 CC(=N)NC(C)c1cccc[n]1 Amb25799324 [0,0,0,0,0,0|3,0,0]=3 24 B12R1.107 CC(=NN(C)C)c1ccccc1 Amb22230212 [0,0,0,0,0,0|3,0,1]=4 25 B12R1.107 CC(=O)CC(C)c1c[n]ccc1 Amb24691286 [0,0,0,0,0,0|2,0,0]=2 26 B12R1.107 CC(=O)CC(C)c1cc[n]c[n]1 Amb24580545 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.107 CC(=O)CC(C)c1cccc[n]1 Amb24370168 [0,0,0,0,0,0|2,0,0]=2 28 B12R1.107 CC(=O)CC(c1ccccn1)O Amb1016907 [0,0,0,0,0,0|3,0,0]=3 29 B12R1.107 CC(=O)C[C@@H](O)c1cccc[n]1 Amb25319984 [0,0,0,0,0,0|3,0,0]=3 30 B12R1.107 CC(=O)C[C@H](C)c1c[n]ccc1 Amb25714386 [0,0,0,0,0,0|2,0,0]=2 31 B12R1.107 CC(=O)NC(=O)c1c[n]ccc1 Amb25756189 [0,0,0,0,0,0|3,0,1]=4 32 B12R1.107 CC(=O)NC(=O)c1cccc[n]1 Amb25040960 [0,0,0,0,0,0|3,0,1]=4 33 B12R1.107 CC(=O)NC(=O)c1ccccc1 Amb24073560 [0,0,0,0,0,0|2,0,1]=3 34 B12R1.107 CC(=O)NC(=S)c1ccccc1 Amb24073591 [0,0,0,0,0,0|2,0,1]=3 35 B12R1.107 CC(=O)NC(C)c1cc[n]cc1 Amb25150955 [0,0,0,0,0,0|2,0,0]=2 36 B12R1.107 CC(=O)NC(C)c1cccc[n]1 Amb25150956 [0,0,0,0,0,0|2,0,0]=2 37 B12R1.107 CC(=O)N[C@@H](C)c1cccc[n]1 Amb25134946 [0,0,0,0,0,0|2,0,0]=2 38 B12R1.107 CC(=O)N[C@H](C)c1cccc[n]1 Amb24659356 [0,0,0,0,0,0|2,0,0]=2 39 B12R1.107 CC(=O)OC(=C)c1ccccc1 Amb22730633 [0,0,0,0,0,0|0,0,2]=2 40 B12R1.107 CC(=O)OC(=O)c1ccccc1 Amb17678790 [0,0,0,0,0,0|1,0,1]=2 41 B12R1.107 CC(=O)OC(C)c1c[n]ccc1 Amb25723772 [0,0,0,0,0,0|1,0,0]=1 42 B12R1.107 CC(=O)O[C@@H](C)c1c[n]cc[n]1 Amb24676447 [0,0,0,0,0,0|2,0,0]=2 43 B12R1.107 CC(=O)O[C@@H](C)c1ccccc1 Amb25144207 [0,0,0,0,0,0|0,0,0]=0 44 B12R1.107 CC(=O)O[C@H](C)c1c[n]cc[n]1 Amb24473985 [0,0,0,0,0,0|2,0,0]=2 45 B12R1.107 CC(=O)O[C@H](C)c1ccccc1 Amb25160190 [0,0,0,0,0,0|0,0,0]=0 46 B12R1.107 CC(=O)\C=C(/O)\c1cccc[n]1 Amb24309430 [0,0,0,0,0,0|3,0,1]=4 47 B12R1.107 CC(=O)\C=C(/S)\c1ccccc1 Amb25730212 [0,0,0,0,0,0|2,0,1]=3 48 B12R1.107 CC(=O)\C=C(\N)/c1cc[n]cc1 Amb25059228 [0,0,0,0,0,0|3,0,1]=4 49 B12R1.107 CC(=O)\C=C(\N)/c1ccccc1 Amb25309296 [0,0,0,0,0,0|2,0,1]=3 50 B12R1.107 CC(=O)\N=C(\N)/c1ccccc1 Amb25150972 [0,0,0,0,0,0|2,0,1]=3 51 B12R1.107 CC(=S)NC(=O)c1ccccc1 Amb24640397 [0,0,0,0,0,0|2,1,1]=4 52 B12R1.107 CC(=S)N[C@@H](C)c1ccccc1 Amb24532689 [0,0,0,0,0,0|1,1,0]=2 53 B12R1.107 CC(C)=CC(N)c1c[n]ccc1 Amb25150099 [0,0,0,0,0,0|4,0,0]=4 54 B12R1.107 CC(C)=CC(N)c1cccc[n]1 Amb25693522 [0,0,0,0,0,0|4,0,0]=4 55 B12R1.107 CC(C)=CC(N)c1ccccc1 Amb24355884 [0,0,0,0,0,0|3,0,0]=3 56 B12R1.107 CC(C)=CC(O)c1c[n]ccc1 Amb25068076 [0,0,0,0,0,0|4,0,0]=4 57 B12R1.107 CC(C)=CC(O)c1cccc[n]1 Amb25836013 [0,0,0,0,0,0|4,0,0]=4 58 B12R1.107 CC(C)=NC(=O)c1ccccc1 Amb24096687 [0,0,0,0,0,0|3,0,1]=4 59 B12R1.107 CC(C)C[C@@H](Cl)c1ccccc1 Amb25667428 [0,0,0,0,0,0|3,0,1]=4 60 B12R1.107 CC(C)C[C@@H](N)c1ccccc1 Amb22288660 [0,0,0,0,0,0|3,0,1]=4 61 B12R1.107 CC(C)C[C@@H](O)c1ccccc1 Amb25816173 [0,0,0,0,0,0|3,0,1]=4 62 B12R1.107 CC(C)C[C@H](N)c1ccccc1 Amb22288705 [0,0,0,0,0,0|3,0,1]=4 63 B12R1.107 CC(C)C[C@H](O)c1ccccc1 Amb24344678 [0,0,0,0,0,0|3,0,1]=4 64 B12R1.107 CC(C)NC(C)c1cccc[n]1 Amb22274350 [0,0,0,0,0,0|3,0,1]=4 65 B12R1.107 CC(C)N[C@@H](C)c1c[n]ccc1 Amb24739309 [0,0,0,0,0,0|3,0,1]=4 66 B12R1.107 CC(C)N[C@@H](C)c1cc[n]cc1 Amb25282212 [0,0,0,0,0,0|3,0,1]=4 67 B12R1.107 CC(C)N[C@@H](C)c1cccc[n]1 Amb25234954 [0,0,0,0,0,0|3,0,1]=4 68 B12R1.107 CC(C)N[C@@H](C)c1ccccc1 Amb22747560 [0,0,0,0,0,0|2,0,1]=3 69 B12R1.107 CC(C)N[C@H](C)c1c[n]ccc1 Amb25830845 [0,0,0,0,0,0|3,0,1]=4 70 B12R1.107 CC(C)OC(O)c1cccc[n]1 Amb24496382 [0,0,0,0,0,0|3,0,1]=4 71 B12R1.107 CC(C)OP(=O)c1ccccc1 Amb25042914 [0,0,0,0,0,0|3,0,1]=4 72 B12R1.107 CC(C)SC(C)c1c[n]ccc1 Amb25788724 [0,0,0,0,0,0|2,1,1]=4 73 B12R1.107 CC(C)SC(C)c1ccccc1 Amb24371858 [0,0,0,0,0,0|1,1,1]=3 74 B12R1.107 CC(C)[NH2+][C@@H](C)c1ccccc1 Amb22049556 [0,0,0,0,0,0|2,0,1]=3 75 B12R1.107 CC(CB(O)O)c1ccccc1 Amb24725059 [0,0,0,0,0,0|3,0,1]=4 76 B12R1.107 CC(CC(C)Br)c1ccccc1 Amb25273655 [0,0,0,0,0,0|2,0,1]=3 77 B12R1.107 CC(CC(C)O)c1c[n]ccc1 Amb25278209 [0,0,0,0,0,0|2,0,2]=4 78 B12R1.107 CC(CC(N)=O)c1cc[n]cc1 Amb25724402 [0,0,0,0,0,0|3,0,0]=3 79 B12R1.107 CC(CC(N)=S)c1ccccc1 Amb24583414 [0,0,0,0,0,0|2,1,0]=3 80 B12R1.107 CC(CC(N)N)c1ccccc1 Amb24670721 [0,0,0,0,0,0|3,0,1]=4 81 B12R1.107 CC(CC(O)=O)c1[n]ccc[n]1 Amb25135402 [0,0,0,0,0,0|4,0,0]=4 82 B12R1.107 CC(CC(O)=O)c1c[n]cc[n]1 Amb24487345 [0,0,0,0,0,0|4,0,0]=4 83 B12R1.107 CC(CC(O)=O)c1cc[n]c[n]1 Amb24589784 [0,0,0,0,0,0|4,0,0]=4 84 B12R1.107 CC(CC(O)O)c1ccccc1 Amb25092014 [0,0,0,0,0,0|2,0,2]=4 85 B12R1.107 CC(CN(C)C)c1ccccc1 Amb22491726 [0,0,0,0,0,0|3,0,0]=3 86 B12R1.107 CC(CN(C)C)c1ccccc1 Amb25848155 [0,0,0,0,0,0|3,0,0]=3 87 B12R1.107 CC(CN(C)N)c1ccccc1 Amb24379493 [0,0,0,0,0,0|3,0,0]=3 88 B12R1.107 CC(CN(c1ccccc1)C)C Amb17232437 [0,0,0,0,0,0|3,0,1]=4 89 B12R1.107 CC(CN(c1ccccc1)C)N Amb10610213 [0,0,0,0,0,0|3,0,1]=4 90 B12R1.107 CC(CN(c1ccccc1)C)N Amb1137929 [0,0,0,0,0,0|3,0,1]=4 91 B12R1.107 CC(CN(c1ccccc1)C)O Amb17138595 [0,0,0,0,0,0|2,0,2]=4 92 B12R1.107 CC(CS(C)=O)c1ccccc1 Amb24673234 [0,0,0,0,0,0|2,0,0]=2 93 B12R1.107 CC(CS(O)=O)c1ccccc1 Amb24557264 [0,0,0,0,0,0|3,0,0]=3 94 B12R1.107 CC(CS([O-])=O)c1ccccc1 Amb24385785 [0,0,0,0,0,0|3,0,0]=3 95 B12R1.107 CC(Cl)CN(C)c1ccccc1 Amb24711498 [0,0,0,0,0,0|3,0,1]=4 96 B12R1.107 CC(N)CC(O)c1ccccc1 Amb18646365 [0,0,0,0,0,0|3,0,1]=4 97 B12R1.107 CC(N)C[C@@H](O)c1ccccc1 Amb25719473 [0,0,0,0,0,0|3,0,1]=4 98 B12R1.107 CC(NC(=O)Cl)c1ccccc1 Amb25780625 [0,0,0,0,0,0|2,0,0]=2 99 B12R1.107 CC(NC(N)=N)c1cc[n]cc1 Amb18798328 [0,0,0,0,0,0|4,0,0]=4 100 B12R1.107 CC(NC(N)=N)c1ccc[n]c1 Amb18798329 [0,0,0,0,0,0|4,0,0]=4 101 B12R1.107 CC(NC(N)=N)c1cccc[n]1 Amb18798330 [0,0,0,0,0,0|4,0,0]=4 102 B12R1.107 CC(NC(N)=N)c1ccccc1 Amb22284229 [0,0,0,0,0,0|3,0,0]=3 103 B12R1.107 CC(NN(C)C)c1cc[n]cc1 Amb25156586 [0,0,0,0,0,0|4,0,0]=4 104 B12R1.107 CC(NN(C)C)c1cccc[n]1 Amb24364346 [0,0,0,0,0,0|4,0,0]=4 105 B12R1.107 CC(NN(C)C)c1ccccc1 Amb24608774 [0,0,0,0,0,0|3,0,0]=3 106 B12R1.107 CC(O)CC(N)c1ccccc1 Amb18646382 [0,0,0,0,0,0|2,0,2]=4 107 B12R1.107 CC(O)CC(P)c1ccccc1 Amb25157842 [0,0,0,0,0,0|2,0,2]=4 108 B12R1.107 CC(O)CC(S)c1ccccc1 Amb24525704 [0,0,0,0,0,0|2,0,2]=4 109 B12R1.107 CC(O)C[C@H](O)c1ccccc1 Amb24355251 [0,0,0,0,0,0|2,0,2]=4 110 B12R1.107 CC(OC(=O)c1ccccc1)C Amb15740252 [0,0,0,0,0,0|2,0,2]=4 111 B12R1.107 CC(OC(=O)c1ccccc1)Cl Amb10603969 [0,0,0,0,0,0|2,0,2]=4 112 B12R1.107 CC(OC(C)=O)c1ccccn1 Amb17912737 [0,0,0,0,0,0|1,0,0]=1 113 B12R1.107 CC(OC(C)=O)c1ccncc1 Amb17689315 [0,0,0,0,0,0|1,0,0]=1 114 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22446280 [0,0,0,0,0,0|2,0,2]=4 115 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22446311 [0,0,0,0,0,0|2,0,2]=4 116 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22474103 [0,0,0,0,0,0|2,0,2]=4 117 B12R1.107 CC([O-])=CC(=O)c1ccccc1 Amb22474104 [0,0,0,0,0,0|2,0,2]=4 118 B12R1.107 CC([SiH2]C(Cl)Cl)c1ccccc1 Amb25743475 [0,0,0,0,0,0|3,0,1]=4 119 B12R1.107 CC(c1ccccc1)CC(=O)O Amb1207393 [0,0,0,0,0,0|2,0,0]=2 120 B12R1.107 CC(c1ccccc1)NC(=N)N Amb10669498 [0,0,0,0,0,0|3,0,0]=3 121 B12R1.107 CC(c1ccccc1)NC(=O)N Amb1135151 [0,0,0,0,0,0|2,0,0]=2 122 B12R1.107 CC(c1ccccc1)NC(=S)N Amb1645582 [0,0,0,0,0,0|2,1,0]=3 123 B12R1.107 CN(C)CC(Br)c1ccccc1 Amb25055256 [0,0,0,0,0,0|4,0,0]=4 124 B12R1.107 CN(C)CC(F)c1ccccc1 Amb24623425 [0,0,0,0,0,0|4,0,0]=4 125 B12R1.107 CN(C)CC(N)c1ccccc1 Amb22042488 [0,0,0,0,0,0|4,0,0]=4 126 B12R1.107 CN(C)C[C@@H](N)c1ccccc1 Amb22745082 [0,0,0,0,0,0|4,0,0]=4 127 B12R1.107 CN(C)C[C@@H](O)c1ccccc1 Amb22226504 [0,0,0,0,0,0|4,0,0]=4 128 B12R1.107 CN(C)C[C@H](O)c1ccccc1 Amb24707113 [0,0,0,0,0,0|4,0,0]=4 129 B12R1.107 CN(CC(N)=O)c1cccc[n]1 Amb25686738 [0,0,0,0,0,0|4,0,0]=4 130 B12R1.107 CN(CC(O)=O)c1ccc[n]c1 Amb18268673 [0,0,0,0,0,0|4,0,0]=4 131 B12R1.107 CN(CC(O)=O)c1cccc[n]1 Amb22275945 [0,0,0,0,0,0|4,0,0]=4 132 B12R1.107 CN(NC(N)=O)c1cccc[n]1 Amb25151116 [0,0,0,0,0,0|4,0,0]=4 133 B12R1.107 CN(c1ccccc1)CC(=C)C Amb10571185 [0,0,0,0,0,0|3,0,0]=3 134 B12R1.107 CN(c1ccccc1)CC(=O)Cl Amb17142999 [0,0,0,0,0,0|3,0,0]=3 135 B12R1.107 CN(c1ccccc1)CC(=O)O Amb10610413 [0,0,0,0,0,0|3,0,0]=3 136 B12R1.107 CP(CC(O)=O)c1ccccc1 Amb25108110 [0,0,0,0,0,0|3,0,0]=3 137 B12R1.107 CS(=NC(N)=O)c1ccccc1 Amb24370272 [0,0,0,0,0,0|3,0,0]=3 138 B12R1.107 CS(=O)CC(=O)c1ccccc1 Amb24741512 [0,0,0,0,0,0|3,0,1]=4 139 B12R1.107 CS(=O)CC(N)c1ccccc1 Amb18648795 [0,0,0,0,0,0|3,0,0]=3 140 B12R1.107 CS(=O)CC(O)c1cc[n]cc1 Amb25753341 [0,0,0,0,0,0|4,0,0]=4 141 B12R1.107 CS(=O)CC(O)c1ccccc1 Amb25781686 [0,0,0,0,0,0|3,0,0]=3 142 B12R1.107 CS(=O)C[C@@H](O)c1cc[n]cc1 Amb25333612 [0,0,0,0,0,0|4,0,0]=4 143 B12R1.107 C[C@@H](N)CN(C)c1ccccc1 Amb25058714 [0,0,0,0,0,0|3,0,1]=4 144 B12R1.107 C[C@@H](N)C[C@@H]([O-])c1ccccc1 Amb25825094 [0,0,0,0,0,0|3,0,1]=4 145 B12R1.107 C[C@@H](NC(N)=N)c1cc[n]cc1 Amb24703575 [0,0,0,0,0,0|4,0,0]=4 146 B12R1.107 C[C@@H](NC(N)=O)c1ccccc1 Amb22232053 [0,0,0,0,0,0|2,0,0]=2 147 B12R1.107 C[C@@H](O)CN(C)c1ccccc1 Amb24663849 [0,0,0,0,0,0|2,0,2]=4 148 B12R1.107 C[C@@H](O)C[C@@H](N)c1ccccc1 Amb24634311 [0,0,0,0,0,0|2,0,2]=4 149 B12R1.107 C[C@@H](O)C[C@H](N)c1ccccc1 Amb24711221 [0,0,0,0,0,0|2,0,2]=4 150 B12R1.107 C[C@@H](SC(N)=N)c1ccccc1 Amb25807975 [0,0,0,0,0,0|2,1,0]=3 151 B12R1.107 C[C@@H](c1ccccc1)CC(=O)O Amb10844340 [0,0,0,0,0,0|2,0,0]=2 152 B12R1.107 C[C@H](C[C@H](C)O)c1ccccc1 Amb25741359 [0,0,0,0,0,0|1,0,2]=3 153 B12R1.107 C[C@H](Cl)C[C@@H](Cl)c1ccccc1 Amb25119306 [0,0,0,0,0,0|3,0,1]=4 154 B12R1.107 C[C@H](N)C[C@@H](O)c1ccccc1 Amb25362221 [0,0,0,0,0,0|3,0,1]=4 155 B12R1.107 C[C@H](N)C[C@H]([O-])c1ccccc1 Amb25180739 [0,0,0,0,0,0|3,0,1]=4 156 B12R1.107 C[C@H](NC(N)=N)c1ccc[n]c1 Amb25369645 [0,0,0,0,0,0|4,0,0]=4 157 B12R1.107 C[C@H](NC(N)=O)c1cccc[n]1 Amb24448704 [0,0,0,0,0,0|3,0,0]=3 158 B12R1.107 C[C@H](NC(N)=O)c1ccccc1 Amb22232024 [0,0,0,0,0,0|2,0,0]=2 159 B12R1.107 C[C@H](O)CC(N)c1ccccc1 Amb24608910 [0,0,0,0,0,0|2,0,2]=4 160 B12R1.107 C[C@H](O)CC(O)c1ccccc1 Amb25846972 [0,0,0,0,0,0|2,0,2]=4 161 B12R1.107 C[C@H](O)C[C@@H](N)c1ccccc1 Amb25152440 [0,0,0,0,0,0|2,0,2]=4 162 B12R1.107 C[C@H](O)C[C@@H](O)c1ccccc1 Amb24431811 [0,0,0,0,0,0|2,0,2]=4 163 B12R1.107 C[C@H](O)C[C@H](S)c1ccccc1 Amb24398074 [0,0,0,0,0,0|2,0,2]=4 164 B12R1.107 C[C@H](c1ccccc1)CC(=O)O Amb10844379 [0,0,0,0,0,0|2,0,0]=2 165 B12R1.107 C\C(=C/C(=O)Cl)\c1ccccc1 Amb25195673 [0,0,0,0,0,0|2,0,1]=3 166 B12R1.107 C\C(=C/C(N)=O)\c1ccccc1 Amb24648875 [0,0,0,0,0,0|2,0,1]=3 167 B12R1.107 C\C(=C/[N+]([O-])=O)\c1ccccc1 Amb21858900 [0,0,0,0,0,0|3,0,1]=4 168 B12R1.107 C\C(=C\C(=O)Cl)\c1ccccc1 Amb25220154 [0,0,0,0,0,0|2,0,1]=3 169 B12R1.107 C\C(=C\C(C)=O)\c1c[n]ccc1 Amb25308395 [0,0,0,0,0,0|2,0,1]=3 170 B12R1.107 C\C(=C\C(C)=O)\c1cc[n]cc1 Amb25783222 [0,0,0,0,0,0|2,0,1]=3 171 B12R1.107 C\C(=C\C(C)=O)\c1ccccc1 Amb24367599 [0,0,0,0,0,0|1,0,1]=2 172 B12R1.107 C\C(=C\C(C)O)\c1ccccc1 Amb25823380 [0,0,0,0,0,0|1,0,3]=4 173 B12R1.107 C\C(=C\C(N)=O)\c1ccc[n]c1 Amb25296908 [0,0,0,0,0,0|3,0,1]=4 174 B12R1.107 C\C(=C\C(O)=O)\c1cc[n]cc1 Amb20626499 [0,0,0,0,0,0|3,0,1]=4 175 B12R1.107 C\C(=C\C(O)=O)\c1ccc[n]c1 Amb20626498 [0,0,0,0,0,0|3,0,1]=4 176 B12R1.107 C\C(=C\C(O)=O)\c1cccc[n]1 Amb24393080 [0,0,0,0,0,0|3,0,1]=4 177 B12R1.107 C\C(=C\C(O)=O)\c1ccccc1 Amb24271190 [0,0,0,0,0,0|2,0,1]=3 178 B12R1.107 C\C(=C\N(C)C)\c1ccccc1 Amb25711045 [0,0,0,0,0,0|3,0,1]=4 179 B12R1.107 C\C(=C\[N+]([O-])=O)\c1ccccc1 Amb25338387 [0,0,0,0,0,0|3,0,1]=4 180 B12R1.107 C\C(=N/C(C)C)\c1ccccc1 Amb24053029 [0,0,0,0,0,0|2,0,2]=4 181 B12R1.107 C\C(=N\N(C)C)\c1ccccc1 Amb22347640 [0,0,0,0,0,0|3,0,1]=4 182 B12R1.107 C\C(\Cl)=C\C(Cl)c1ccccc1 Amb25277290 [0,0,0,0,0,0|3,0,0]=3 183 B12R1.107 C\C(\Cl)=C\C(O)c1ccccc1 Amb25681436 [0,0,0,0,0,0|3,0,0]=3 184 B12R1.107 C\C(\F)=C/C(=O)c1ccccc1 Amb24497135 [0,0,0,0,0,0|3,0,1]=4 185 B12R1.107 C\C(\F)=C\C(=O)c1ccccc1 Amb24631194 [0,0,0,0,0,0|3,0,1]=4 186 B12R1.107 C\C(\N)=C\C(=S)c1ccccc1 Amb25264968 [0,0,0,0,0,0|3,0,1]=4 187 B12R1.107 C\C(\N)=N\C(=S)c1ccccc1 Amb25669598 [0,0,0,0,0,0|3,0,1]=4 188 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22043283 [0,0,0,0,0,0|2,0,2]=4 189 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22729931 [0,0,0,0,0,0|2,0,2]=4 190 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22729983 [0,0,0,0,0,0|2,0,2]=4 191 B12R1.107 C\C(\[O-])=C/C(=O)c1ccccc1 Amb22733686 [0,0,0,0,0,0|2,0,2]=4 192 B12R1.107 C\C(\[O-])=C\C(=O)c1ccccc1 Amb22729984 [0,0,0,0,0,0|2,0,2]=4 193 B12R1.107 ClC(c1ccccc1)CN(C)C Amb10563749 [0,0,0,0,0,0|4,0,0]=4 194 B12R1.107 ClC(c1ccccc1)CN(C)C Amb17546791 [0,0,0,0,0,0|4,0,0]=4 195 B12R1.107 Cl\C(=C/C(=O)O)\c1ccccc1 Amb17594707 [0,0,0,0,0,0|3,0,1]=4 196 B12R1.107 NC(=O)CN(N)c1ccccc1 Amb25150990 [0,0,0,0,0,0|4,0,0]=4 197 B12R1.107 NC(=O)C[C@@H](N)c1c[n]ccc1 Amb18792646 [0,0,0,0,0,0|4,0,0]=4 198 B12R1.107 NC(=O)C[C@@H](N)c1ccccc1 Amb18792562 [0,0,0,0,0,0|3,0,0]=3 199 B12R1.107 NC(=O)C[C@@H](O)c1ccccc1 Amb25751170 [0,0,0,0,0,0|3,0,0]=3 200 B12R1.107 NC(=O)C[C@H](N)c1c[n]ccc1 Amb25137393 [0,0,0,0,0,0|4,0,0]=4 201 B12R1.107 NC(=O)C[C@H](N)c1cccc[n]1 Amb25049883 [0,0,0,0,0,0|4,0,0]=4 202 B12R1.107 NC(=O)C[C@H](O)c1ccccc1 Amb25150965 [0,0,0,0,0,0|3,0,0]=3 203 B12R1.107 NC(=O)C[P](=S)c1ccccc1 Amb24375519 [0,0,0,0,0,0|4,0,0]=4 204 B12R1.107 NC(=O)NC(=N)c1ccccc1 Amb25337571 [0,0,0,0,0,0|3,0,1]=4 205 B12R1.107 NC(=O)NC(=S)c1ccccc1 Amb24532795 [0,0,0,0,0,0|3,0,1]=4 206 B12R1.107 NC(=O)\C=C(\O)/c1ccccc1 Amb24580412 [0,0,0,0,0,0|3,0,1]=4 207 B12R1.107 NC(=S)CC(O)c1ccccc1 Amb18805332 [0,0,0,0,0,0|3,1,0]=4 208 B12R1.107 NC(CC(O)=O)c1cccc[n]1 Amb22898991 [0,0,0,0,0,0|4,0,0]=4 209 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609847 [0,0,0,0,0,0|3,0,0]=3 210 B12R1.107 NC(c1ccccc1)CC(=O)N Amb10609952 [0,0,0,0,0,0|3,0,0]=3 211 B12R1.107 NC(c1ccccc1)CC(=O)O Amb1048120 [0,0,0,0,0,0|3,0,0]=3 212 B12R1.107 NC(c1ccccc1)CC(C)C Amb1107536 [0,0,0,0,0,0|3,0,1]=4 213 B12R1.107 NC(c1ccccc1)CN(C)C Amb1218288 [0,0,0,0,0,0|4,0,0]=4 214 B12R1.107 NN(CC(O)=O)c1ccccc1 Amb22757137 [0,0,0,0,0,0|4,0,0]=4 215 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb19929593 [0,0,0,0,0,0|4,0,0]=4 216 B12R1.107 N[C@@H](CC(O)=O)c1cc[n]cc1 Amb20240885 [0,0,0,0,0,0|4,0,0]=4 217 B12R1.107 N[C@@H](CC(O)=O)c1ccc[n]c1 Amb19929600 [0,0,0,0,0,0|4,0,0]=4 218 B12R1.107 N[C@@H](CC(O)=O)c1cccc[n]1 Amb20241102 [0,0,0,0,0,0|4,0,0]=4 219 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb19929602 [0,0,0,0,0,0|4,0,0]=4 220 B12R1.107 N[C@H](CC(O)=O)c1cc[n]cc1 Amb20241136 [0,0,0,0,0,0|4,0,0]=4 221 B12R1.107 N[C@H](CC(O)=O)c1ccc[n]c1 Amb19929601 [0,0,0,0,0,0|4,0,0]=4 222 B12R1.107 N[C@H](CC(O)=O)c1cccc[n]1 Amb20241101 [0,0,0,0,0,0|4,0,0]=4 223 B12R1.107 N\C(=C/C(O)=O)\c1ccccc1 Amb22054873 [0,0,0,0,0,0|3,0,1]=4 224 B12R1.107 N\C(=C\C(O)=O)\c1ccccc1 Amb25274098 [0,0,0,0,0,0|3,0,1]=4 225 B12R1.107 O=C(CC(=O)[Na])c1ccccc1 Amb24364157 [0,0,0,0,0,0|3,0,1]=4 226 B12R1.107 O=C(c1ccccc1)C=C(C)C Amb10874044 [0,0,0,0,0,0|3,0,1]=4 227 B12R1.107 O=C(c1ccccc1)CC(=O)O Amb10576353 [0,0,0,0,0,0|3,0,1]=4 228 B12R1.107 O=C(c1ccccc1)\C=C(/N)\C Amb2386640 [0,0,0,0,0,0|3,0,1]=4 229 B12R1.107 O=C(c1ccccc1)\N=C(/N)\C Amb10553700 [0,0,0,0,0,0|3,0,1]=4 230 B12R1.107 OB(O)OC(O)c1ccccc1 Amb24343472 [0,0,0,0,0,0|3,0,1]=4 231 B12R1.107 OC(=O)CC(Cl)c1cc[n]cc1 Amb18119876 [0,0,0,0,0,0|4,0,0]=4 232 B12R1.107 OC(=O)CC(Cl)c1ccc[n]c1 Amb18119752 [0,0,0,0,0,0|4,0,0]=4 233 B12R1.107 OC(=O)CC(Cl)c1cccc[n]1 Amb18120042 [0,0,0,0,0,0|4,0,0]=4 234 B12R1.107 OC(=O)CC(Cl)c1ccccc1 Amb18120400 [0,0,0,0,0,0|3,0,0]=3 235 B12R1.107 OC(=O)CC(F)c1ccc[n]c1 Amb25823686 [0,0,0,0,0,0|4,0,0]=4 236 B12R1.107 OC(=O)CC(F)c1ccccc1 Amb24554792 [0,0,0,0,0,0|3,0,0]=3 237 B12R1.107 OC(=O)CC(O)c1cc[n]cc1 Amb18563783 [0,0,0,0,0,0|4,0,0]=4 238 B12R1.107 OC(=O)CC(O)c1cccc[n]1 Amb18563782 [0,0,0,0,0,0|4,0,0]=4 239 B12R1.107 OC(=O)CC(S)c1ccccc1 Amb18303085 [0,0,0,0,0,0|3,0,0]=3 240 B12R1.107 OC(=O)CC(c1ccccn1)Br Amb17596297 [0,0,0,0,0,0|4,0,0]=4 241 B12R1.107 OC(=O)CC(c1cccnc1)N Amb1993735 [0,0,0,0,0,0|4,0,0]=4 242 B12R1.107 OC(=O)CS(=O)c1ccccc1 Amb18290924 [0,0,0,0,0,0|4,0,0]=4 243 B12R1.107 OC(=O)\C=C(\F)/c1ccccc1 Amb24426178 [0,0,0,0,0,0|3,0,1]=4 244 B12R1.107 OC(CC(S)=S)c1ccccc1 Amb25145313 [0,0,0,0,0,0|3,1,0]=4 245 B12R1.107 OC(c1ccccc1)CC(C)C Amb1110402 [0,0,0,0,0,0|3,0,1]=4 246 B12R1.107 OC(c1ccccc1)CC(O)C Amb1110547 [0,0,0,0,0,0|2,0,2]=4 247 B12R1.107 OC(c1ccccc1)CN(C)C Amb10563753 [0,0,0,0,0,0|4,0,0]=4 248 B12R1.107 OC(c1ccccc1)CN(C)C Amb17104281 [0,0,0,0,0,0|4,0,0]=4 249 B12R1.107 OC(c1ccccc1)C[N+](=O)[O-] Amb1048142 [0,0,0,0,0,0|4,0,0]=4 250 B12R1.107 O[C@H](OP(O)O)c1ccccc1 Amb24675416 [0,0,0,0,0,0|3,0,1]=4 251 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb22491482 [0,0,0,0,0,0|3,0,1]=4 252 B12R1.107 [O-]C(=O)CC(=O)c1ccccc1 Amb23401058 [0,0,0,0,0,0|3,0,1]=4 253 B12R1.107 [O-][N+](=O)OC(=O)c1ccccc1 Amb17939330 [0,0,0,0,0,0|3,0,1]=4 254 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb1395651 [0,0,0,0,0,0|2,0,1]=3 255 B12R1.107 [OH2+]\C(=C/C(=O)C)\c1ccccc1 Amb2563772 [0,0,0,0,0,0|2,0,1]=3 256 B11R1.16 C=CCC(Br)c1ccccc1 Amb24668989 [1,0,0,0,0,0|2,0,1]=4 257 B11R1.16 C=CCC(N)c1ccccc1 Amb22831520 [1,0,0,0,0,0|2,0,1]=4 258 B11R1.16 C=CCC(O)c1ccccc1 Amb22228007 [1,0,0,0,0,0|2,0,1]=4 259 B11R1.16 C=CCC(c1ccccc1)N Amb17226687 [1,0,0,0,0,0|2,0,1]=4 260 B11R1.16 C=CCC(c1ccccc1)O Amb2389146 [1,0,0,0,0,0|2,0,1]=4 261 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22829899 [1,0,0,0,0,0|2,0,1]=4 262 B11R1.16 C=CC[C@@H](N)c1ccccc1 Amb22831832 [1,0,0,0,0,0|2,0,1]=4 263 B11R1.16 C=CC[C@@H](O)c1ccccc1 Amb24726216 [1,0,0,0,0,0|2,0,1]=4 264 B11R1.16 C=COC(=O)c1ccccc1 Amb10807409 [1,0,0,0,0,0|1,0,2]=4 265 B11R1.16 CC#CC(N)c1ccccc1 Amb25113894 [1,0,0,0,0,0|2,0,1]=4 266 B11R1.16 CC#CC(O)c1ccccc1 Amb25148346 [1,0,0,0,0,0|2,0,1]=4 267 B11R1.16 CC#C[C@@H](O)c1ccccc1 Amb25188578 [1,0,0,0,0,0|2,0,1]=4 268 B11R1.16 CC(=CCC)c1ccccc1 Amb22228912 [1,0,0,0,0,0|1,0,2]=4 269 B11R1.16 CC(CC#C)c1ccccc1 Amb18117214 [1,0,0,0,0,0|1,0,2]=4 270 B11R1.16 CC(CC=C)c1c[n]ccc1 Amb24085283 [1,0,0,0,0,0|2,0,1]=4 271 B11R1.16 CC(CC=C)c1ccccc1 Amb25829403 [1,0,0,0,0,0|1,0,1]=3 272 B11R1.16 CC(CC=O)c1c[n]cc[n]1 Amb24591956 [1,0,0,0,0,0|3,0,0]=4 273 B11R1.16 CC(CC=O)c1c[n]ccc1 Amb18125013 [1,0,0,0,0,0|2,0,0]=3 274 B11R1.16 CC(CC=O)c1cc[n]cc1 Amb25283017 [1,0,0,0,0,0|2,0,0]=3 275 B11R1.16 CC(CCN)c1ccccc1 Amb17991256 [1,0,0,0,0,0|2,0,1]=4 276 B11R1.16 CC(CNN)c1ccccc1 Amb18791463 [1,0,0,0,0,0|3,0,0]=4 277 B11R1.16 CC(C[Zn]Br)c1ccccc1 Amb22897843 [1,0,0,0,0,0|3,0,0]=4 278 B11R1.16 CC(N=[N+]=[N-])c1ccccc1 Amb18632995 [1,0,0,0,0,0|3,0,0]=4 279 B11R1.16 CC(NC=S)c1ccccc1 Amb25191191 [1,0,0,0,0,0|1,1,0]=3 280 B11R1.16 CC(NN=O)c1ccccc1 Amb24392128 [1,0,0,0,0,0|2,0,0]=3 281 B11R1.16 CC(OC=C)c1ccccc1 Amb22522122 [1,0,0,0,0,0|0,0,1]=2 282 B11R1.16 CC(OC=O)c1ccccc1 Amb22735162 [1,0,0,0,0,0|0,0,0]=1 283 B11R1.16 CC(OCO)c1ccccc1 Amb24613529 [1,0,0,0,0,0|0,0,2]=3 284 B11R1.16 CC(SCCl)c1ccccc1 Amb24487902 [1,0,0,0,0,0|1,1,1]=4 285 B11R1.16 CC(\C=C\Cl)c1ccccc1 Amb24710339 [1,0,0,0,0,0|2,0,0]=3 286 B11R1.16 CC(\C=N\N)c1ccccc1 Amb24412748 [1,0,0,0,0,0|3,0,0]=4 287 B11R1.16 CC(c1ccccc1)CC#N Amb17593643 [1,0,0,0,0,0|2,0,1]=4 288 B11R1.16 CC(c1ccccc1)N=C=O Amb2092860 [1,0,0,0,0,0|1,0,1]=3 289 B11R1.16 CC=CC(O)c1ccccc1 Amb22228005 [1,0,0,0,0,0|2,0,0]=3 290 B11R1.16 CCCC(c1ccccc1)[NH3+] Amb10560246 [1,0,0,0,0,0|2,0,1]=4 291 B11R1.16 CCC[C@@H](N)c1ccccc1 Amb22388605 [1,0,0,0,0,0|2,0,1]=4 292 B11R1.16 CCC[C@@H](O)c1ccccc1 Amb22338826 [1,0,0,0,0,0|2,0,1]=4 293 B11R1.16 CCC[C@H](N)c1ccccc1 Amb20241164 [1,0,0,0,0,0|2,0,1]=4 294 B11R1.16 CCC[C@H](N)c1ccccc1 Amb23385315 [1,0,0,0,0,0|2,0,1]=4 295 B11R1.16 CCC[C@H](O)c1ccccc1 Amb22338698 [1,0,0,0,0,0|2,0,1]=4 296 B11R1.16 CCC[C@H](c1ccccc1)N Amb16233791 [1,0,0,0,0,0|2,0,1]=4 297 B11R1.16 CCNC(C)c1cc[n]cc1 Amb19515613 [1,0,0,0,0,0|2,0,1]=4 298 B11R1.16 CCNC(c1ccccc1)C Amb1771733 [1,0,0,0,0,0|1,0,1]=3 299 B11R1.16 CCN[C@H](C)c1c[n]ccc1 Amb25114990 [1,0,0,0,0,0|2,0,1]=4 300 B11R1.16 CCN[C@H](C)c1ccccc1 Amb24363134 [1,0,0,0,0,0|1,0,1]=3 301 B11R1.16 CCOC(=C)c1ccccc1 Amb24495644 [1,0,0,0,0,0|0,0,3]=4 302 B11R1.16 CCOC(=N)c1ccccc1 Amb17666955 [1,0,0,0,0,0|1,0,2]=4 303 B11R1.16 CCOC(=O)c1ccccc1 Amb22367067 [1,0,0,0,0,0|1,0,2]=4 304 B11R1.16 CCOC(=[NH2+])c1ccccc1 Amb22445379 [1,0,0,0,0,0|1,0,2]=4 305 B11R1.16 CCOC(C)c1c[n]ccc1 Amb24085116 [1,0,0,0,0,0|1,0,1]=3 306 B11R1.16 CCOC(C)c1ccccc1 Amb17940188 [1,0,0,0,0,0|0,0,1]=2 307 B11R1.16 CCOC(Cl)c1ccccc1 Amb24419639 [1,0,0,0,0,0|1,0,1]=3 308 B11R1.16 CCOC(O)c1c[n]ccc1 Amb24379956 [1,0,0,0,0,0|2,0,1]=4 309 B11R1.16 CCOC(O)c1cccc[n]1 Amb25057798 [1,0,0,0,0,0|2,0,1]=4 310 B11R1.16 CCOP(=O)c1ccccc1 Amb10601587 [1,0,0,0,0,0|2,0,1]=4 311 B11R1.16 CCSC(C)c1c[n]ccc1 Amb25099407 [1,0,0,0,0,0|1,1,1]=4 312 B11R1.16 CCSC(Cl)c1ccccc1 Amb25109977 [1,0,0,0,0,0|1,1,1]=4 313 B11R1.16 CN(N=C=O)c1ccccc1 Amb25242708 [1,0,0,0,0,0|2,0,1]=4 314 B11R1.16 CN(NC=O)c1ccccc1 Amb17778798 [1,0,0,0,0,0|2,0,0]=3 315 B11R1.16 CN(\N=C\N)c1ccccc1 Amb25840394 [1,0,0,0,0,0|3,0,0]=4 316 B11R1.16 CNCC(Br)c1ccccc1 Amb25224394 [1,0,0,0,0,0|3,0,0]=4 317 B11R1.16 CNCC(C)c1cccc[n]1 Amb18644449 [1,0,0,0,0,0|3,0,0]=4 318 B11R1.16 CNCC(F)c1ccccc1 Amb24710254 [1,0,0,0,0,0|3,0,0]=4 319 B11R1.16 CNCC(N)c1ccccc1 Amb18290185 [1,0,0,0,0,0|3,0,0]=4 320 B11R1.16 CNCC(S)c1ccccc1 Amb25685409 [1,0,0,0,0,0|3,0,0]=4 321 B11R1.16 CNCC(c1ccccc1)C Amb17619365 [1,0,0,0,0,0|2,0,0]=3 322 B11R1.16 CNCC(c1ccccc1)N Amb13883001 [1,0,0,0,0,0|3,0,0]=4 323 B11R1.16 CNC[C@@H](N)c1ccccc1 Amb24487965 [1,0,0,0,0,0|3,0,0]=4 324 B11R1.16 CNC[C@H](C)c1ccccc1 Amb24399611 [1,0,0,0,0,0|2,0,0]=3 325 B11R1.16 CNC[C@H](N)c1ccccc1 Amb25040662 [1,0,0,0,0,0|3,0,0]=4 326 B11R1.16 CNC[C@H](O)c1ccccc1 Amb25674653 [1,0,0,0,0,0|3,0,0]=4 327 B11R1.16 CNNC(Br)c1ccccc1 Amb24643804 [1,0,0,0,0,0|3,0,0]=4 328 B11R1.16 CNOC(=O)c1ccccc1 Amb25240574 [1,0,0,0,0,0|2,0,1]=4 329 B11R1.16 COCC(C)c1ccccc1 Amb24079980 [1,0,0,0,0,0|2,0,0]=3 330 B11R1.16 COCC(Cl)c1ccccc1 Amb24509304 [1,0,0,0,0,0|3,0,0]=4 331 B11R1.16 COCC(O)c1ccccc1 Amb18791504 [1,0,0,0,0,0|3,0,0]=4 332 B11R1.16 COCC(S)c1ccccc1 Amb25698414 [1,0,0,0,0,0|3,0,0]=4 333 B11R1.16 COCC(c1ccccc1)N Amb1134749 [1,0,0,0,0,0|3,0,0]=4 334 B11R1.16 COCC(c1ccccc1)N Amb13952604 [1,0,0,0,0,0|3,0,0]=4 335 B11R1.16 COC[C@@H](O)c1ccccc1 Amb22746575 [1,0,0,0,0,0|3,0,0]=4 336 B11R1.16 COC[C@H](N)c1ccccc1 Amb22737495 [1,0,0,0,0,0|3,0,0]=4 337 B11R1.16 COC[C@H](c1ccccc1)N Amb17061641 [1,0,0,0,0,0|3,0,0]=4 338 B11R1.16 CONC(C)c1cccc[n]1 Amb25793754 [1,0,0,0,0,0|3,0,0]=4 339 B11R1.16 CONC(C)c1ccccc1 Amb22896960 [1,0,0,0,0,0|2,0,0]=3 340 B11R1.16 CO\N=C(\c1ccccc1)/C Amb10572535 [1,0,0,0,0,0|2,0,1]=4 341 B11R1.16 CSCC(C)c1ccccc1 Amb25143821 [1,0,0,0,0,0|2,0,0]=3 342 B11R1.16 CSCC(N)c1ccccc1 Amb18300065 [1,0,0,0,0,0|3,0,0]=4 343 B11R1.16 CSCC(O)c1ccccc1 Amb18793198 [1,0,0,0,0,0|3,0,0]=4 344 B11R1.16 CSC[C@@H](N)c1ccccc1 Amb25368447 [1,0,0,0,0,0|3,0,0]=4 345 B11R1.16 C[C@@H](CCBr)c1ccccc1 Amb24395063 [1,0,0,0,0,0|2,0,1]=4 346 B11R1.16 C[C@@H](N=[N+]=[N-])c1ccccc1 Amb24671324 [1,0,0,0,0,0|3,0,0]=4 347 B11R1.16 C[C@@H](NC=O)c1c[n]ccc1 Amb24390688 [1,0,0,0,0,0|2,0,0]=3 348 B11R1.16 C[C@H](CC=O)c1ccccc1 Amb25843699 [1,0,0,0,0,0|1,0,0]=2 349 B11R1.16 C[C@H](CCBr)c1ccccc1 Amb25690423 [1,0,0,0,0,0|2,0,1]=4 350 B11R1.16 C[C@H](CCO)c1ccccc1 Amb24371178 [1,0,0,0,0,0|1,0,2]=4 351 B11R1.16 C[C@H](NC=O)c1c[n]ccc1 Amb24709803 [1,0,0,0,0,0|2,0,0]=3 352 B11R1.16 C[C@H](NC=O)c1cc[n]cc1 Amb25071847 [1,0,0,0,0,0|2,0,0]=3 353 B11R1.16 C[C@H](NC=O)c1cccc[n]1 Amb25782398 [1,0,0,0,0,0|2,0,0]=3 354 B11R1.16 C[C@H](NC=O)c1ccccc1 Amb24696096 [1,0,0,0,0,0|1,0,0]=2 355 B11R1.16 C[NH2+]OC(=O)c1ccccc1 Amb22352804 [1,0,0,0,0,0|2,0,1]=4 356 B11R1.16 C\C(=C/C=O)\c1cc[n]cc1 Amb25735690 [1,0,0,0,0,0|2,0,1]=4 357 B11R1.16 C\C(=C/C=O)\c1cccc[n]1 Amb18124820 [1,0,0,0,0,0|2,0,1]=4 358 B11R1.16 C\C(=C/CC)\c1ccccc1 Amb25151168 [1,0,0,0,0,0|1,0,2]=4 359 B11R1.16 C\C(=C\C=O)\c1ccccc1 Amb25124926 [1,0,0,0,0,0|1,0,1]=3 360 B11R1.16 C\C(=N\NC)\c1ccccc1 Amb25099332 [1,0,0,0,0,0|2,0,1]=4 361 B11R1.16 C\C(=N\OC)\c1ccccc1 Amb25189562 [1,0,0,0,0,0|2,0,1]=4 362 B11R1.16 C\C=C/C(O)c1c[n]ccc1 Amb25241944 [1,0,0,0,0,0|3,0,0]=4 363 B11R1.16 C\C=C\C(=O)c1ccccc1 Amb10574126 [1,0,0,0,0,0|2,0,1]=4 364 B11R1.16 C\C=C\C(C)c1cc[n]cc1 Amb24571960 [1,0,0,0,0,0|2,0,0]=3 365 B11R1.16 C\C=C\C(N)c1ccccc1 Amb18124850 [1,0,0,0,0,0|2,0,0]=3 366 B11R1.16 C\C=C\C(O)c1cccc[n]1 Amb24431006 [1,0,0,0,0,0|3,0,0]=4 367 B11R1.16 C\C=C\[C@@H](O)c1ccccc1 Amb25760539 [1,0,0,0,0,0|2,0,0]=3 368 B11R1.16 C\C=C\[C@H](O)c1ccccc1 Amb25190477 [1,0,0,0,0,0|2,0,0]=3 369 B11R1.16 C\C=N/C(=O)c1ccccc1 Amb24072877 [1,0,0,0,0,0|2,0,1]=4 370 B11R1.16 C\C=N\C(=O)c1ccccc1 Amb24563950 [1,0,0,0,0,0|2,0,1]=4 371 B11R1.16 ClCCC(c1ccccc1)C Amb17232691 [1,0,0,0,0,0|2,0,1]=4 372 B11R1.16 Cl\C=C\C(Cl)c1ccccc1 Amb24634048 [1,0,0,0,0,0|3,0,0]=4 373 B11R1.16 N\C(=C\C=O)\c1ccccc1 Amb24514799 [1,0,0,0,0,0|2,0,1]=4 374 B11R1.16 O=C(NC=O)c1ccccc1 Amb24096618 [1,0,0,0,0,0|2,0,1]=4 375 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb22330589 [1,0,0,0,0,0|2,0,1]=4 376 B11R1.16 O=C([CH-]C=O)c1ccccc1 Amb24121236 [1,0,0,0,0,0|2,0,1]=4 377 B11R1.16 O=CC=C(c1ccccc1)Cl Amb17232626 [1,0,0,0,0,0|2,0,1]=4 378 B11R1.16 O=CCC(=S)c1ccccc1 Amb25351016 [1,0,0,0,0,0|2,0,1]=4 379 B11R1.16 O=CCC(Cl)c1ccccc1 Amb24470053 [1,0,0,0,0,0|2,0,0]=3 380 B11R1.16 O=CCC(S)c1ccccc1 Amb18126455 [1,0,0,0,0,0|2,0,0]=3 381 B11R1.16 O=CCS(=O)c1ccccc1 Amb25674931 [1,0,0,0,0,0|3,0,0]=4 382 B11R1.16 O=CNC(c1ccccn1)C Amb10070157 [1,0,0,0,0,0|2,0,0]=3 383 B11R1.16 O=CNC(c1cccnc1)C Amb10070156 [1,0,0,0,0,0|2,0,0]=3 384 B11R1.16 O=CNC(c1ccncc1)C Amb10070155 [1,0,0,0,0,0|2,0,0]=3 385 B11R1.16 O=COC(Cl)c1ccccc1 Amb24710112 [1,0,0,0,0,0|1,0,0]=2 386 B11R1.16 O=C\C=C(/F)\c1ccccc1 Amb18125100 [1,0,0,0,0,0|2,0,1]=4 387 B11R1.16 O=C\C=C(/S)\c1ccccc1 Amb18646120 [1,0,0,0,0,0|2,0,1]=4 388 B11R1.16 O=C\C=C(\Br)/c1ccccc1 Amb25084228 [1,0,0,0,0,0|2,0,1]=4 389 B11R1.16 O=C\C=C(\Cl)/c1ccccc1 Amb19884139 [1,0,0,0,0,0|2,0,1]=4 390 B11R1.16 O=C\C=C(\c1ccccc1)/C Amb17593660 [1,0,0,0,0,0|1,0,1]=3 391 B11R1.16 O=NCC(Cl)c1ccccc1 Amb25177516 [1,0,0,0,0,0|3,0,0]=4 392 B11R1.16 OC(CC=O)c1cc[n]cc1 Amb24434533 [1,0,0,0,0,0|3,0,0]=4 393 B11R1.16 OC(CC=O)c1ccccc1 Amb18125126 [1,0,0,0,0,0|2,0,0]=3 394 B11R1.16 O[C@H](CC=O)c1cc[n]cc1 Amb25142585 [1,0,0,0,0,0|3,0,0]=4 395 B11R1.16 O[C@H](CC=O)c1ccccc1 Amb24533175 [1,0,0,0,0,0|2,0,0]=3 396 B11R1.16 [O-]SOC(O)c1ccccc1 Amb24403740 [1,0,0,0,0,0|2,0,1]=4 397 B11R1.91 CC(=C)COc1ccccc1 Amb10601706 [1,0,0,0,0,0|3,0,0]=4 398 B11R1.91 CC(=C)OCc1ccccc1 Amb22731238 [1,0,0,0,0,0|1,0,0]=2 399 B11R1.91 CC(=C)\C=C\c1ccccc1 Amb22546632 [1,0,0,0,0,0|2,0,1]=4 400 B11R1.91 CC(=N)NCc1cccc[n]1 Amb25798703 [1,0,0,0,0,0|3,0,0]=4 401 B11R1.91 CC(=N)NCc1ccccc1 Amb24477667 [1,0,0,0,0,0|2,0,0]=3 402 B11R1.91 CC(=N)SCc1ccccc1 Amb17609340 [1,0,0,0,0,0|1,1,0]=3 403 B11R1.91 CC(=NCc1ccccc1)C Amb10568469 [1,0,0,0,0,0|2,0,0]=3 404 B11R1.91 CC(=O)C=Cc1ccc[nH+]c1 Amb24099599 [1,0,0,0,0,0|2,0,1]=4 405 B11R1.91 CC(=O)CCN1CC=CC=C1 Amb24676819 [1,0,0,0,0,0|2,0,1]=4 406 B11R1.91 CC(=O)CCc1[n]ccc[n]1 Amb24726140 [1,0,0,0,0,0|3,0,0]=4 407 B11R1.91 CC(=O)CCc1c[n]cc[n]1 Amb25307907 [1,0,0,0,0,0|3,0,0]=4 408 B11R1.91 CC(=O)CCc1ccccn1 Amb17507163 [1,0,0,0,0,0|2,0,0]=3 409 B11R1.91 CC(=O)CCc1cccnc1 Amb17507164 [1,0,0,0,0,0|2,0,0]=3 410 B11R1.91 CC(=O)CCc1ccncc1 Amb17507165 [1,0,0,0,0,0|2,0,0]=3 411 B11R1.91 CC(=O)CNc1ccccc1 Amb24447025 [1,0,0,0,0,0|2,0,0]=3 412 B11R1.91 CC(=O)CSc1cc[n]cc1 Amb25344740 [1,0,0,0,0,0|3,0,0]=4 413 B11R1.91 CC(=O)NCc1[n]ccc[n]1 Amb24704246 [1,0,0,0,0,0|3,0,0]=4 414 B11R1.91 CC(=O)NCc1c[n]c[n]c1 Amb22727960 [1,0,0,0,0,0|3,0,0]=4 415 B11R1.91 CC(=O)NCc1c[n]cc[n]1 Amb25311243 [1,0,0,0,0,0|3,0,0]=4 416 B11R1.91 CC(=O)NCc1ccccc1 Amb1214455 [1,0,0,0,0,0|1,0,0]=2 417 B11R1.91 CC(=O)NNc1c[n]ccc1 Amb25272223 [1,0,0,0,0,0|3,0,0]=4 418 B11R1.91 CC(=O)NNc1cc[n]cc1 Amb24416297 [1,0,0,0,0,0|3,0,0]=4 419 B11R1.91 CC(=O)NOc1ccccc1 Amb24104585 [1,0,0,0,0,0|2,0,0]=3 420 B11R1.91 CC(=O)OCC1C=CCC=C1 Amb22365037 [1,0,0,0,0,0|0,0,2]=3 421 B11R1.91 CC(=O)OCc1[n]ccc[n]1 Amb22756932 [1,0,0,0,0,0|2,0,0]=3 422 B11R1.91 CC(=O)SCc1ccc[n]c1 Amb22274513 [1,0,0,0,0,0|1,1,0]=3 423 B11R1.91 CC(=O)SCc1cccc[n]1 Amb22274512 [1,0,0,0,0,0|1,1,0]=3 424 B11R1.91 CC(=O)SSc1ccccc1 Amb24370825 [1,0,0,0,0,0|1,1,0]=3 425 B11R1.91 CC(=O)\C=C/c1cccc[n]1 Amb24532942 [1,0,0,0,0,0|2,0,1]=4 426 B11R1.91 CC(=O)\C=C/c1ccccc1 Amb24380759 [1,0,0,0,0,0|1,0,1]=3 427 B11R1.91 CC(=O)\C=C\c1ccccc1 Amb1658842 [1,0,0,0,0,0|1,0,1]=3 428 B11R1.91 CC(=O)\C=C\c1ccccn1 Amb17477755 [1,0,0,0,0,0|2,0,1]=4 429 B11R1.91 CC(=O)\C=C\c1cccnc1 Amb17477757 [1,0,0,0,0,0|2,0,1]=4 430 B11R1.91 CC(=O)\C=C\c1ccncc1 Amb17477756 [1,0,0,0,0,0|2,0,1]=4 431 B11R1.91 CC(=O)\C=N\c1ccccc1 Amb25230668 [1,0,0,0,0,0|2,0,0]=3 432 B11R1.91 CC(=O)\N=N\c1ccccc1 Amb16231119 [1,0,0,0,0,0|2,0,0]=3 433 B11R1.91 CC(=S)NCc1cccc[n]1 Amb24372089 [1,0,0,0,0,0|2,1,0]=4 434 B11R1.91 CC(=S)NCc1ccccc1 Amb1797002 [1,0,0,0,0,0|1,1,0]=3 435 B11R1.91 CC(=S)OCc1ccccc1 Amb22168133 [1,0,0,0,0,0|0,1,0]=2 436 B11R1.91 CC(C)=CNc1ccccc1 Amb24715634 [1,0,0,0,0,0|3,0,0]=4 437 B11R1.91 CC(C)=NNc1ccccc1 Amb20240635 [1,0,0,0,0,0|3,0,0]=4 438 B11R1.91 CC(C)OCc1cc[n]cc1 Amb24649842 [1,0,0,0,0,0|2,0,1]=4 439 B11R1.91 CC(C)OCc1cccc[n]1 Amb24485831 [1,0,0,0,0,0|2,0,1]=4 440 B11R1.91 CC(N)OCc1cccc[n]1 Amb24432123 [1,0,0,0,0,0|2,0,1]=4 441 B11R1.91 CC(NCc1ccccc1)C Amb2118435 [1,0,0,0,0,0|2,0,1]=4 442 B11R1.91 CC(O)OCc1ccccc1 Amb25070837 [1,0,0,0,0,0|0,0,2]=3 443 B11R1.91 CN(C)CCc1ccccc1 Amb22350299 [1,0,0,0,0,0|3,0,0]=4 444 B11R1.91 CN(C)OCc1ccccc1 Amb24735469 [1,0,0,0,0,0|2,0,0]=3 445 B11R1.91 CN(N)CCc1ccccc1 Amb18064284 [1,0,0,0,0,0|3,0,0]=4 446 B11R1.91 C[C@@H](O)CCc1ccccc1 Amb22049565 [1,0,0,0,0,0|1,0,2]=4 447 B11R1.91 C[C@H](O)CCc1ccccc1 Amb19929325 [1,0,0,0,0,0|1,0,2]=4 448 B11R1.91 C[SiH](C)CCc1ccccc1 Amb22338692 [1,0,0,0,0,0|2,1,0]=4 449 B11R1.91 C\C(=C\C[n+]1ccccc1)\Cl Amb2228412 [1,0,0,0,0,0|3,0,0]=4 450 B11R1.91 C\C(\N)=C\Oc1ccccc1 Amb24674154 [1,0,0,0,0,0|3,0,0]=4 451 B11R1.91 C\C(\N)=N/Cc1c[n]ccc1 Amb24098048 [1,0,0,0,0,0|3,0,0]=4 452 B11R1.91 C\C(\N)=N\Nc1ccccc1 Amb24417520 [1,0,0,0,0,0|3,0,0]=4 453 B11R1.91 C\C(\N)=N\Oc1ccccc1 Amb25042875 [1,0,0,0,0,0|3,0,0]=4 454 B11R1.91 ClP(Cl)OCc1ccccc1 Amb22054434 [1,0,0,0,0,0|3,0,0]=4 455 B11R1.91 N=C(/N)\SCc1ccccc1 Amb20655654 [1,0,0,0,0,0|2,1,0]=4 456 B11R1.91 N=C([NH3+])SCc1ccccc1 Amb24113839 [1,0,0,0,0,0|2,1,0]=4 457 B11R1.91 NC(=N)NCc1ccccc1 Amb21955695 [1,0,0,0,0,0|3,0,0]=4 458 B11R1.91 NC(=N)NCc1ccccc1 Amb22370878 [1,0,0,0,0,0|3,0,0]=4 459 B11R1.91 NC(=N)SCc1ccccc1 Amb20676044 [1,0,0,0,0,0|2,1,0]=4 460 B11R1.91 NC(=N)[NH2+]Cc1ccccc1 Amb22269907 [1,0,0,0,0,0|3,0,0]=4 461 B11R1.91 NC(=NCc1ccccc1)N Amb16231121 [1,0,0,0,0,0|3,0,0]=4 462 B11R1.91 NC(=O)CCc1ccccn1 Amb17399914 [1,0,0,0,0,0|3,0,0]=4 463 B11R1.91 NC(=O)CCc1ccncc1 Amb10553007 [1,0,0,0,0,0|3,0,0]=4 464 B11R1.91 NC(=O)NCc1ccccc1 Amb2435042 [1,0,0,0,0,0|2,0,0]=3 465 B11R1.91 NC(=O)NCc1ccccn1 Amb1050832 [1,0,0,0,0,0|3,0,0]=4 466 B11R1.91 NC(=O)NCc1cccnc1 Amb2435041 [1,0,0,0,0,0|3,0,0]=4 467 B11R1.91 NC(=O)NOc1ccccc1 Amb24726052 [1,0,0,0,0,0|3,0,0]=4 468 B11R1.91 NC(=S)CCc1ccccc1 Amb1801109 [1,0,0,0,0,0|2,1,0]=4 469 B11R1.91 NC(=S)NCc1ccccc1 Amb1207502 [1,0,0,0,0,0|2,1,0]=4 470 B11R1.91 NC(=S)SCc1ccccc1 Amb19999447 [1,0,0,0,0,0|1,2,0]=4 471 B11R1.91 NC(=[NH2+])NCc1ccccc1 Amb22730911 [1,0,0,0,0,0|3,0,0]=4 472 B11R1.91 NC(=[NH2+])SCc1ccccc1 Amb2407328 [1,0,0,0,0,0|2,1,0]=4 473 B11R1.91 NC(N)=NCc1ccccc1 Amb19374239 [1,0,0,0,0,0|3,0,0]=4 474 B11R1.91 O=C(Cl)CCc1ccc[n]c1 Amb24077445 [1,0,0,0,0,0|3,0,0]=4 475 B11R1.91 O=C(Cl)NCc1ccccc1 Amb25772230 [1,0,0,0,0,0|2,0,0]=3 476 B11R1.91 O=C(Cl)OCc1cc[n]cc1 Amb24559531 [1,0,0,0,0,0|2,0,0]=3 477 B11R1.91 O=C(Cl)OCc1ccc[n]c1 Amb25852784 [1,0,0,0,0,0|2,0,0]=3 478 B11R1.91 O=C(S)CCc1ccccc1 Amb24733716 [1,0,0,0,0,0|2,0,0]=3 479 B11R1.91 O=S(Cl)CCc1ccccc1 Amb25371638 [1,0,0,0,0,0|3,0,0]=4 480 B11R1.91 OC(=O)CCc1ccccc1 Amb22366916 [1,0,0,0,0,0|2,0,0]=3 481 B11R1.91 OC(=O)CCc1ccccn1 Amb1102533 [1,0,0,0,0,0|3,0,0]=4 482 B11R1.91 OC(=O)CCc1cccnc1 Amb1214870 [1,0,0,0,0,0|3,0,0]=4 483 B11R1.91 OC(=O)CCc1ccncc1 Amb1090849 [1,0,0,0,0,0|3,0,0]=4 484 B11R1.91 OC(=O)COc1ccccc1 Amb1213413 [1,0,0,0,0,0|3,0,0]=4 485 B11R1.91 OC(=O)COc1ccccc1 Amb22274444 [1,0,0,0,0,0|3,0,0]=4 486 B11R1.91 OC(=O)CPc1ccccc1 Amb24487808 [1,0,0,0,0,0|3,0,0]=4 487 B11R1.91 OC(=O)CSc1ccccc1 Amb1038999 [1,0,0,0,0,0|3,0,0]=4 488 B11R1.91 OC(=O)NCc1ccccc1 Amb10603977 [1,0,0,0,0,0|2,0,0]=3 489 B11R1.91 OC(=O)[13CH2][13CH2]c1ccccc1 Amb22336575 [1,0,0,0,0,0|2,0,0]=3 490 B11R1.91 OC(=O)\C=C\c1ccccc1 Amb22366387 [1,0,0,0,0,0|2,0,1]=4 491 B11R1.91 OC(=O)\C=N\c1ccccc1 Amb25243930 [1,0,0,0,0,0|3,0,0]=4 492 B11R1.91 O[13C](=O)[13CH2][13CH2]c1ccccc1 Amb22336771 [1,0,0,0,0,0|2,0,0]=3 493 B11R1.91 SC(=S)CCc1ccccc1 Amb24439493 [1,0,0,0,0,0|2,1,0]=4 494 B11R1.91 SC(=S)OCc1ccccc1 Amb10553124 [1,0,0,0,0,0|1,1,0]=3 495 B11R1.91 SC(=S)OCc1ccccc1 Amb25721135 [1,0,0,0,0,0|1,1,0]=3 496 B11R1.91 [O-]C(=O)C#Cc1ccccc1 Amb22753901 [1,0,0,0,0,0|2,0,1]=4 497 B11R1.91 [O-]C(=O)CCc1ccccc1 Amb22233349 [1,0,0,0,0,0|2,0,0]=3 498 B11R1.91 [O-]C(=O)CNc1ccccc1 Amb21520409 [1,0,0,0,0,0|3,0,0]=4 499 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22167530 [1,0,0,0,0,0|3,0,0]=4 500 B11R1.91 [O-]C(=O)COc1ccccc1 Amb22734447 [1,0,0,0,0,0|3,0,0]=4 501 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb1814995 [1,0,0,0,0,0|2,0,1]=4 502 B11R1.91 [O-]C(=O)\C=C\c1ccccc1 Amb22360910 [1,0,0,0,0,0|2,0,1]=4 503 B11R1.91 [O-]P(=O)OCc1ccccc1 Amb22461723 [1,0,0,0,0,0|2,0,0]=3 504 B11R1.91 [O-]S(=O)NCc1ccccc1 Amb22641608 [1,0,0,0,0,0|3,0,0]=4 505 B11R1.91 [O-][N+](=O)CCc1ccccc1 Amb16192705 [1,0,0,0,0,0|3,0,0]=4 506 B11R1.91 [O-][N+](=O)O[Hg]c1ccccc1 Amb22732287 [1,0,0,0,0,0|3,0,0]=4 507 B13R1.11 BrCC(=O)NC(c1ccncc1)C Amb17330100 [0,1,0,0,0,0|2,0,0]=3 508 B13R1.11 C=CC(=O)N[C@@H](c1ccccc1)C Amb16192564 [0,1,0,0,0,0|1,0,1]=3 509 B13R1.11 CC(=C=O)NC(=O)c1ccccc1 Amb24427427 [0,1,0,0,0,0|2,0,1]=4 510 B13R1.11 CC(CC(=O)C#N)c1ccccc1 Amb24494969 [0,1,0,0,0,0|1,0,1]=3 511 B13R1.11 CC(CC(=O)NO)c1ccccc1 Amb24387362 [0,1,0,0,0,0|2,0,0]=3 512 B13R1.11 CC(CC(C)C=O)c1ccccc1 Amb18127778 [0,1,0,0,0,0|1,0,1]=3 513 B13R1.11 CC(CC(O)c1ccccc1)=C=C Amb25266831 [0,1,0,0,0,0|3,0,0]=4 514 B13R1.11 CC(CO)CC(C)c1ccccc1 Amb22733184 [0,1,0,0,0,0|1,0,2]=4 515 B13R1.11 CC(NC(=O)C#C)c1ccc[n]c1 Amb25356910 [0,1,0,0,0,0|2,0,1]=4 516 B13R1.11 CC(NC(=O)CCl)c1c[n]cc[n]1 Amb21861963 [0,1,0,0,0,0|3,0,0]=4 517 B13R1.11 CC(NC(=O)CF)c1ccccc1 Amb25041090 [0,1,0,0,0,0|1,0,0]=2 518 B13R1.11 CC(NC(=O)CI)c1ccccc1 Amb22340599 [0,1,0,0,0,0|1,0,0]=2 519 B13R1.11 CC(NC(=O)CN)c1c[n]cc[n]1 Amb21861967 [0,1,0,0,0,0|3,0,0]=4 520 B13R1.11 CC(NC(=O)CO)c1cc[n]cc1 Amb24705233 [0,1,0,0,0,0|2,0,0]=3 521 B13R1.11 CC(NC(=O)CO)c1ccc[n]c1 Amb25167477 [0,1,0,0,0,0|2,0,0]=3 522 B13R1.11 CC(NC(=O)CO)c1cccc[n]1 Amb24403502 [0,1,0,0,0,0|2,0,0]=3 523 B13R1.11 CC(NC(=O)CS)c1cc[n]cc1 Amb25226569 [0,1,0,0,0,0|2,0,0]=3 524 B13R1.11 CC(NC(=O)CS)c1ccc[n]c1 Amb25740479 [0,1,0,0,0,0|2,0,0]=3 525 B13R1.11 CC(NC(=O)NN)c1cc[n]cc1 Amb18805013 [0,1,0,0,0,0|3,0,0]=4 526 B13R1.11 CC(NC(=O)NO)c1ccccc1 Amb25121196 [0,1,0,0,0,0|2,0,0]=3 527 B13R1.11 CC(NC(C)C#C)c1ccccc1 Amb25858830 [0,1,0,0,0,0|2,0,1]=4 528 B13R1.11 CC(NC(N)=NO)c1ccccc1 Amb18186377 [0,1,0,0,0,0|2,0,1]=4 529 B13R1.11 CC(OC(=S)NN)c1ccccc1 Amb25772337 [0,1,0,0,0,0|1,1,0]=3 530 B13R1.11 CC(c1ccccc1)NC(C#N)C Amb17400450 [0,1,0,0,0,0|2,0,1]=4 531 B13R1.11 CCC(=N)NC(C)c1ccc[n]c1 Amb25821712 [0,1,0,0,0,0|3,0,0]=4 532 B13R1.11 CCC(=O)CC(c1ccccc1)C Amb17594493 [0,1,0,0,0,0|1,0,0]=2 533 B13R1.11 CCC(=O)NC(=N)c1ccccc1 Amb25855572 [0,1,0,0,0,0|2,0,1]=4 534 B13R1.11 CCC(=O)NC(C)c1cc[n]cc1 Amb25849891 [0,1,0,0,0,0|2,0,0]=3 535 B13R1.11 CCC(=O)NN(c1ccccc1)C Amb1869422 [0,1,0,0,0,0|2,0,0]=3 536 B13R1.11 CCC(=O)N[C@@H](C)c1cc[n]cc1 Amb24434298 [0,1,0,0,0,0|2,0,0]=3 537 B13R1.11 CCC(=O)N[C@@H](C)c1ccc[n]c1 Amb25232496 [0,1,0,0,0,0|2,0,0]=3 538 B13R1.11 CCC(=O)N[C@@H](C)c1cccc[n]1 Amb25752057 [0,1,0,0,0,0|2,0,0]=3 539 B13R1.11 CCC(=O)N[C@@H](C)c1ccccc1 Amb23091317 [0,1,0,0,0,0|1,0,0]=2 540 B13R1.11 CCC(=O)N[C@H](C)c1ccc[n]c1 Amb24489299 [0,1,0,0,0,0|2,0,0]=3 541 B13R1.11 CCC(=O)N[C@H](C)c1cccc[n]1 Amb25120344 [0,1,0,0,0,0|2,0,0]=3 542 B13R1.11 CCC(=O)OC(=O)c1ccccc1 Amb22500123 [0,1,0,0,0,0|1,0,1]=3 543 B13R1.11 CN(CC(=O)NC)c1cc[n]cc1 Amb25252497 [0,1,0,0,0,0|3,0,0]=4 544 B13R1.11 CN(CC(=O)NC)c1cccc[n]1 Amb24422204 [0,1,0,0,0,0|3,0,0]=4 545 B13R1.11 CN(CC(=O)NC)c1ccccc1 Amb19971421 [0,1,0,0,0,0|2,0,0]=3 546 B13R1.11 CN(CC(=O)OC)c1cccc[n]1 Amb18186549 [0,1,0,0,0,0|3,0,0]=4 547 B13R1.11 CN(\C=C(/O)\C=O)c1ccccc1 Amb25082760 [0,1,0,0,0,0|3,0,0]=4 548 B13R1.11 CNC(=N)NC(C)c1cc[n]cc1 Amb18184395 [0,1,0,0,0,0|3,0,0]=4 549 B13R1.11 CNC(=N)NC(C)c1ccc[n]c1 Amb18184394 [0,1,0,0,0,0|3,0,0]=4 550 B13R1.11 CNC(=N)NC(C)c1cccc[n]1 Amb18184396 [0,1,0,0,0,0|3,0,0]=4 551 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb18184205 [0,1,0,0,0,0|2,0,0]=3 552 B13R1.11 CNC(=N)NC(C)c1ccccc1 Amb20631264 [0,1,0,0,0,0|2,0,0]=3 553 B13R1.11 CNC(=N)N[C@@H](C)c1cc[n]cc1 Amb25300802 [0,1,0,0,0,0|3,0,0]=4 554 B13R1.11 CNC(=N)N[C@@H](C)c1cccc[n]1 Amb24353594 [0,1,0,0,0,0|3,0,0]=4 555 B13R1.11 CNC(=N)N[C@@H](C)c1ccccc1 Amb25152972 [0,1,0,0,0,0|2,0,0]=3 556 B13R1.11 CNC(=N)N[C@H](C)c1cc[n]cc1 Amb25702002 [0,1,0,0,0,0|3,0,0]=4 557 B13R1.11 CNC(=N)N[C@H](C)c1cccc[n]1 Amb25858377 [0,1,0,0,0,0|3,0,0]=4 558 B13R1.11 CNC(=O)CC(=O)c1ccccc1 Amb24361603 [0,1,0,0,0,0|2,0,1]=4 559 B13R1.11 CNC(=O)CC(=S)c1ccccc1 Amb25125271 [0,1,0,0,0,0|2,0,1]=4 560 B13R1.11 CNC(=O)CC(C)c1cc[n]cc1 Amb25686680 [0,1,0,0,0,0|2,0,0]=3 561 B13R1.11 CNC(=O)CC(C)c1ccc[n]c1 Amb24397679 [0,1,0,0,0,0|2,0,0]=3 562 B13R1.11 CNC(=O)CC(c1cccnc1)N Amb17233543 [0,1,0,0,0,0|3,0,0]=4 563 B13R1.11 CNC(=O)CS(=O)c1ccccc1 Amb25807172 [0,1,0,0,0,0|3,0,0]=4 564 B13R1.11 CNC(=O)C[C@@H](O)c1ccccc1 Amb24490336 [0,1,0,0,0,0|2,0,0]=3 565 B13R1.11 CNC(=O)C[C@H](C)c1ccccc1 Amb25041089 [0,1,0,0,0,0|1,0,0]=2 566 B13R1.11 CNC(=O)C[C@H](N)c1ccccc1 Amb24637726 [0,1,0,0,0,0|2,0,0]=3 567 B13R1.11 CNC(=O)C[C@H](O)c1ccccc1 Amb24444391 [0,1,0,0,0,0|2,0,0]=3 568 B13R1.11 CNC(=O)NC(=N)c1ccccc1 Amb24441539 [0,1,0,0,0,0|2,0,1]=4 569 B13R1.11 CNC(=O)NC(C)c1cc[n]cc1 Amb25153495 [0,1,0,0,0,0|2,0,0]=3 570 B13R1.11 CNC(=O)NC(C)c1ccc[n]c1 Amb25190371 [0,1,0,0,0,0|2,0,0]=3 571 B13R1.11 CNC(=O)NC(C)c1cccc[n]1 Amb25128617 [0,1,0,0,0,0|2,0,0]=3 572 B13R1.11 CNC(=O)NC(C)c1ccccc1 Amb25324528 [0,1,0,0,0,0|1,0,0]=2 573 B13R1.11 CNC(=O)NN(C)c1ccccc1 Amb25137162 [0,1,0,0,0,0|2,0,0]=3 574 B13R1.11 CNC(=O)N[C@@H](C)c1ccc[n]c1 Amb25730920 [0,1,0,0,0,0|2,0,0]=3 575 B13R1.11 CNC(=O)N[C@H](C)c1ccccc1 Amb25040008 [0,1,0,0,0,0|1,0,0]=2 576 B13R1.11 CNC(=S)NC(C)c1cc[n]cc1 Amb23465377 [0,1,0,0,0,0|2,1,0]=4 577 B13R1.11 CNC(=S)NC(C)c1cccc[n]1 Amb25155802 [0,1,0,0,0,0|2,1,0]=4 578 B13R1.11 CNC(=S)N[C@@H](C)c1ccccc1 Amb24414685 [0,1,0,0,0,0|1,1,0]=3 579 B13R1.11 CNC(=S)N[C@H](C)c1ccc[n]c1 Amb24450747 [0,1,0,0,0,0|2,1,0]=4 580 B13R1.11 COC(=O)CC(=O)c1ccccc1 Amb10553935 [0,1,0,0,0,0|2,0,1]=4 581 B13R1.11 COC(=O)CC(C)c1ccccc1 Amb17843427 [0,1,0,0,0,0|1,0,0]=2 582 B13R1.11 COC(=O)CC(O)c1ccccc1 Amb22731500 [0,1,0,0,0,0|2,0,0]=3 583 B13R1.11 COC(=O)CC(c1ccccc1)N Amb1221582 [0,1,0,0,0,0|2,0,0]=3 584 B13R1.11 COC(=O)CC(c1ccccc1)N Amb2371447 [0,1,0,0,0,0|2,0,0]=3 585 B13R1.11 COC(=O)C[C@@H](C)c1ccccc1 Amb22363030 [0,1,0,0,0,0|1,0,0]=2 586 B13R1.11 COC(=O)C[C@@H](N)c1ccc[n]c1 Amb24107581 [0,1,0,0,0,0|3,0,0]=4 587 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb18796125 [0,1,0,0,0,0|2,0,0]=3 588 B13R1.11 COC(=O)C[C@@H](N)c1ccccc1 Amb19373681 [0,1,0,0,0,0|2,0,0]=3 589 B13R1.11 COC(=O)C[C@@H](c1ccccc1)N Amb17617178 [0,1,0,0,0,0|2,0,0]=3 590 B13R1.11 COC(=O)C[C@H](N)c1ccccc1 Amb22268691 [0,1,0,0,0,0|2,0,0]=3 591 B13R1.11 COC(=O)NC(=N)c1ccccc1 Amb25254191 [0,1,0,0,0,0|2,0,1]=4 592 B13R1.11 COC(=O)NC(=O)c1ccccc1 Amb25190157 [0,1,0,0,0,0|2,0,1]=4 593 B13R1.11 COC(=O)NC(C)c1ccc[n]c1 Amb25155951 [0,1,0,0,0,0|2,0,0]=3 594 B13R1.11 COC(=O)NC(c1ccccc1)C Amb10568146 [0,1,0,0,0,0|1,0,0]=2 595 B13R1.11 COC(=O)N[C@@H](C)c1cccc[n]1 Amb25788838 [0,1,0,0,0,0|2,0,0]=3 596 B13R1.11 COC(=O)N[C@@H](C)c1ccccc1 Amb24611219 [0,1,0,0,0,0|1,0,0]=2 597 B13R1.11 COC(=O)N[C@H](C)c1ccc[n]c1 Amb25821184 [0,1,0,0,0,0|2,0,0]=3 598 B13R1.11 COC(=O)N[C@H](C)c1cccc[n]1 Amb24466639 [0,1,0,0,0,0|2,0,0]=3 599 B13R1.11 COC(=O)N[C@H](C)c1ccccc1 Amb24666677 [0,1,0,0,0,0|1,0,0]=2 600 B13R1.11 COC(=O)\C=C(\N)/c1ccccc1 Amb25258009 [0,1,0,0,0,0|2,0,1]=4 601 B13R1.11 CSC(=O)NC(=O)c1ccccc1 Amb25743426 [0,1,0,0,0,0|2,0,1]=4 602 B13R1.11 CSC(=O)NC(C)c1ccccc1 Amb25292316 [0,1,0,0,0,0|1,0,0]=2 603 B13R1.11 C[C@@H](CC(=O)NN)c1ccccc1 Amb22357025 [0,1,0,0,0,0|2,0,0]=3 604 B13R1.11 C[C@@H](NC(=O)C#C)c1ccc[n]c1 Amb24474101 [0,1,0,0,0,0|2,0,1]=4 605 B13R1.11 C[C@@H](NC(=O)C=C)c1cccc[n]1 Amb25362937 [0,1,0,0,0,0|2,0,1]=4 606 B13R1.11 C[C@@H](NC(=O)CBr)c1cc[n]cc1 Amb24625001 [0,1,0,0,0,0|2,0,0]=3 607 B13R1.11 C[C@@H](NC(=O)CBr)c1ccc[n]c1 Amb25299108 [0,1,0,0,0,0|2,0,0]=3 608 B13R1.11 C[C@@H](NC(=O)CN)c1cccc[n]1 Amb24590584 [0,1,0,0,0,0|2,0,0]=3 609 B13R1.11 C[C@@H](NC(=O)CO)c1cccc[n]1 Amb25807145 [0,1,0,0,0,0|2,0,0]=3 610 B13R1.11 C[C@@H](NC(=O)CO)c1ccccc1 Amb25324160 [0,1,0,0,0,0|1,0,0]=2 611 B13R1.11 C[C@@H](N[C@@H](C)C#N)c1ccccc1 Amb25752018 [0,1,0,0,0,0|2,0,1]=4 612 B13R1.11 C[C@@H](N[C@H](C)C#C)c1ccccc1 Amb25758951 [0,1,0,0,0,0|2,0,1]=4 613 B13R1.11 C[C@H](NC(=O)C#C)c1ccc[n]c1 Amb25838330 [0,1,0,0,0,0|2,0,1]=4 614 B13R1.11 C[C@H](NC(=O)C=C)c1cc[n]cc1 Amb25274618 [0,1,0,0,0,0|2,0,1]=4 615 B13R1.11 C[C@H](NC(=O)C=C)c1ccc[n]c1 Amb25192059 [0,1,0,0,0,0|2,0,1]=4 616 B13R1.11 C[C@H](NC(=O)C=C)c1cccc[n]1 Amb25101352 [0,1,0,0,0,0|2,0,1]=4 617 B13R1.11 C[C@H](NC(=O)C=C)c1ccccc1 Amb25858461 [0,1,0,0,0,0|1,0,1]=3 618 B13R1.11 C[C@H](NC(=O)CBr)c1cc[n]cc1 Amb24365752 [0,1,0,0,0,0|2,0,0]=3 619 B13R1.11 C[C@H](NC(=O)CBr)c1cccc[n]1 Amb25088775 [0,1,0,0,0,0|2,0,0]=3 620 B13R1.11 C[C@H](NC(=O)CBr)c1ccccc1 Amb25291312 [0,1,0,0,0,0|1,0,0]=2 621 B13R1.11 C[C@H](NC(=O)CCl)c1ccc[n]c1 Amb25752234 [0,1,0,0,0,0|2,0,0]=3 622 B13R1.11 C[C@H](NC(=O)CCl)c1cccc[n]1 Amb25061088 [0,1,0,0,0,0|2,0,0]=3 623 B13R1.11 C[C@H](NC(=O)CN)c1cc[n]cc1 Amb25094641 [0,1,0,0,0,0|2,0,0]=3 624 B13R1.11 C[C@H](NC(=O)CN)c1ccc[n]c1 Amb25752233 [0,1,0,0,0,0|2,0,0]=3 625 B13R1.11 C[C@H](NC(=O)CS)c1ccccc1 Amb25698363 [0,1,0,0,0,0|1,0,0]=2 626 B13R1.11 C[C@H](NC(=O)NN)c1ccccc1 Amb22356343 [0,1,0,0,0,0|2,0,0]=3 627 B13R1.11 C[C@H](NC(C)C#C)c1ccccc1 Amb25195849 [0,1,0,0,0,0|2,0,1]=4 628 B13R1.11 C[C@H](N[C@@H](C)C#N)c1ccccc1 Amb24417915 [0,1,0,0,0,0|2,0,1]=4 629 B13R1.11 C[C@H](N[C@H](C)C#C)c1ccccc1 Amb25041022 [0,1,0,0,0,0|2,0,1]=4 630 B13R1.11 C[C@H](N[C@H](C)C#N)c1ccccc1 Amb25731977 [0,1,0,0,0,0|2,0,1]=4 631 B13R1.11 C\C(=C/C(=O)C#N)\c1ccccc1 Amb25050242 [0,1,0,0,0,0|1,0,2]=4 632 B13R1.11 C\C(=C/C(=O)OC)\c1cccc[n]1 Amb24555692 [0,1,0,0,0,0|2,0,1]=4 633 B13R1.11 C\C(=C\C(=O)C#N)\c1ccccc1 Amb24584484 [0,1,0,0,0,0|1,0,2]=4 634 B13R1.11 C\C(=C\C(=O)C=C)\c1ccccc1 Amb25377817 [0,1,0,0,0,0|1,0,2]=4 635 B13R1.11 C\C(=C\C(=O)CC)\c1ccccc1 Amb24553546 [0,1,0,0,0,0|1,0,1]=3 636 B13R1.11 C\C(=C\C(=O)NC)\c1ccccc1 Amb24369890 [0,1,0,0,0,0|1,0,1]=3 637 B13R1.11 C\C(=C\C(=O)OC)\c1c[n]ccc1 Amb25191857 [0,1,0,0,0,0|2,0,1]=4 638 B13R1.11 C\C(=C\C(C)C=O)\c1ccccc1 Amb25328859 [0,1,0,0,0,0|1,0,2]=4 639 B13R1.11 C\C(=C\C(O)c1ccccc1)\C#C Amb25847852 [0,1,0,0,0,0|3,0,0]=4 640 B13R1.11 C\C(\C=O)=C/C(C)c1ccccc1 Amb18647861 [0,1,0,0,0,0|1,0,0]=2 641 B13R1.11 C\C(\C=O)=C\C(O)c1ccccc1 Amb24752502 [0,1,0,0,0,0|2,0,0]=3 642 B13R1.11 C\C(\C=O)=N/N(C)c1ccccc1 Amb18127764 [0,1,0,0,0,0|2,0,0]=3 643 B13R1.11 C\C(\CC(C)c1ccccc1)=N/O Amb25255452 [0,1,0,0,0,0|1,0,1]=3 644 B13R1.11 C\C(\CC(O)c1ccccc1)=C\C Amb24576542 [0,1,0,0,0,0|3,0,0]=4 645 B13R1.11 C\C(\CC(O)c1ccccc1)=C\Cl Amb25794461 [0,1,0,0,0,0|3,0,0]=4 646 B13R1.11 C\C(\CCl)=C\C(C)c1ccccc1 Amb25840684 [0,1,0,0,0,0|2,0,0]=3 647 B13R1.11 C\C(\CO)=C\C(C)c1ccccc1 Amb24495198 [0,1,0,0,0,0|1,0,1]=3 648 B13R1.11 C\C=C(/F)\CN(C)c1ccccc1 Amb22546801 [0,1,0,0,0,0|3,0,0]=4 649 B13R1.11 ClCC(=O)NC(=N)c1ccccc1 Amb10552973 [0,1,0,0,0,0|2,0,1]=4 650 B13R1.11 ClCC(=O)NC(c1ccccc1)C Amb1643934 [0,1,0,0,0,0|1,0,0]=2 651 B13R1.11 ClCC(=O)N[C@@H](c1ccccc1)C Amb10844688 [0,1,0,0,0,0|1,0,0]=2 652 B13R1.11 ClCC(=O)N[C@H](c1ccccc1)C Amb10844690 [0,1,0,0,0,0|1,0,0]=2 653 B13R1.11 NC(CC(=O)NO)c1ccccc1 Amb25118570 [0,1,0,0,0,0|3,0,0]=4 654 B13R1.11 NCC(=O)NC(=O)c1ccccc1 Amb25782184 [0,1,0,0,0,0|2,0,1]=4 655 B13R1.11 NCC(=O)NC(c1ccccc1)C Amb10767123 [0,1,0,0,0,0|1,0,0]=2 656 B13R1.11 NNC(=O)CC(O)c1ccccc1 Amb24720262 [0,1,0,0,0,0|3,0,0]=4 657 B13R1.11 NNC(=O)C[C@@H](O)c1ccccc1 Amb24533813 [0,1,0,0,0,0|3,0,0]=4 658 B13R1.11 N[C@H](CC(=O)NO)c1ccccc1 Amb24586364 [0,1,0,0,0,0|3,0,0]=4 659 B13R1.11 N\C(=N\C(=O)CN)\c1ccccc1 Amb25200216 [0,1,0,0,0,0|2,0,1]=4 660 B13R1.11 O=C(CCl)NC(=S)c1ccccc1 Amb22285382 [0,1,0,0,0,0|2,0,1]=4 661 B13R1.11 O=C(CCl)NS(=O)c1ccccc1 Amb25858213 [0,1,0,0,0,0|3,0,0]=4 662 B13R1.11 O=C(NC(=O)CF)c1ccccc1 Amb24743332 [0,1,0,0,0,0|2,0,1]=4 663 B13R1.11 OCC(=C=C(c1ccccc1)C)C Amb17594413 [0,1,0,0,0,0|1,0,2]=4 664 B13R1.11 OCC(=O)NC(=O)c1ccccc1 Amb1109639 [0,1,0,0,0,0|2,0,1]=4 665 B13R1.11 OCC(=O)NC(c1ccccc1)C Amb1110697 [0,1,0,0,0,0|1,0,0]=2 666 B13R1.132 CC(=C)CC(N)c1ccc(Cl)cc1 Amb25137701 [0,1,0,0,0,0|3,0,0]=4 667 B13R1.132 CC(=C)CC(N)c1ccc(I)cc1 Amb25161110 [0,1,0,0,0,0|3,0,0]=4 668 B13R1.132 CC(=C)CC(O)c1ccc(Cl)cc1 Amb25757059 [0,1,0,0,0,0|3,0,0]=4 669 B13R1.132 CC(=C)CC(O)c1ccc(F)cc1 Amb24531926 [0,1,0,0,0,0|3,0,0]=4 670 B13R1.132 CC(=C)CC(O)c1ccc(I)cc1 Amb25161022 [0,1,0,0,0,0|3,0,0]=4 671 B13R1.132 CC(=C)CC(O)c1ccc(N)cc1 Amb24761112 [0,1,0,0,0,0|3,0,0]=4 672 B13R1.132 CC(=C)CN(C)c1ccc(F)cc1 Amb25847704 [0,1,0,0,0,0|3,0,0]=4 673 B13R1.132 CC(=C)CN(C)c1ccc(N)cc1 Amb25240740 [0,1,0,0,0,0|3,0,0]=4 674 B13R1.132 CC(=C)CN(C)c1ccc(O)cc1 Amb24458512 [0,1,0,0,0,0|3,0,0]=4 675 B13R1.132 CC(=N)NC(C)c1ccc(Cl)cc1 Amb25728600 [0,1,0,0,0,0|2,0,0]=3 676 B13R1.132 CC(=O)CC(=O)c1ccc(I)cc1 Amb25040567 [0,1,0,0,0,0|2,0,1]=4 677 B13R1.132 CC(=O)CC(=O)c1ccc(O)cc1 Amb18128073 [0,1,0,0,0,0|2,0,1]=4 678 B13R1.132 CC(=O)CC(=O)c1ccc(cc1)C Amb1209108 [0,1,0,0,0,0|2,0,1]=4 679 B13R1.132 CC(=O)CC(O)c1ccc(Cl)cc1 Amb24346726 [0,1,0,0,0,0|2,0,0]=3 680 B13R1.132 CC(=O)CC(O)c1ccc(F)cc1 Amb25080847 [0,1,0,0,0,0|2,0,0]=3 681 B13R1.132 CC(=O)CN(C)c1ccc(F)cc1 Amb18179022 [0,1,0,0,0,0|2,0,0]=3 682 B13R1.132 CC(=O)CN(C)c1ccc(O)cc1 Amb18128413 [0,1,0,0,0,0|2,0,0]=3 683 B13R1.132 CC(=O)CS(=O)c1ccc(Cl)cc1 Amb24346892 [0,1,0,0,0,0|3,0,0]=4 684 B13R1.132 CC(=O)C[C@@H](O)c1ccc(Br)cc1 Amb25689126 [0,1,0,0,0,0|2,0,0]=3 685 B13R1.132 CC(=O)C[C@H](O)c1ccc(Br)cc1 Amb24733813 [0,1,0,0,0,0|2,0,0]=3 686 B13R1.132 CC(=O)C[C@H](O)c1ccc(Cl)cc1 Amb24495353 [0,1,0,0,0,0|2,0,0]=3 687 B13R1.132 CC(=O)NC(=C)c1ccc(Br)cc1 Amb22270447 [0,1,0,0,0,0|1,0,2]=4 688 B13R1.132 CC(=O)NC(=O)c1ccc(F)cc1 Amb18178968 [0,1,0,0,0,0|2,0,1]=4 689 B13R1.132 CC(=O)NC(=O)c1ccc(I)cc1 Amb25779064 [0,1,0,0,0,0|2,0,1]=4 690 B13R1.132 CC(=O)NC(=O)c1ccc(O)cc1 Amb18128318 [0,1,0,0,0,0|2,0,1]=4 691 B13R1.132 CC(=O)NC(=S)c1ccc(Cl)cc1 Amb24399257 [0,1,0,0,0,0|2,0,1]=4 692 B13R1.132 CC(=O)NC(C)c1[n]cc(Br)c[n]1 Amb24577695 [0,1,0,0,0,0|3,0,0]=4 693 B13R1.132 CC(=O)NC(C)c1c[n]c(Cl)c[n]1 Amb25343514 [0,1,0,0,0,0|3,0,0]=4 694 B13R1.132 CC(=O)NC(C)c1ccc(Br)[n]c1 Amb24759268 [0,1,0,0,0,0|2,0,0]=3 695 B13R1.132 CC(=O)NC(C)c1ccc(Cl)[n]c1 Amb25343513 [0,1,0,0,0,0|2,0,0]=3 696 B13R1.132 CC(=O)N[C@@H](C)c1ccc(Cl)c[n]1 Amb25829884 [0,1,0,0,0,0|2,0,0]=3 697 B13R1.132 CC(=O)N[C@@H](C)c1ccc(F)c[n]1 Amb22744792 [0,1,0,0,0,0|2,0,0]=3 698 B13R1.132 CC(=O)N[C@@H](C)c1ccc(F)cc1 Amb25759857 [0,1,0,0,0,0|1,0,0]=2 699 B13R1.132 CC(=O)N[C@@H](C)c1ccc(I)cc1 Amb24596753 [0,1,0,0,0,0|1,0,0]=2 700 B13R1.132 CC(=O)N[C@@H](C)c1ccc(O)cc1 Amb24602338 [0,1,0,0,0,0|1,0,0]=2 701 B13R1.132 CC(=O)N[C@H](C)c1ccc(F)c[n]1 Amb25731898 [0,1,0,0,0,0|2,0,0]=3 702 B13R1.132 CC(=O)N[C@H](C)c1ccc(F)cc1 Amb25670331 [0,1,0,0,0,0|1,0,0]=2 703 B13R1.132 CC(=O)OC(C)c1ccc(Br)cc1 Amb24688904 [0,1,0,0,0,0|0,0,0]=1 704 B13R1.132 CC(=O)OC(C)c1ccc(Cl)cc1 Amb24397810 [0,1,0,0,0,0|0,0,0]=1 705 B13R1.132 CC(=O)OC(C)c1ccc(F)c[n]1 Amb24403643 [0,1,0,0,0,0|1,0,0]=2 706 B13R1.132 CC(=O)OC(C)c1ccc(F)cc1 Amb24719345 [0,1,0,0,0,0|0,0,0]=1 707 B13R1.132 CC(=O)OC(C)c1ccc(O)cc1 Amb18128606 [0,1,0,0,0,0|0,0,0]=1 708 B13R1.132 CC(=O)ON(C)c1ccc(N)cc1 Amb25689832 [0,1,0,0,0,0|1,0,0]=2 709 B13R1.132 CC(=O)O[C@@H](C)c1ccc(Cl)c[n]1 Amb25749644 [0,1,0,0,0,0|1,0,0]=2 710 B13R1.132 CC(=O)O[C@H](C)c1ccc(O)cc1 Amb25318784 [0,1,0,0,0,0|0,0,0]=1 711 B13R1.132 CC(=O)\C=C(/N)\c1ccc(Cl)cc1 Amb25790284 [0,1,0,0,0,0|2,0,1]=4 712 B13R1.132 CC(=O)\C=C(/O)\c1ccc(O)cc1 Amb24631596 [0,1,0,0,0,0|2,0,1]=4 713 B13R1.132 CC(Br)CC(C)c1ccc(Cl)cc1 Amb24674407 [0,1,0,0,0,0|2,0,1]=4 714 B13R1.132 CC(Br)CC(C)c1ccc(F)cc1 Amb24379714 [0,1,0,0,0,0|2,0,1]=4 715 B13R1.132 CC(C)=CC(N)c1ccc(Br)cc1 Amb24570161 [0,1,0,0,0,0|3,0,0]=4 716 B13R1.132 CC(C)=CC(N)c1ccc(C)cc1 Amb25772019 [0,1,0,0,0,0|3,0,0]=4 717 B13R1.132 CC(C)=CC(N)c1ccc(Cl)cc1 Amb25040356 [0,1,0,0,0,0|3,0,0]=4 718 B13R1.132 CC(C)=CC(N)c1ccc(F)cc1 Amb25734828 [0,1,0,0,0,0|3,0,0]=4 719 B13R1.132 CC(C)=CC(N)c1ccc(I)cc1 Amb25757552 [0,1,0,0,0,0|3,0,0]=4 720 B13R1.132 CC(C)=CC(O)c1ccc(Br)cc1 Amb25369889 [0,1,0,0,0,0|3,0,0]=4 721 B13R1.132 CC(C)=CC(O)c1ccc(C)cc1 Amb24575203 [0,1,0,0,0,0|3,0,0]=4 722 B13R1.132 CC(C)=CC(O)c1ccc(Cl)cc1 Amb24460395 [0,1,0,0,0,0|3,0,0]=4 723 B13R1.132 CC(C)=CC(O)c1ccc(F)cc1 Amb25050366 [0,1,0,0,0,0|3,0,0]=4 724 B13R1.132 CC(C)=CC(O)c1ccc(I)cc1 Amb25120299 [0,1,0,0,0,0|3,0,0]=4 725 B13R1.132 CC(C)=C[C@H](N)c1ccc(Cl)cc1 Amb25857981 [0,1,0,0,0,0|3,0,0]=4 726 B13R1.132 CC(C)=C[C@H](O)c1ccc(Cl)cc1 Amb24735178 [0,1,0,0,0,0|3,0,0]=4 727 B13R1.132 CC(C)N[C@@H](C)c1ccc(Cl)cc1 Amb24728946 [0,1,0,0,0,0|2,0,1]=4 728 B13R1.132 CC(C)N[C@H](C)c1ccc(Br)cc1 Amb25058373 [0,1,0,0,0,0|2,0,1]=4 729 B13R1.132 CC(C)N[C@H](C)c1ccc(Cl)cc1 Amb25119010 [0,1,0,0,0,0|2,0,1]=4 730 B13R1.132 CC(C)OC(C)c1ccc(Br)cc1 Amb23443734 [0,1,0,0,0,0|1,0,1]=3 731 B13R1.132 CC(C)OC(C)c1ccc(N)cc1 Amb18292845 [0,1,0,0,0,0|1,0,1]=3 732 B13R1.132 CC(C)SC(C)c1ccc(F)cc1 Amb24380621 [0,1,0,0,0,0|1,1,1]=4 733 B13R1.132 CC(C)SC(C)c1ccc(N)cc1 Amb18974010 [0,1,0,0,0,0|1,1,1]=4 734 B13R1.132 CC(CC(N)=O)c1ccc(N)cc1 Amb25859609 [0,1,0,0,0,0|2,0,0]=3 735 B13R1.132 CC(CC(N)=O)c1ccc(O)cc1 Amb18128419 [0,1,0,0,0,0|2,0,0]=3 736 B13R1.132 CC(CC(O)=O)c1ccc(I)cc1 Amb25783621 [0,1,0,0,0,0|2,0,0]=3 737 B13R1.132 CC(CC([O-])=O)c1ccc(C)cc1 Amb17843541 [0,1,0,0,0,0|2,0,0]=3 738 B13R1.132 CC(Cl)CC(C)c1ccc(F)cc1 Amb24457307 [0,1,0,0,0,0|2,0,1]=4 739 B13R1.132 CC(NC(N)=N)c1ccc(Br)cc1 Amb25154817 [0,1,0,0,0,0|3,0,0]=4 740 B13R1.132 CC(NC(N)=N)c1ccc(Cl)cc1 Amb19066805 [0,1,0,0,0,0|3,0,0]=4 741 B13R1.132 CC(NC(N)=N)c1ccc(F)cc1 Amb18185008 [0,1,0,0,0,0|3,0,0]=4 742 B13R1.132 CC(NC(N)=N)c1ccc(O)cc1 Amb25302193 [0,1,0,0,0,0|3,0,0]=4 743 B13R1.132 CC(NC(N)=O)c1ccc(Cl)[n]c1 Amb25792062 [0,1,0,0,0,0|3,0,0]=4 744 B13R1.132 CC(NC(N)=O)c1ccc(Cl)cc1 Amb19088729 [0,1,0,0,0,0|2,0,0]=3 745 B13R1.132 CC(NC(N)=O)c1ccc(F)cc1 Amb18187072 [0,1,0,0,0,0|2,0,0]=3 746 B13R1.132 CC(NC(N)=S)c1ccc(Cl)cc1 Amb24730136 [0,1,0,0,0,0|2,1,0]=4 747 B13R1.132 CC(NC(N)=S)c1ccc(F)cc1 Amb18321924 [0,1,0,0,0,0|2,1,0]=4 748 B13R1.132 CC(SC(N)=N)c1ccc(Cl)cc1 Amb22330488 [0,1,0,0,0,0|2,1,0]=4 749 B13R1.132 CC(SC(N)=N)c1ccc(Cl)cc1 Amb24113428 [0,1,0,0,0,0|2,1,0]=4 750 B13R1.132 CC(c1ccc(cc1)Br)CC(=O)N Amb17255957 [0,1,0,0,0,0|2,0,0]=3 751 B13R1.132 CC(c1ccc(cc1)Br)NC(=O)N Amb1077826 [0,1,0,0,0,0|2,0,0]=3 752 B13R1.132 CC(c1ccc(cc1)C)CC(=O)N Amb17233275 [0,1,0,0,0,0|2,0,0]=3 753 B13R1.132 CC(c1ccc(cc1)Cl)CC(=O)N Amb17236666 [0,1,0,0,0,0|2,0,0]=3 754 B13R1.132 CC(c1ccc(cc1)Cl)NC(=O)C Amb11014279 [0,1,0,0,0,0|1,0,0]=2 755 B13R1.132 CC(c1ccc(cc1)F)CC(=O)N Amb17233786 [0,1,0,0,0,0|2,0,0]=3 756 B13R1.132 CC(c1ccc(cc1)O)NC(=O)C Amb1068623 [0,1,0,0,0,0|1,0,0]=2 757 B13R1.132 CN(C)CC(C)c1ccc(Br)cc1 Amb24727329 [0,1,0,0,0,0|3,0,0]=4 758 B13R1.132 CN(C)CC(C)c1ccc(N)cc1 Amb24604559 [0,1,0,0,0,0|3,0,0]=4 759 B13R1.132 CN(C)NC(C)c1ccc(F)cc1 Amb25114838 [0,1,0,0,0,0|3,0,0]=4 760 B13R1.132 CN(C)NC(C)c1ccc(I)cc1 Amb25211134 [0,1,0,0,0,0|3,0,0]=4 761 B13R1.132 CN(C)NC(C)c1ccc(O)cc1 Amb25781444 [0,1,0,0,0,0|3,0,0]=4 762 B13R1.132 CN(CC(N)=O)c1ccc(F)cc1 Amb18181551 [0,1,0,0,0,0|3,0,0]=4 763 B13R1.132 CN(CC(N)=O)c1ccc(I)cc1 Amb24430727 [0,1,0,0,0,0|3,0,0]=4 764 B13R1.132 CN(CC(O)=O)c1ccc(I)cc1 Amb22967152 [0,1,0,0,0,0|3,0,0]=4 765 B13R1.132 CN(CC(O)=O)c1ccc(I)cc1 Amb25272259 [0,1,0,0,0,0|3,0,0]=4 766 B13R1.132 CN(CC(O)=O)c1ccc(N)cc1 Amb18990916 [0,1,0,0,0,0|3,0,0]=4 767 B13R1.132 CN(c1ccc(cc1)Br)CC(=O)O Amb17349669 [0,1,0,0,0,0|3,0,0]=4 768 B13R1.132 CN(c1ccc(cc1)C)CC(=O)O Amb17335310 [0,1,0,0,0,0|3,0,0]=4 769 B13R1.132 CN(c1ccc(cc1)Cl)CC(=O)O Amb17337480 [0,1,0,0,0,0|3,0,0]=4 770 B13R1.132 CN(c1ccc(cc1)F)CC(=O)O Amb17335598 [0,1,0,0,0,0|3,0,0]=4 771 B13R1.132 CN(c1ccc(cc1)O)CC(=O)Cl Amb17143226 [0,1,0,0,0,0|3,0,0]=4 772 B13R1.132 CN(c1ccc(cc1)O)CC(=O)N Amb17142984 [0,1,0,0,0,0|3,0,0]=4 773 B13R1.132 CS(=O)NC(C)c1ccc(Br)cc1 Amb25177330 [0,1,0,0,0,0|2,0,0]=3 774 B13R1.132 C[C@@H](CC(O)=O)c1ccc(F)cc1 Amb22226567 [0,1,0,0,0,0|2,0,0]=3 775 B13R1.132 C[C@@H](NC(N)=N)c1ccc(Br)cc1 Amb25685561 [0,1,0,0,0,0|3,0,0]=4 776 B13R1.132 C[C@@H](NC(N)=N)c1ccc(Cl)cc1 Amb25753050 [0,1,0,0,0,0|3,0,0]=4 777 B13R1.132 C[C@@H](NC(N)=O)c1ccc(Br)cc1 Amb24453036 [0,1,0,0,0,0|2,0,0]=3 778 B13R1.132 C[C@H](CC(O)=O)c1ccc(Cl)cc1 Amb25288141 [0,1,0,0,0,0|2,0,0]=3 779 B13R1.132 C[C@H](CC(O)=O)c1ccc(F)cc1 Amb22225229 [0,1,0,0,0,0|2,0,0]=3 780 B13R1.132 C[C@H](C[C@@H](C)O)c1ccc(F)cc1 Amb25753353 [0,1,0,0,0,0|1,0,2]=4 781 B13R1.132 C[C@H](NC(N)=N)c1ccc(Br)cc1 Amb24652920 [0,1,0,0,0,0|3,0,0]=4 782 B13R1.132 C[C@H](NC(N)=O)c1ccc(Br)cc1 Amb25761509 [0,1,0,0,0,0|2,0,0]=3 783 B13R1.132 C[C@H](NC(N)=S)c1ccc(F)cc1 Amb25707899 [0,1,0,0,0,0|2,1,0]=4 784 B13R1.132 C\C(=C/C(=O)Cl)\c1ccc(Cl)cc1 Amb24494317 [0,1,0,0,0,0|2,0,1]=4 785 B13R1.132 C\C(=C/C(O)=O)\c1ccc(O)cc1 Amb24557860 [0,1,0,0,0,0|2,0,1]=4 786 B13R1.132 C\C(=C\C(=O)Cl)\c1ccc(Cl)cc1 Amb24518597 [0,1,0,0,0,0|2,0,1]=4 787 B13R1.132 C\C(=C\C(=O)O)\c1ccc(cc1)F Amb10718082 [0,1,0,0,0,0|2,0,1]=4 788 B13R1.132 C\C(=C\C(C)=O)\c1ccc(F)c[n]1 Amb25142983 [0,1,0,0,0,0|2,0,1]=4 789 B13R1.132 C\C(=C\C(C)=O)\c1ccc(I)cc1 Amb25116184 [0,1,0,0,0,0|1,0,1]=3 790 B13R1.132 C\C(=C\C(O)=O)\c1ccc(Cl)cc1 Amb24381701 [0,1,0,0,0,0|2,0,1]=4 791 B13R1.132 C\C(=C\C(O)=O)\c1ccc(O)cc1 Amb25363379 [0,1,0,0,0,0|2,0,1]=4 792 B13R1.132 Cc1ccc([n]c1)C(C)CC(O)=O Amb25227823 [0,1,0,0,0,0|3,0,0]=4 793 B13R1.132 Cc1ccc(c[n]1)C(C)CC(N)=O Amb25706116 [0,1,0,0,0,0|3,0,0]=4 794 B13R1.132 Cc1ccc(c[n]1)C(C)OC(C)=O Amb24421695 [0,1,0,0,0,0|1,0,0]=2 795 B13R1.132 Cc1ccc(cc1)C(=C)NC(C)=O Amb25289157 [0,1,0,0,0,0|1,0,2]=4 796 B13R1.132 Cc1ccc(cc1)C(C)CC(C)Br Amb24601116 [0,1,0,0,0,0|2,0,1]=4 797 B13R1.132 Cc1ccc(cc1)C(C)CC(C)N Amb25247124 [0,1,0,0,0,0|2,0,1]=4 798 B13R1.132 Cc1ccc(cc1)C(C)CC(C)O Amb25129759 [0,1,0,0,0,0|1,0,2]=4 799 B13R1.132 Cc1ccc(cc1)C(C)NC(N)=N Amb18184207 [0,1,0,0,0,0|3,0,0]=4 800 B13R1.132 Cc1ccc(cc1)C(C)NC(N)=O Amb18180791 [0,1,0,0,0,0|2,0,0]=3 801 B13R1.132 Cc1ccc(cc1)C(C)NC(N)=S Amb19052001 [0,1,0,0,0,0|2,1,0]=4 802 B13R1.132 Cc1ccc(cc1)C(C)NN(C)C Amb24738823 [0,1,0,0,0,0|3,0,0]=4 803 B13R1.132 Cc1ccc(cc1)C(Cl)CC(O)=O Amb18118902 [0,1,0,0,0,0|3,0,0]=4 804 B13R1.132 Cc1ccc(cc1)C(Cl)OC(C)=O Amb25288087 [0,1,0,0,0,0|1,0,0]=2 805 B13R1.132 Cc1ccc(cc1)C(F)CC(O)=O Amb25276630 [0,1,0,0,0,0|3,0,0]=4 806 B13R1.132 Cc1ccc(cc1)C(N)CS(C)=O Amb25187932 [0,1,0,0,0,0|3,0,0]=4 807 B13R1.132 Cc1ccc(cc1)C(O)CC(C)=O Amb25821404 [0,1,0,0,0,0|2,0,0]=3 808 B13R1.132 Cc1ccc(cc1)N(C)CC(C)=C Amb25369268 [0,1,0,0,0,0|3,0,0]=4 809 B13R1.132 Cc1ccc(cc1)N(C)CC(C)=O Amb18178411 [0,1,0,0,0,0|2,0,0]=3 810 B13R1.132 Cc1ccc(cc1)N(C)CC(N)=O Amb18178561 [0,1,0,0,0,0|3,0,0]=4 811 B13R1.132 Cc1ccc(cc1)[C@@H](C)NC(N)=N Amb25241861 [0,1,0,0,0,0|3,0,0]=4 812 B13R1.132 Cc1ccc(cc1)[C@@H](N)CC(N)=O Amb18180796 [0,1,0,0,0,0|3,0,0]=4 813 B13R1.132 Cc1ccc(cc1)[C@@H](N)CC(O)=O Amb18180924 [0,1,0,0,0,0|3,0,0]=4 814 B13R1.132 Cc1ccc(cc1)[C@@H](O)CC(C)=C Amb25796385 [0,1,0,0,0,0|3,0,0]=4 815 B13R1.132 Cc1ccc(cc1)[C@@H](O)CC(C)=O Amb24424862 [0,1,0,0,0,0|2,0,0]=3 816 B13R1.132 Cc1ccc(cc1)[C@H](C)CC(C)=O Amb24691740 [0,1,0,0,0,0|1,0,0]=2 817 B13R1.132 Cc1ccc(cc1)[C@H](C)CC(O)=O Amb24373882 [0,1,0,0,0,0|2,0,0]=3 818 B13R1.132 Cc1ccc(cc1)[C@H](C)NC(C)=O Amb24375905 [0,1,0,0,0,0|1,0,0]=2 819 B13R1.132 Cc1ccc(cc1)[C@H](N)CC(N)=O Amb25678447 [0,1,0,0,0,0|3,0,0]=4 820 B13R1.132 Cc1ccc(cc1)[C@H](N)CC(O)=O Amb19515963 [0,1,0,0,0,0|3,0,0]=4 821 B13R1.132 Cc1ccc(cc1)\C(\C)=C/C(O)=O Amb25834975 [0,1,0,0,0,0|2,0,1]=4 822 B13R1.132 Cc1ccc(cc1)\C(\C)=C\C(O)=O Amb18015298 [0,1,0,0,0,0|2,0,1]=4 823 B13R1.132 Cc1ccc(cc1)\C(\N)=C/C(C)=O Amb25179218 [0,1,0,0,0,0|2,0,1]=4 824 B13R1.132 Cc1ccc(cc1)\C(\N)=C\C(C)=O Amb25784779 [0,1,0,0,0,0|2,0,1]=4 825 B13R1.132 NC(=O)CC(N)c1ccc(I)cc1 Amb24375705 [0,1,0,0,0,0|3,0,0]=4 826 B13R1.132 NC(=O)CC(N)c1ccc(O)cc1 Amb24493858 [0,1,0,0,0,0|3,0,0]=4 827 B13R1.132 NC(=O)CC(O)c1ccc(F)cc1 Amb25375782 [0,1,0,0,0,0|3,0,0]=4 828 B13R1.132 NC(=O)C[C@@H](N)c1ccc(Cl)cc1 Amb18322119 [0,1,0,0,0,0|3,0,0]=4 829 B13R1.132 NC(=O)C[C@@H](N)c1ccc(F)cc1 Amb18796564 [0,1,0,0,0,0|3,0,0]=4 830 B13R1.132 NC(=O)C[C@@H](N)c1ccc(F)cc1 Amb20622804 [0,1,0,0,0,0|3,0,0]=4 831 B13R1.132 NC(=O)C[C@@H](N)c1ccc(I)cc1 Amb25835548 [0,1,0,0,0,0|3,0,0]=4 832 B13R1.132 NC(=O)C[C@H](N)c1ccc(Cl)cc1 Amb24271245 [0,1,0,0,0,0|3,0,0]=4 833 B13R1.132 NC(=O)C[C@H](N)c1ccc(F)cc1 Amb24271246 [0,1,0,0,0,0|3,0,0]=4 834 B13R1.132 NC(=O)C[C@H](N)c1ccc(F)cc1 Amb25209402 [0,1,0,0,0,0|3,0,0]=4 835 B13R1.132 NC(=O)C[C@H](O)c1ccc(F)cc1 Amb24698625 [0,1,0,0,0,0|3,0,0]=4 836 B13R1.132 NC(CC(O)=O)c1ccc(F)cc1 Amb17659135 [0,1,0,0,0,0|3,0,0]=4 837 B13R1.132 NC(c1ccc(cc1)Br)CC(=O)O Amb1058721 [0,1,0,0,0,0|3,0,0]=4 838 B13R1.132 NC(c1ccc(cc1)C)CC(=O)O Amb1207929 [0,1,0,0,0,0|3,0,0]=4 839 B13R1.132 NC(c1ccc(cc1)Cl)CC(=O)O Amb10819774 [0,1,0,0,0,0|3,0,0]=4 840 B13R1.132 NC(c1ccc(cc1)Cl)CC(=O)O Amb2569623 [0,1,0,0,0,0|3,0,0]=4 841 B13R1.132 NC(c1ccc(cc1)Cl)CC(=O)[O-] Amb15695765 [0,1,0,0,0,0|3,0,0]=4 842 B13R1.132 NC(c1ccc(cc1)F)CC(=O)O Amb1048098 [0,1,0,0,0,0|3,0,0]=4 843 B13R1.132 N[C@@H](CC(O)=O)c1ccc(Br)cc1 Amb19373087 [0,1,0,0,0,0|3,0,0]=4 844 B13R1.132 N[C@@H](CC(O)=O)c1ccc(Br)cc1 Amb19888496 [0,1,0,0,0,0|3,0,0]=4 845 B13R1.132 N[C@@H](CC(O)=O)c1ccc(Cl)cc1 Amb18319936 [0,1,0,0,0,0|3,0,0]=4 846 B13R1.132 N[C@@H](CC(O)=O)c1ccc(I)cc1 Amb24598206 [0,1,0,0,0,0|3,0,0]=4 847 B13R1.132 N[C@@H](CC(O)=O)c1ccc(O)cc1 Amb20240751 [0,1,0,0,0,0|3,0,0]=4 848 B13R1.132 N[C@@H](CC(O)=O)c1ccc(O)cc1 Amb22226646 [0,1,0,0,0,0|3,0,0]=4 849 B13R1.132 N[C@H](CC(O)=O)c1ccc(Br)cc1 Amb19887643 [0,1,0,0,0,0|3,0,0]=4 850 B13R1.132 N[C@H](CC(O)=O)c1ccc(Cl)cc1 Amb19887651 [0,1,0,0,0,0|3,0,0]=4 851 B13R1.132 N[C@H](CC(O)=O)c1ccc(F)cc1 Amb19515820 [0,1,0,0,0,0|3,0,0]=4 852 B13R1.132 N[C@H](CC(O)=O)c1ccc(O)cc1 Amb20240752 [0,1,0,0,0,0|3,0,0]=4 853 B13R1.132 N[C@H](CC(O)=O)c1ccc(O)cc1 Amb20240880 [0,1,0,0,0,0|3,0,0]=4 854 B13R1.132 N[C@H](c1ccc(cc1)F)CC(=O)O Amb10603269 [0,1,0,0,0,0|3,0,0]=4 855 B13R1.132 Nc1ccc(cc1)C(O)CC(O)=O Amb25701810 [0,1,0,0,0,0|3,0,0]=4 856 B13R1.132 Nc1ccc(cc1)[C@@H](O)CC(O)=O Amb24605524 [0,1,0,0,0,0|3,0,0]=4 857 B13R1.132 OC(=O)CC(Cl)c1ccc(Br)cc1 Amb18120421 [0,1,0,0,0,0|3,0,0]=4 858 B13R1.132 OC(=O)CC(Cl)c1ccc(Cl)cc1 Amb18120422 [0,1,0,0,0,0|3,0,0]=4 859 B13R1.132 OC(=O)CC(Cl)c1ccc(F)cc1 Amb18120423 [0,1,0,0,0,0|3,0,0]=4 860 B13R1.132 OC(=O)CC(F)c1ccc(F)cc1 Amb25376047 [0,1,0,0,0,0|3,0,0]=4 861 B13R1.132 OC(=O)CC(c1ccc(cc1)O)N Amb2438716 [0,1,0,0,0,0|3,0,0]=4 862 B13R1.132 OC(=O)C[C@@H](O)c1ccc(Cl)cc1 Amb24417996 [0,1,0,0,0,0|3,0,0]=4 863 B13R1.132 OC(=O)C[C@H](O)c1ccc(Cl)cc1 Amb24759116 [0,1,0,0,0,0|3,0,0]=4 864 B13R1.132 OC(=O)C[C@H](O)c1ccc(F)cc1 Amb24373818 [0,1,0,0,0,0|3,0,0]=4 865 B13R1.132 OC(c1ccc(cc1)C)CC(=O)O Amb17233660 [0,1,0,0,0,0|3,0,0]=4 866 B13R1.132 OC(c1ccc(cc1)Cl)CC(=O)O Amb17237174 [0,1,0,0,0,0|3,0,0]=4 867 B13R1.132 OC(c1ccc(cc1)F)CC(=O)O Amb17234055 [0,1,0,0,0,0|3,0,0]=4 868 B13R1.132 Oc1ccc(cc1)C(Cl)CC(O)=O Amb24490476 [0,1,0,0,0,0|3,0,0]=4 869 B13R1.132 Oc1ccc(cc1)C(O)CC(O)=O Amb18298162 [0,1,0,0,0,0|3,0,0]=4 870 B13R1.132 Oc1ccc(cc1)[C@@H](O)CC(O)=O Amb25228482 [0,1,0,0,0,0|3,0,0]=4 871 B13R1.147 CC(=C)CC(Cl)c1cc(Cl)ccc1 Amb25278291 [0,1,0,0,0,0|3,0,0]=4 872 B13R1.147 CC(=C)CC(N)c1cccc(Br)c1 Amb24436151 [0,1,0,0,0,0|3,0,0]=4 873 B13R1.147 CC(=C)CC(N)c1cccc(Cl)c1 Amb25833922 [0,1,0,0,0,0|3,0,0]=4 874 B13R1.147 CC(=C)CC(N)c1cccc(F)c1 Amb24689876 [0,1,0,0,0,0|3,0,0]=4 875 B13R1.147 CC(=C)CC(N)c1cccc(I)c1 Amb25161348 [0,1,0,0,0,0|3,0,0]=4 876 B13R1.147 CC(=C)CC(O)c1cccc(Br)c1 Amb25052701 [0,1,0,0,0,0|3,0,0]=4 877 B13R1.147 CC(=C)CC(O)c1cccc(Cl)c1 Amb24655318 [0,1,0,0,0,0|3,0,0]=4 878 B13R1.147 CC(=C)CC(O)c1cccc(I)c1 Amb25345270 [0,1,0,0,0,0|3,0,0]=4 879 B13R1.147 CC(=C)CC(O)c1cccc(N)c1 Amb25753367 [0,1,0,0,0,0|3,0,0]=4 880 B13R1.147 CC(=C)CN(C)c1cccc(F)c1 Amb24632835 [0,1,0,0,0,0|3,0,0]=4 881 B13R1.147 CC(=C)C[C@@H](N)c1cccc(I)c1 Amb25252214 [0,1,0,0,0,0|3,0,0]=4 882 B13R1.147 CC(=N)NC(C)c1cccc(Br)c1 Amb25128441 [0,1,0,0,0,0|2,0,0]=3 883 B13R1.147 CC(=O)CC(=O)c1cc(C)ccc1 Amb18178269 [0,1,0,0,0,0|2,0,1]=4 884 B13R1.147 CC(=O)CC(=O)c1cc(O)ccc1 Amb24351620 [0,1,0,0,0,0|2,0,1]=4 885 B13R1.147 CC(=O)CC(C)c1c[n]cc(F)c1 Amb24465169 [0,1,0,0,0,0|2,0,0]=3 886 B13R1.147 CC(=O)CC(C)c1cccc(F)c1 Amb25719077 [0,1,0,0,0,0|1,0,0]=2 887 B13R1.147 CC(=O)CC(O)c1cccc(Br)c1 Amb24464735 [0,1,0,0,0,0|2,0,0]=3 888 B13R1.147 CC(=O)CC(O)c1cccc(F)c1 Amb25369345 [0,1,0,0,0,0|2,0,0]=3 889 B13R1.147 CC(=O)CN(C)c1cccc(F)c1 Amb18791228 [0,1,0,0,0,0|2,0,0]=3 890 B13R1.147 CC(=O)CS(=O)c1cccc(Br)c1 Amb25678271 [0,1,0,0,0,0|3,0,0]=4 891 B13R1.147 CC(=O)CS(=O)c1cccc(F)c1 Amb25136925 [0,1,0,0,0,0|3,0,0]=4 892 B13R1.147 CC(=O)C[C@H](O)c1cccc(Br)c1 Amb24593557 [0,1,0,0,0,0|2,0,0]=3 893 B13R1.147 CC(=O)C[C@H](O)c1cccc(Cl)c1 Amb24533369 [0,1,0,0,0,0|2,0,0]=3 894 B13R1.147 CC(=O)NC(=C)c1cccc(Cl)c1 Amb24341197 [0,1,0,0,0,0|1,0,2]=4 895 B13R1.147 CC(=O)NC(=C)c1cccc(F)c1 Amb25709701 [0,1,0,0,0,0|1,0,2]=4 896 B13R1.147 CC(=O)NC(=O)c1cc(Cl)ccc1 Amb25119296 [0,1,0,0,0,0|2,0,1]=4 897 B13R1.147 CC(=O)NC(=O)c1cc(I)ccc1 Amb25690669 [0,1,0,0,0,0|2,0,1]=4 898 B13R1.147 CC(=O)NC(C)c1c[n]cc(F)c1 Amb25668869 [0,1,0,0,0,0|2,0,0]=3 899 B13R1.147 CC(=O)NC(C)c1cc(Br)cc[n]1 Amb25196066 [0,1,0,0,0,0|2,0,0]=3 900 B13R1.147 CC(=O)NC(C)c1cc(N)ccc1 Amb21959592 [0,1,0,0,0,0|1,0,0]=2 901 B13R1.147 CC(=O)NC(C)c1cccc(O)c1 Amb25823431 [0,1,0,0,0,0|1,0,0]=2 902 B13R1.147 CC(=O)NC(c1cccc(c1)Br)C Amb14005116 [0,1,0,0,0,0|1,0,0]=2 903 B13R1.147 CC(=O)NC(c1cccc(c1)Cl)C Amb10666947 [0,1,0,0,0,0|1,0,0]=2 904 B13R1.147 CC(=O)NC(c1cccc(c1)F)C Amb10667278 [0,1,0,0,0,0|1,0,0]=2 905 B13R1.147 CC(=O)NC(c1cccc(c1)N)C Amb1089732 [0,1,0,0,0,0|1,0,0]=2 906 B13R1.147 CC(=O)NC(c1cccc(c1)N)C Amb2099817 [0,1,0,0,0,0|1,0,0]=2 907 B13R1.147 CC(=O)N[C@@H](C)c1cccc(Br)c1 Amb25787630 [0,1,0,0,0,0|1,0,0]=2 908 B13R1.147 CC(=O)N[C@@H](C)c1cccc(F)c1 Amb24354509 [0,1,0,0,0,0|1,0,0]=2 909 B13R1.147 CC(=O)N[C@@H](C)c1cccc(O)c1 Amb24529355 [0,1,0,0,0,0|1,0,0]=2 910 B13R1.147 CC(=O)N[C@H](C)c1cc(Cl)cc[n]1 Amb24358772 [0,1,0,0,0,0|2,0,0]=3 911 B13R1.147 CC(=O)OC(C)c1[n]c(Cl)cc[n]1 Amb24490650 [0,1,0,0,0,0|2,0,0]=3 912 B13R1.147 CC(=O)OC(C)c1cccc(O)c1 Amb25712940 [0,1,0,0,0,0|0,0,0]=1 913 B13R1.147 CC(=O)O[C@@H](C)c1cccc(Br)c1 Amb24720583 [0,1,0,0,0,0|0,0,0]=1 914 B13R1.147 CC(=O)O[C@@H](C)c1cccc(F)c1 Amb24525305 [0,1,0,0,0,0|0,0,0]=1 915 B13R1.147 CC(=O)O[C@H](C)c1cccc(O)c1 Amb24364063 [0,1,0,0,0,0|0,0,0]=1 916 B13R1.147 CC(=O)\C=C(/N)\c1cc(N)ccc1 Amb24492707 [0,1,0,0,0,0|2,0,1]=4 917 B13R1.147 CC(=O)\C=C(\N)/c1cc(N)ccc1 Amb25138650 [0,1,0,0,0,0|2,0,1]=4 918 B13R1.147 CC(C)=CC(N)c1cccc(Br)c1 Amb25085416 [0,1,0,0,0,0|3,0,0]=4 919 B13R1.147 CC(C)=CC(N)c1cccc(I)c1 Amb25328336 [0,1,0,0,0,0|3,0,0]=4 920 B13R1.147 CC(C)=CC(O)c1cc(C)ccc1 Amb25035369 [0,1,0,0,0,0|3,0,0]=4 921 B13R1.147 CC(C)=CC(O)c1cccc(F)c1 Amb24736568 [0,1,0,0,0,0|3,0,0]=4 922 B13R1.147 CC(C)=CC(O)c1cccc(I)c1 Amb24439820 [0,1,0,0,0,0|3,0,0]=4 923 B13R1.147 CC(C)NC(C)c1cccc(N)c1 Amb24489399 [0,1,0,0,0,0|2,0,1]=4 924 B13R1.147 CC(C)N[C@@H](C)c1cccc(Cl)c1 Amb24534087 [0,1,0,0,0,0|2,0,1]=4 925 B13R1.147 CC(C)N[C@@H](C)c1cccc(O)c1 Amb25822828 [0,1,0,0,0,0|2,0,1]=4 926 B13R1.147 CC(C)N[C@H](C)c1cccc(Br)c1 Amb24688533 [0,1,0,0,0,0|2,0,1]=4 927 B13R1.147 CC(C)N[C@H](C)c1cccc(Cl)c1 Amb24705060 [0,1,0,0,0,0|2,0,1]=4 928 B13R1.147 CC(C)N[C@H](C)c1cccc(F)c1 Amb25044122 [0,1,0,0,0,0|2,0,1]=4 929 B13R1.147 CC(C)N[C@H](C)c1cccc(O)c1 Amb24473864 [0,1,0,0,0,0|2,0,1]=4 930 B13R1.147 CC(C)OC(C)c1cccc(N)c1 Amb18292843 [0,1,0,0,0,0|1,0,1]=3 931 B13R1.147 CC(C)SC(C)c1cccc(Cl)c1 Amb24473865 [0,1,0,0,0,0|1,1,1]=4 932 B13R1.147 CC(C)SC(C)c1cccc(N)c1 Amb18973996 [0,1,0,0,0,0|1,1,1]=4 933 B13R1.147 CC(CC(C)N)c1cc(Cl)ccc1 Amb25815215 [0,1,0,0,0,0|2,0,1]=4 934 B13R1.147 CC(CC(C)O)c1cc(Cl)ccc1 Amb25852925 [0,1,0,0,0,0|1,0,2]=4 935 B13R1.147 CC(CC(O)=O)c1c[n]cc(F)c1 Amb24444159 [0,1,0,0,0,0|3,0,0]=4 936 B13R1.147 CC(CC(O)=O)c1cc(O)ccc1 Amb18128622 [0,1,0,0,0,0|2,0,0]=3 937 B13R1.147 CC(NC(N)=N)c1cccc(Br)c1 Amb19308493 [0,1,0,0,0,0|3,0,0]=4 938 B13R1.147 CC(NC(N)=N)c1cccc(Cl)c1 Amb18325440 [0,1,0,0,0,0|3,0,0]=4 939 B13R1.147 CC(NC(N)=N)c1cccc(F)c1 Amb18805224 [0,1,0,0,0,0|3,0,0]=4 940 B13R1.147 CC(NC(N)=N)c1cccc(O)c1 Amb24753119 [0,1,0,0,0,0|3,0,0]=4 941 B13R1.147 CC(NC(N)=O)c1c[n]cc(F)c1 Amb24576826 [0,1,0,0,0,0|3,0,0]=4 942 B13R1.147 CC(NC(N)=O)c1cc[n]c(F)c1 Amb25167519 [0,1,0,0,0,0|3,0,0]=4 943 B13R1.147 CC(NC(N)=O)c1cccc(Br)c1 Amb25804473 [0,1,0,0,0,0|2,0,0]=3 944 B13R1.147 CC(NC(N)=O)c1cccc(Cl)c1 Amb19088728 [0,1,0,0,0,0|2,0,0]=3 945 B13R1.147 CC(NC(N)=O)c1cccc(F)c1 Amb18809707 [0,1,0,0,0,0|2,0,0]=3 946 B13R1.147 CC(NC(N)=S)c1cccc(F)c1 Amb19055169 [0,1,0,0,0,0|2,1,0]=4 947 B13R1.147 CN(C)NC(C)c1cccc(Br)c1 Amb24529684 [0,1,0,0,0,0|3,0,0]=4 948 B13R1.147 CN(C)NC(C)c1cccc(Cl)c1 Amb24357904 [0,1,0,0,0,0|3,0,0]=4 949 B13R1.147 CN(CC(N)=O)c1cccc(Cl)c1 Amb25247255 [0,1,0,0,0,0|3,0,0]=4 950 B13R1.147 CN(CC(N)=O)c1cccc(F)c1 Amb18179265 [0,1,0,0,0,0|3,0,0]=4 951 B13R1.147 CN(CC(N)=O)c1cccc(O)c1 Amb24719255 [0,1,0,0,0,0|3,0,0]=4 952 B13R1.147 CN(CC(O)=O)c1cc(O)ccc1 Amb24368102 [0,1,0,0,0,0|3,0,0]=4 953 B13R1.147 CN(CC(O)=O)c1cccc(Br)c1 Amb24458433 [0,1,0,0,0,0|3,0,0]=4 954 B13R1.147 CN(CC(O)=O)c1cccc(N)c1 Amb18987695 [0,1,0,0,0,0|3,0,0]=4 955 B13R1.147 CS(=O)CC(O)c1cccc(Cl)c1 Amb22446270 [0,1,0,0,0,0|3,0,0]=4 956 B13R1.147 CS(=O)NC(C)c1cccc(N)c1 Amb24536641 [0,1,0,0,0,0|2,0,0]=3 957 B13R1.147 CS(=O)NC(C)c1cccc(O)c1 Amb25177265 [0,1,0,0,0,0|2,0,0]=3 958 B13R1.147 C[C@@H](NC(N)=N)c1cccc(Br)c1 Amb25095408 [0,1,0,0,0,0|3,0,0]=4 959 B13R1.147 C[C@H](NC(N)=N)c1cccc(Cl)c1 Amb25685556 [0,1,0,0,0,0|3,0,0]=4 960 B13R1.147 C[C@H](NC(N)=N)c1cccc(F)c1 Amb24564162 [0,1,0,0,0,0|3,0,0]=4 961 B13R1.147 C[C@H](NC(N)=O)c1cccc(O)c1 Amb24421523 [0,1,0,0,0,0|2,0,0]=3 962 B13R1.147 C\C(=C/C(C)=O)\c1cc(F)ccc1 Amb25730112 [0,1,0,0,0,0|1,0,1]=3 963 B13R1.147 C\C(=C/C(O)=O)\c1cc(O)ccc1 Amb25059689 [0,1,0,0,0,0|2,0,1]=4 964 B13R1.147 C\C(=C\C(=O)Cl)\c1cc(Cl)ccc1 Amb24518598 [0,1,0,0,0,0|2,0,1]=4 965 B13R1.147 C\C(=C\C(C)=O)\c1cc(F)ccc1 Amb24551107 [0,1,0,0,0,0|1,0,1]=3 966 B13R1.147 C\C(=C\C(O)=O)\c1cc(O)ccc1 Amb24602458 [0,1,0,0,0,0|2,0,1]=4 967 B13R1.147 C\C(=C\C(O)=O)\c1cccc(Br)c1 Amb25095576 [0,1,0,0,0,0|2,0,1]=4 968 B13R1.147 C\C(=C\C(O)=O)\c1cccc(Cl)c1 Amb22058696 [0,1,0,0,0,0|2,0,1]=4 969 B13R1.147 C\C(=C\C(O)=O)\c1cccc(F)c1 Amb24271262 [0,1,0,0,0,0|2,0,1]=4 970 B13R1.147 Cc1cc(ccc1)N(C)CC(N)=O Amb18178560 [0,1,0,0,0,0|3,0,0]=4 971 B13R1.147 Cc1cc(ccc1)[C@@H](C)CC(O)=O Amb24391487 [0,1,0,0,0,0|2,0,0]=3 972 B13R1.147 Cc1cc(ccc1)[C@@H](N)CC(N)=O Amb18180794 [0,1,0,0,0,0|3,0,0]=4 973 B13R1.147 Cc1cc(ccc1)[C@@H](N)CC(O)=O Amb18180922 [0,1,0,0,0,0|3,0,0]=4 974 B13R1.147 Cc1cc(ccc1)[C@H](C)CC(O)=O Amb25774483 [0,1,0,0,0,0|2,0,0]=3 975 B13R1.147 Cc1cc(ccc1)[C@H](C)NC(N)=N Amb25691063 [0,1,0,0,0,0|3,0,0]=4 976 B13R1.147 Cc1cc(ccc1)[C@H](N)CC(O)=O Amb19888387 [0,1,0,0,0,0|3,0,0]=4 977 B13R1.147 Cc1cccc([n]1)C(C)CC(N)=O Amb24370061 [0,1,0,0,0,0|3,0,0]=4 978 B13R1.147 Cc1cccc([n]1)[C@H](C)OC(C)=O Amb24631925 [0,1,0,0,0,0|1,0,0]=2 979 B13R1.147 Cc1cccc(c1)C(C)CC(C)=O Amb24430310 [0,1,0,0,0,0|1,0,0]=2 980 B13R1.147 Cc1cccc(c1)C(C)CC(C)N Amb25098579 [0,1,0,0,0,0|2,0,1]=4 981 B13R1.147 Cc1cccc(c1)C(C)CC(C)O Amb25296262 [0,1,0,0,0,0|1,0,2]=4 982 B13R1.147 Cc1cccc(c1)C(C)OC(C)=O Amb24530231 [0,1,0,0,0,0|0,0,0]=1 983 B13R1.147 Cc1cccc(c1)C(O)CC(C)=O Amb25298405 [0,1,0,0,0,0|2,0,0]=3 984 B13R1.147 Cc1cccc(c1)N(C)CC(C)=O Amb18178409 [0,1,0,0,0,0|2,0,0]=3 985 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)=O Amb25099533 [0,1,0,0,0,0|1,0,0]=2 986 B13R1.147 Cc1cccc(c1)[C@@H](C)NC(C)C Amb25789175 [0,1,0,0,0,0|2,0,1]=4 987 B13R1.147 Cc1cccc(c1)[C@H](C)OC(C)=O Amb25115848 [0,1,0,0,0,0|0,0,0]=1 988 B13R1.147 NC(=O)CC(O)c1cccc(F)c1 Amb24555372 [0,1,0,0,0,0|3,0,0]=4 989 B13R1.147 NC(=O)CC(c1cccc(c1)C)C Amb17233288 [0,1,0,0,0,0|2,0,0]=3 990 B13R1.147 NC(=O)CC(c1cccc(c1)Cl)C Amb17236669 [0,1,0,0,0,0|2,0,0]=3 991 B13R1.147 NC(=O)CC(c1cccc(c1)F)C Amb17233790 [0,1,0,0,0,0|2,0,0]=3 992 B13R1.147 NC(=O)C[C@@H](N)c1cccc(Br)c1 Amb25827716 [0,1,0,0,0,0|3,0,0]=4 993 B13R1.147 NC(=O)C[C@@H](N)c1cccc(Cl)c1 Amb18322120 [0,1,0,0,0,0|3,0,0]=4 994 B13R1.147 NC(=O)C[C@@H](N)c1cccc(F)c1 Amb18181553 [0,1,0,0,0,0|3,0,0]=4 995 B13R1.147 NC(=O)C[C@H](N)c1cccc(Br)c1 Amb25733375 [0,1,0,0,0,0|3,0,0]=4 996 B13R1.147 NC(=O)C[C@H](N)c1cccc(Cl)c1 Amb24271244 [0,1,0,0,0,0|3,0,0]=4 997 B13R1.147 N[C@@H](CC(O)=O)c1cc(O)ccc1 Amb19888391 [0,1,0,0,0,0|3,0,0]=4 998 B13R1.147 N[C@@H](CC(O)=O)c1cccc(Cl)c1 Amb18319937 [0,1,0,0,0,0|3,0,0]=4 999 B13R1.147 N[C@@H](CC(O)=O)c1cccc(F)c1 Amb19057058 [0,1,0,0,0,0|3,0,0]=4 1000 B13R1.147 N[C@@H](CC(O)=O)c1cccc(F)c1 Amb23401394 [0,1,0,0,0,0|3,0,0]=4 1001 B13R1.147 N[C@H](CC(O)=O)c1cc(O)ccc1 Amb19887673 [0,1,0,0,0,0|3,0,0]=4 1002 B13R1.147 N[C@H](CC(O)=O)c1cccc(Br)c1 Amb19887637 [0,1,0,0,0,0|3,0,0]=4 1003 B13R1.147 N[C@H](CC(O)=O)c1cccc(Cl)c1 Amb19887655 [0,1,0,0,0,0|3,0,0]=4 1004 B13R1.147 N[C@H](CC(O)=O)c1cccc(F)c1 Amb19887666 [0,1,0,0,0,0|3,0,0]=4 1005 B13R1.147 N[C@H](CC(O)=O)c1cccc(I)c1 Amb25742482 [0,1,0,0,0,0|3,0,0]=4 1006 B13R1.147 Nc1cc(ccc1)C(F)CC(O)=O Amb25249468 [0,1,0,0,0,0|3,0,0]=4 1007 B13R1.147 Nc1cc(ccc1)C(N)CC(O)=O Amb25043228 [0,1,0,0,0,0|3,0,0]=4 1008 B13R1.147 Nc1cc(ccc1)[C@H](N)CC(O)=O Amb25276953 [0,1,0,0,0,0|3,0,0]=4 1009 B13R1.147 OC(=O)CC(Cl)c1cccc(Br)c1 Amb18120449 [0,1,0,0,0,0|3,0,0]=4 1010 B13R1.147 OC(=O)CC(c1cccc(c1)Br)C Amb10844377 [0,1,0,0,0,0|2,0,0]=3 1011 B13R1.147 OC(=O)CC(c1cccc(c1)Br)N Amb1023435 [0,1,0,0,0,0|3,0,0]=4 1012 B13R1.147 OC(=O)CC(c1cccc(c1)C)C Amb17233412 [0,1,0,0,0,0|2,0,0]=3 1013 B13R1.147 OC(=O)CC(c1cccc(c1)C)N Amb2435883 [0,1,0,0,0,0|3,0,0]=4 1014 B13R1.147 OC(=O)CC(c1cccc(c1)C)O Amb17233659 [0,1,0,0,0,0|3,0,0]=4 1015 B13R1.147 OC(=O)CC(c1cccc(c1)Cl)C Amb17236836 [0,1,0,0,0,0|2,0,0]=3 1016 B13R1.147 OC(=O)CC(c1cccc(c1)Cl)N Amb1068288 [0,1,0,0,0,0|3,0,0]=4 1017 B13R1.147 OC(=O)CC(c1cccc(c1)Cl)O Amb17237173 [0,1,0,0,0,0|3,0,0]=4 1018 B13R1.147 OC(=O)CC(c1cccc(c1)F)N Amb1202468 [0,1,0,0,0,0|3,0,0]=4 1019 B13R1.147 OC(=O)CC(c1cccc(c1)F)O Amb17234054 [0,1,0,0,0,0|3,0,0]=4 1020 B13R1.147 OC(=O)CC(c1cccc(c1)I)N Amb1048649 [0,1,0,0,0,0|3,0,0]=4 1021 B13R1.147 OC(=O)CC(c1cccc(c1)O)N Amb1058829 [0,1,0,0,0,0|3,0,0]=4 1022 B13R1.147 OC(=O)CN(c1cccc(c1)Br)C Amb17349671 [0,1,0,0,0,0|3,0,0]=4 1023 B13R1.147 OC(=O)CN(c1cccc(c1)C)C Amb17335309 [0,1,0,0,0,0|3,0,0]=4 1024 B13R1.147 OC(=O)CN(c1cccc(c1)Cl)C Amb17337479 [0,1,0,0,0,0|3,0,0]=4 1025 B13R1.147 OC(=O)CN(c1cccc(c1)F)C Amb17335599 [0,1,0,0,0,0|3,0,0]=4 1026 B13R1.147 OC(=O)C[C@H](O)c1cccc(Cl)c1 Amb24444374 [0,1,0,0,0,0|3,0,0]=4 1027 B13R1.147 OC(=O)\C=C(\c1cccc(c1)C)/C Amb17233185 [0,1,0,0,0,0|2,0,1]=4 1028 B13R1.147 OC(=O)\C=C(\c1cccc(c1)Cl)/C Amb17236497 [0,1,0,0,0,0|2,0,1]=4 1029 B13R1.147 OC(=O)\C=C(\c1cccc(c1)F)/C Amb17233655 [0,1,0,0,0,0|2,0,1]=4 1030 B13R1.147 Oc1cccc(c1)C(O)CC(O)=O Amb18990574 [0,1,0,0,0,0|3,0,0]=4 1031 B13R1.147 [O-]C(=O)CC(c1cccc(c1)Br)N Amb11038264 [0,1,0,0,0,0|3,0,0]=4 1032 B13R1.152 BrC(C(C(=O)O)O)c1ccccc1 Amb17596766 [0,1,0,0,0,0|3,0,0]=4 1033 B13R1.152 C=C(C(O)c1ccccc1)C(N)=O Amb24692881 [0,1,0,0,0,0|3,0,0]=4 1034 B13R1.152 C=C([C@H](N)c1ccccc1)C(O)=O Amb25697157 [0,1,0,0,0,0|3,0,0]=4 1035 B13R1.152 CC(=C)C(=C)C(O)c1ccccc1 Amb25781853 [0,1,0,0,0,0|3,0,0]=4 1036 B13R1.152 CC(=C)C(=O)C(N)c1ccccc1 Amb25153483 [0,1,0,0,0,0|3,0,0]=4 1037 B13R1.152 CC(=C)C(=O)C(O)c1ccccc1 Amb25807562 [0,1,0,0,0,0|3,0,0]=4 1038 B13R1.152 CC(=C)C(=O)[C@H](N)c1ccccc1 Amb25155665 [0,1,0,0,0,0|3,0,0]=4 1039 B13R1.152 CC(=C)C(C)C(O)c1ccccc1 Amb24495101 [0,1,0,0,0,0|3,0,0]=4 1040 B13R1.152 CC(=C)C(N)C(C)c1ccccc1 Amb25180112 [0,1,0,0,0,0|2,0,0]=3 1041 B13R1.152 CC(=C)[C@@H](O)[C@@H](C)c1ccccc1 Amb25092087 [0,1,0,0,0,0|2,0,0]=3 1042 B13R1.152 CC(=N)N(C)C(C)c1ccccc1 Amb25258088 [0,1,0,0,0,0|2,0,0]=3 1043 B13R1.152 CC(=O)C(=C)C(O)c1cccc[n]1 Amb24544624 [0,1,0,0,0,0|3,0,0]=4 1044 B13R1.152 CC(=O)C(=C)[C@@H](O)c1ccccc1 Amb24370174 [0,1,0,0,0,0|2,0,0]=3 1045 B13R1.152 CC(=O)C(=O)C(=O)c1ccccc1 Amb25092958 [0,1,0,0,0,0|2,0,1]=4 1046 B13R1.152 CC(=O)C(=O)C(C)c1ccccc1 Amb24492525 [0,1,0,0,0,0|1,0,0]=2 1047 B13R1.152 CC(=O)C(C)C(=C)c1ccccc1 Amb24492728 [0,1,0,0,0,0|1,0,2]=4 1048 B13R1.152 CC(=O)C(C)C(C)c1ccccc1 Amb25087204 [0,1,0,0,0,0|1,0,0]=2 1049 B13R1.152 CC(=O)C(C)C(N)c1ccccc1 Amb25041504 [0,1,0,0,0,0|2,0,0]=3 1050 B13R1.152 CC(=O)C(C)C(O)c1c[n]ccc1 Amb25729242 [0,1,0,0,0,0|3,0,0]=4 1051 B13R1.152 CC(=O)C(C)N(O)c1ccccc1 Amb25838746 [0,1,0,0,0,0|3,0,0]=4 1052 B13R1.152 CC(=O)C(Cl)C(=O)c1ccccc1 Amb25210855 [0,1,0,0,0,0|2,0,1]=4 1053 B13R1.152 CC(=O)C(Cl)C(N)c1ccccc1 Amb25300345 [0,1,0,0,0,0|2,0,0]=3 1054 B13R1.152 CC(=O)C(F)C(=O)c1ccccc1 Amb25816142 [0,1,0,0,0,0|2,0,1]=4 1055 B13R1.152 CC(=O)C(N)C(O)c1ccccc1 Amb25066908 [0,1,0,0,0,0|2,0,0]=3 1056 B13R1.152 CC(=O)C(O)C(=O)c1ccccc1 Amb24467013 [0,1,0,0,0,0|2,0,1]=4 1057 B13R1.152 CC(=O)N(C)C(=C)c1ccccc1 Amb25350858 [0,1,0,0,0,0|1,0,2]=4 1058 B13R1.152 CC(=O)N(C)C(C)c1cc[n]cc1 Amb25731267 [0,1,0,0,0,0|2,0,0]=3 1059 B13R1.152 CC(=O)N(C)C(C)c1cccc[n]1 Amb25120520 [0,1,0,0,0,0|2,0,0]=3 1060 B13R1.152 CC(=O)N(C)C(C)c1ccccc1 Amb25731265 [0,1,0,0,0,0|1,0,0]=2 1061 B13R1.152 CC(=O)N(C)C(Cl)c1ccccc1 Amb25772765 [0,1,0,0,0,0|2,0,0]=3 1062 B13R1.152 CC(=O)N(O)C(=O)c1ccccc1 Amb24073570 [0,1,0,0,0,0|2,0,1]=4 1063 B13R1.152 CC(=O)[C@@H](C)C(=O)c1ccccc1 Amb25729157 [0,1,0,0,0,0|2,0,1]=4 1064 B13R1.152 CC(=O)[C@@H](C)[C@@H](C)c1ccccc1 Amb25086639 [0,1,0,0,0,0|1,0,0]=2 1065 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1cccc[n]1 Amb24432173 [0,1,0,0,0,0|3,0,0]=4 1066 B13R1.152 CC(=O)[C@@H](C)[C@@H](O)c1ccccc1 Amb24467544 [0,1,0,0,0,0|2,0,0]=3 1067 B13R1.152 CC(=O)[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb25290208 [0,1,0,0,0,0|2,0,0]=3 1068 B13R1.152 CC(=O)[C@@H](O)[C@@H](O)c1ccccc1 Amb24704823 [0,1,0,0,0,0|2,0,0]=3 1069 B13R1.152 CC(=O)[C@H](C)[C@H](O)c1ccccc1 Amb24492637 [0,1,0,0,0,0|2,0,0]=3 1070 B13R1.152 CC(=O)[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb24574713 [0,1,0,0,0,0|2,0,0]=3 1071 B13R1.152 CC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb24652637 [0,1,0,0,0,0|2,0,0]=3 1072 B13R1.152 CC(=O)[C@H](O)[C@H](O)c1ccccc1 Amb24752230 [0,1,0,0,0,0|2,0,0]=3 1073 B13R1.152 CC(=O)\C(\Br)=C(\N)/c1ccccc1 Amb25680603 [0,1,0,0,0,0|2,0,1]=4 1074 B13R1.152 CC(C(=C)C(O)=O)c1ccccc1 Amb24634053 [0,1,0,0,0,0|2,0,0]=3 1075 B13R1.152 CC(C(Br)C(O)=O)c1ccccc1 Amb24396296 [0,1,0,0,0,0|2,0,0]=3 1076 B13R1.152 CC(C(C(=O)O)N)c1ccccc1 Amb10072242 [0,1,0,0,0,0|2,0,0]=3 1077 B13R1.152 CC(C(C(=O)O)O)c1ccccc1 Amb10549583 [0,1,0,0,0,0|2,0,0]=3 1078 B13R1.152 CC(C(C)c1cccc[n]1)C(O)=O Amb18824717 [0,1,0,0,0,0|3,0,0]=4 1079 B13R1.152 CC(C(C)c1ccccc1)C(=O)Cl Amb25197974 [0,1,0,0,0,0|2,0,0]=3 1080 B13R1.152 CC(C(Cl)C(N)=O)c1ccccc1 Amb18330991 [0,1,0,0,0,0|2,0,0]=3 1081 B13R1.152 CC(C(Cl)C(O)=O)c1ccccc1 Amb25773999 [0,1,0,0,0,0|2,0,0]=3 1082 B13R1.152 CC(C(Cl)c1ccccc1)C(=O)Cl Amb24418080 [0,1,0,0,0,0|3,0,0]=4 1083 B13R1.152 CC(C(Cl)c1ccccc1)C(O)=O Amb18130574 [0,1,0,0,0,0|3,0,0]=4 1084 B13R1.152 CC(C(F)C(O)=O)c1cc[n]cc1 Amb25119011 [0,1,0,0,0,0|3,0,0]=4 1085 B13R1.152 CC(C(F)C(O)=O)c1ccc[n]c1 Amb24583873 [0,1,0,0,0,0|3,0,0]=4 1086 B13R1.152 CC(C(F)C(O)=O)c1ccccc1 Amb24674555 [0,1,0,0,0,0|2,0,0]=3 1087 B13R1.152 CC(C(N)C(N)=O)c1ccccc1 Amb18975500 [0,1,0,0,0,0|2,0,0]=3 1088 B13R1.152 CC(C(N)c1ccccc1)C(O)=O Amb19375481 [0,1,0,0,0,0|3,0,0]=4 1089 B13R1.152 CC(C(O)C(C)N)c1ccccc1 Amb25311051 [0,1,0,0,0,0|2,0,1]=4 1090 B13R1.152 CC(C(O)C(N)=O)c1ccccc1 Amb18809180 [0,1,0,0,0,0|2,0,0]=3 1091 B13R1.152 CC(C(O)N(C)N)c1ccccc1 Amb25296272 [0,1,0,0,0,0|3,0,0]=4 1092 B13R1.152 CC(C)=C(C)C(O)c1ccccc1 Amb24495409 [0,1,0,0,0,0|3,0,0]=4 1093 B13R1.152 CC(C)C(=O)C(C)c1ccccc1 Amb24400185 [0,1,0,0,0,0|2,0,1]=4 1094 B13R1.152 CC(C)C(=O)[C@@H](C)c1ccccc1 Amb24408301 [0,1,0,0,0,0|2,0,1]=4 1095 B13R1.152 CC(C)C(N)C(C)c1ccccc1 Amb23536663 [0,1,0,0,0,0|2,0,1]=4 1096 B13R1.152 CC(C)C(O)C(C)c1ccccc1 Amb24704769 [0,1,0,0,0,0|2,0,1]=4 1097 B13R1.152 CC(C)[C@H](O)[C@@H](C)c1ccccc1 Amb24495041 [0,1,0,0,0,0|2,0,1]=4 1098 B13R1.152 CC(N(c1ccccc1)C)C(=O)Cl Amb17143180 [0,1,0,0,0,0|3,0,0]=4 1099 B13R1.152 CC(O)C(C)C(C)c1ccccc1 Amb25332510 [0,1,0,0,0,0|1,0,2]=4 1100 B13R1.152 CC(S(=O)c1ccccc1)C(=O)C Amb17595198 [0,1,0,0,0,0|3,0,0]=4 1101 B13R1.152 CC([C@@H](N)C(O)=O)c1ccccc1 Amb24107545 [0,1,0,0,0,0|2,0,0]=3 1102 B13R1.152 CC([C@H](O)[C@H](C)N)c1ccccc1 Amb24697327 [0,1,0,0,0,0|2,0,1]=4 1103 B13R1.152 CC([C@H](O)c1ccccc1)C(O)=O Amb25258355 [0,1,0,0,0,0|3,0,0]=4 1104 B13R1.152 CC(c1ccccc1)C(=O)C(O)=O Amb18648106 [0,1,0,0,0,0|2,0,0]=3 1105 B13R1.152 CC(c1ccccc1)N(O)C(N)=O Amb25321876 [0,1,0,0,0,0|2,0,0]=3 1106 B13R1.152 CN(C(=O)C(=O)C)c1ccccc1 Amb2424343 [0,1,0,0,0,0|2,0,0]=3 1107 B13R1.152 CN(C(C)c1cc[n]cc1)C(=O)Cl Amb24724961 [0,1,0,0,0,0|3,0,0]=4 1108 B13R1.152 CN(C(C)c1cc[n]cc1)C(N)=O Amb24747907 [0,1,0,0,0,0|3,0,0]=4 1109 B13R1.152 CN(C(C)c1ccc[n]c1)C(N)=O Amb25344518 [0,1,0,0,0,0|3,0,0]=4 1110 B13R1.152 CN(C(C)c1cccc[n]1)C(N)=O Amb25796074 [0,1,0,0,0,0|3,0,0]=4 1111 B13R1.152 CN(C)C(=O)[C@@H](C)c1ccccc1 Amb25370071 [0,1,0,0,0,0|3,0,0]=4 1112 B13R1.152 CN(C)C(=O)[C@H](C)c1ccccc1 Amb25093411 [0,1,0,0,0,0|3,0,0]=4 1113 B13R1.152 CN(C)C(C)C(C)c1ccccc1 Amb24653657 [0,1,0,0,0,0|3,0,0]=4 1114 B13R1.152 CN([C@@H](C)C(O)=O)c1ccccc1 Amb24424138 [0,1,0,0,0,0|3,0,0]=4 1115 B13R1.152 C[C@@H](C(=O)[C@H](C)N)c1ccccc1 Amb24561937 [0,1,0,0,0,0|2,0,1]=4 1116 B13R1.152 C[C@@H]([C@@H](C)c1ccccc1)C(N)=O Amb25765701 [0,1,0,0,0,0|2,0,0]=3 1117 B13R1.152 C[C@@H]([C@@H](N)C(O)=O)c1ccccc1 Amb22801136 [0,1,0,0,0,0|2,0,0]=3 1118 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(N)=O Amb24590220 [0,1,0,0,0,0|3,0,0]=4 1119 B13R1.152 C[C@@H]([C@@H](N)c1ccccc1)C(O)=O Amb19929625 [0,1,0,0,0,0|3,0,0]=4 1120 B13R1.152 C[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25697174 [0,1,0,0,0,0|2,0,0]=3 1121 B13R1.152 C[C@@H]([C@@H](O)[C@H](C)N)c1ccccc1 Amb25040764 [0,1,0,0,0,0|2,0,1]=4 1122 B13R1.152 C[C@@H]([C@@H](O)c1ccccc1)C(O)=O Amb24429060 [0,1,0,0,0,0|3,0,0]=4 1123 B13R1.152 C[C@@H]([C@H](N)c1ccccc1)C(O)=O Amb19929623 [0,1,0,0,0,0|3,0,0]=4 1124 B13R1.152 C[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb25708376 [0,1,0,0,0,0|2,0,0]=3 1125 B13R1.152 C[C@@H]([C@H](O)c1ccccc1)C(O)=O Amb25689703 [0,1,0,0,0,0|3,0,0]=4 1126 B13R1.152 C[C@@H](c1ccccc1)N(O)C(N)=O Amb25040134 [0,1,0,0,0,0|2,0,0]=3 1127 B13R1.152 C[C@H]([C@@H](C(=O)O)C)c1ccccc1 Amb10844123 [0,1,0,0,0,0|2,0,0]=3 1128 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb19890909 [0,1,0,0,0,0|2,0,0]=3 1129 B13R1.152 C[C@H]([C@@H](N)C(O)=O)c1ccccc1 Amb25101600 [0,1,0,0,0,0|2,0,0]=3 1130 B13R1.152 C[C@H]([C@@H](N)c1ccccc1)C(O)=O Amb25111224 [0,1,0,0,0,0|3,0,0]=4 1131 B13R1.152 C[C@H]([C@@H](O)C(O)=O)c1ccccc1 Amb25363181 [0,1,0,0,0,0|2,0,0]=3 1132 B13R1.152 C[C@H]([C@@H](O)c1ccccc1)C(N)=O Amb25708390 [0,1,0,0,0,0|3,0,0]=4 1133 B13R1.152 C[C@H]([C@H](N)c1ccccc1)C(O)=O Amb24552403 [0,1,0,0,0,0|3,0,0]=4 1134 B13R1.152 C\C(=C(\F)/C(O)=O)\c1ccccc1 Amb18128594 [0,1,0,0,0,0|2,0,1]=4 1135 B13R1.152 C\C(=C(\N)/c1ccccc1)\C(C)=O Amb25360965 [0,1,0,0,0,0|2,0,1]=4 1136 B13R1.152 C\C(\C(C)=O)=C(\C)/c1ccccc1 Amb25730281 [0,1,0,0,0,0|1,0,1]=3 1137 B13R1.152 C\C(\C(O)=O)=C(\C)/c1ccccc1 Amb18127724 [0,1,0,0,0,0|2,0,1]=4 1138 B13R1.152 C\C(\F)=C(\F)/C(O)c1ccccc1 Amb25847030 [0,1,0,0,0,0|3,0,0]=4 1139 B13R1.152 ClC(C(C(=O)O)O)c1ccccc1 Amb17595327 [0,1,0,0,0,0|3,0,0]=4 1140 B13R1.152 NC(=O)C(Cl)C(O)c1ccccc1 Amb25772867 [0,1,0,0,0,0|3,0,0]=4 1141 B13R1.152 NC(=O)C(N)C(F)c1ccccc1 Amb25322105 [0,1,0,0,0,0|3,0,0]=4 1142 B13R1.152 NC(=O)C(O)C(F)c1ccccc1 Amb24400168 [0,1,0,0,0,0|3,0,0]=4 1143 B13R1.152 NC(=O)[C@@H](N)[C@@H](O)c1ccccc1 Amb25138644 [0,1,0,0,0,0|3,0,0]=4 1144 B13R1.152 NC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb24426182 [0,1,0,0,0,0|3,0,0]=4 1145 B13R1.152 NC(=O)[C@H](Cl)[C@@H](O)c1ccccc1 Amb25363147 [0,1,0,0,0,0|3,0,0]=4 1146 B13R1.152 NC(=O)[C@H](F)[C@@H](O)c1ccccc1 Amb24429111 [0,1,0,0,0,0|3,0,0]=4 1147 B13R1.152 NC(=O)[C@H](O)[C@@H](N)c1ccccc1 Amb24552423 [0,1,0,0,0,0|3,0,0]=4 1148 B13R1.152 NC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb24741670 [0,1,0,0,0,0|3,0,0]=4 1149 B13R1.152 NC(C(C(=O)O)C)c1ccccc1 Amb17470593 [0,1,0,0,0,0|3,0,0]=4 1150 B13R1.152 NC(C(N)c1ccccc1)C(O)=O Amb18128694 [0,1,0,0,0,0|3,0,0]=4 1151 B13R1.152 NC(C(O)C(O)=O)c1ccccc1 Amb22552502 [0,1,0,0,0,0|3,0,0]=4 1152 B13R1.152 NC([C@H](O)c1ccccc1)C(O)=O Amb25848582 [0,1,0,0,0,0|3,0,0]=4 1153 B13R1.152 NC(c1ccccc1)C(=O)C(O)=O Amb24693899 [0,1,0,0,0,0|3,0,0]=4 1154 B13R1.152 N[C@@H](C(Cl)c1ccccc1)C(O)=O Amb25765693 [0,1,0,0,0,0|3,0,0]=4 1155 B13R1.152 N[C@@H](C(O)C(O)=O)c1ccccc1 Amb24677811 [0,1,0,0,0,0|3,0,0]=4 1156 B13R1.152 N[C@@H]([C@@H](C(=O)O)O)c1ccccc1 Amb17619345 [0,1,0,0,0,0|3,0,0]=4 1157 B13R1.152 N[C@@H]([C@@H](O)C(O)=O)c1ccccc1 Amb17779638 [0,1,0,0,0,0|3,0,0]=4 1158 B13R1.152 N[C@@H]([C@@H](S)c1ccccc1)C(O)=O Amb24677701 [0,1,0,0,0,0|3,0,0]=4 1159 B13R1.152 N[C@@H]([C@H](C(=O)O)O)c1ccccc1 Amb17619344 [0,1,0,0,0,0|3,0,0]=4 1160 B13R1.152 N[C@@H]([C@H](O)C(O)=O)c1ccccc1 Amb22745018 [0,1,0,0,0,0|3,0,0]=4 1161 B13R1.152 N[C@H]([C@@H](S)c1ccccc1)C(O)=O Amb24346854 [0,1,0,0,0,0|3,0,0]=4 1162 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb10601661 [0,1,0,0,0,0|3,0,0]=4 1163 B13R1.152 N[C@H]([C@H](C(=O)O)O)c1ccccc1 Amb16231605 [0,1,0,0,0,0|3,0,0]=4 1164 B13R1.152 N[C@H]([C@H](N)c1ccccc1)C(O)=O Amb24442986 [0,1,0,0,0,0|3,0,0]=4 1165 B13R1.152 O=C(C(=C)C(=O)C)c1ccccc1 Amb17594383 [0,1,0,0,0,0|2,0,1]=4 1166 B13R1.152 O=C(Cl)C(Br)C(Br)c1ccccc1 Amb22366166 [0,1,0,0,0,0|3,0,0]=4 1167 B13R1.152 OC(=O)C(=O)C(Br)c1ccccc1 Amb18135901 [0,1,0,0,0,0|3,0,0]=4 1168 B13R1.152 OC(=O)C(=O)C(Cl)c1ccccc1 Amb25292830 [0,1,0,0,0,0|3,0,0]=4 1169 B13R1.152 OC(=O)C(Cl)C(Cl)c1ccccc1 Amb18132697 [0,1,0,0,0,0|3,0,0]=4 1170 B13R1.152 OC(=O)C(Cl)C(O)c1ccccc1 Amb25366171 [0,1,0,0,0,0|3,0,0]=4 1171 B13R1.152 OC(=O)[C@H](Cl)[C@H](O)c1ccccc1 Amb24640317 [0,1,0,0,0,0|3,0,0]=4 1172 B13R1.152 OC(C(C(=O)C)C)c1ccccc1 Amb17594547 [0,1,0,0,0,0|2,0,0]=3 1173 B13R1.152 OC(C(C(=O)O)N)c1ccccc1 Amb2228459 [0,1,0,0,0,0|3,0,0]=4 1174 B13R1.152 OC(C(C(=O)[O-])N)c1ccccc1 Amb15772286 [0,1,0,0,0,0|3,0,0]=4 1175 B13R1.152 O[C@H]([C@H](C(=O)O)C)c1ccccc1 Amb10844122 [0,1,0,0,0,0|3,0,0]=4 1176 B13R1.152 O\C(=C(/C(=O)C)\C)\c1ccccc1 Amb17594481 [0,1,0,0,0,0|2,0,1]=4 1177 B13R1.152 SC(C(C(=O)O)N)c1ccccc1 Amb17595234 [0,1,0,0,0,0|3,0,0]=4 1178 B13R1.201 CC(=C)CC(N)c1ccccc1Br Amb24720414 [0,1,0,0,0,0|3,0,0]=4 1179 B13R1.201 CC(=C)CC(N)c1ccccc1Cl Amb24388867 [0,1,0,0,0,0|3,0,0]=4 1180 B13R1.201 CC(=C)CC(N)c1ccccc1O Amb24562577 [0,1,0,0,0,0|3,0,0]=4 1181 B13R1.201 CC(=C)CC(O)c1ccccc1Cl Amb25297598 [0,1,0,0,0,0|3,0,0]=4 1182 B13R1.201 CC(=C)CC(O)c1ccccc1I Amb24447342 [0,1,0,0,0,0|3,0,0]=4 1183 B13R1.201 CC(=C)CC(O)c1ccccc1N Amb25047091 [0,1,0,0,0,0|3,0,0]=4 1184 B13R1.201 CC(=C)CN(C)c1ccccc1F Amb25742089 [0,1,0,0,0,0|3,0,0]=4 1185 B13R1.201 CC(=C)CN(C)c1ccccc1I Amb24676281 [0,1,0,0,0,0|3,0,0]=4 1186 B13R1.201 CC(=C)C[C@@H](N)c1ccccc1Br Amb24598973 [0,1,0,0,0,0|3,0,0]=4 1187 B13R1.201 CC(=C)C[C@@H](N)c1ccccc1O Amb25258962 [0,1,0,0,0,0|3,0,0]=4 1188 B13R1.201 CC(=C)C[C@H](N)c1ccccc1F Amb24550709 [0,1,0,0,0,0|3,0,0]=4 1189 B13R1.201 CC(=N)NC(C)c1ccccc1F Amb25142754 [0,1,0,0,0,0|2,0,0]=3 1190 B13R1.201 CC(=O)CC(O)c1ccccc1Br Amb25080258 [0,1,0,0,0,0|2,0,0]=3 1191 B13R1.201 CC(=O)CC(O)c1ccccc1Cl Amb24495104 [0,1,0,0,0,0|2,0,0]=3 1192 B13R1.201 CC(=O)CN(C)c1ccccc1F Amb18791227 [0,1,0,0,0,0|2,0,0]=3 1193 B13R1.201 CC(=O)C[C@@H](O)c1ccccc1Br Amb25079139 [0,1,0,0,0,0|2,0,0]=3 1194 B13R1.201 CC(=O)C[C@@H](O)c1ccccc1F Amb25191723 [0,1,0,0,0,0|2,0,0]=3 1195 B13R1.201 CC(=O)C[C@@H](O)c1ccccc1O Amb24357147 [0,1,0,0,0,0|2,0,0]=3 1196 B13R1.201 CC(=O)C[C@H](O)c1ccccc1Br Amb25772540 [0,1,0,0,0,0|2,0,0]=3 1197 B13R1.201 CC(=O)C[C@H](O)c1ccccc1Cl Amb24495406 [0,1,0,0,0,0|2,0,0]=3 1198 B13R1.201 CC(=O)C[C@H](O)c1ccccc1F Amb25037120 [0,1,0,0,0,0|2,0,0]=3 1199 B13R1.201 CC(=O)C[C@H](O)c1ccccc1O Amb25752693 [0,1,0,0,0,0|2,0,0]=3 1200 B13R1.201 CC(=O)NC(=C)c1ccccc1C Amb25770031 [0,1,0,0,0,0|1,0,2]=4 1201 B13R1.201 CC(=O)NC(=O)c1ccccc1Br Amb25291358 [0,1,0,0,0,0|2,0,1]=4 1202 B13R1.201 CC(=O)NC(=O)c1ccccc1C Amb24664090 [0,1,0,0,0,0|2,0,1]=4 1203 B13R1.201 CC(=O)NC(=O)c1ccccc1Cl Amb25758002 [0,1,0,0,0,0|2,0,1]=4 1204 B13R1.201 CC(=O)NC(=O)c1ccccc1F Amb18791209 [0,1,0,0,0,0|2,0,1]=4 1205 B13R1.201 CC(=O)NC(=O)c1ccccc1O Amb1983211 [0,1,0,0,0,0|2,0,1]=4 1206 B13R1.201 CC(=O)NC(C)c1ccccc1F Amb25092387 [0,1,0,0,0,0|1,0,0]=2 1207 B13R1.201 CC(=O)NC(C)c1ccccc1O Amb25275237 [0,1,0,0,0,0|1,0,0]=2 1208 B13R1.201 CC(=O)NC(c1ccccc1Br)C Amb13955929 [0,1,0,0,0,0|1,0,0]=2 1209 B13R1.201 CC(=O)N[C@@H](C)c1ccccc1Br Amb25830780 [0,1,0,0,0,0|1,0,0]=2 1210 B13R1.201 CC(=O)N[C@@H](C)c1ccccc1Cl Amb25180661 [0,1,0,0,0,0|1,0,0]=2 1211 B13R1.201 CC(=O)N[C@@H](C)c1ccccc1O Amb24391637 [0,1,0,0,0,0|1,0,0]=2 1212 B13R1.201 CC(=O)N[C@H](C)c1c[n]ccc1Cl Amb24734412 [0,1,0,0,0,0|2,0,0]=3 1213 B13R1.201 CC(=O)N[C@H](C)c1ccccc1Br Amb25200879 [0,1,0,0,0,0|1,0,0]=2 1214 B13R1.201 CC(=O)N[C@H](C)c1ccccc1Cl Amb24489218 [0,1,0,0,0,0|1,0,0]=2 1215 B13R1.201 CC(=O)OC(=O)c1ccccc1O Amb25707001 [0,1,0,0,0,0|1,0,1]=3 1216 B13R1.201 CC(=O)OC(C)c1ccccc1N Amb24652367 [0,1,0,0,0,0|0,0,0]=1 1217 B13R1.201 CC(=O)O[C@@H](C)c1[n]cccc1F Amb25749646 [0,1,0,0,0,0|1,0,0]=2 1218 B13R1.201 CC(=O)O[C@@H](C)c1ccccc1Br Amb25749645 [0,1,0,0,0,0|0,0,0]=1 1219 B13R1.201 CC(=O)O[C@H](C)c1ccccc1Cl Amb25749554 [0,1,0,0,0,0|0,0,0]=1 1220 B13R1.201 CC(=O)\C=C(/O)\c1ccccc1O Amb24344019 [0,1,0,0,0,0|2,0,1]=4 1221 B13R1.201 CC(Br)CC(C)c1ccccc1Cl Amb24601419 [0,1,0,0,0,0|2,0,1]=4 1222 B13R1.201 CC(C)=CC(N)c1ccccc1Br Amb25244889 [0,1,0,0,0,0|3,0,0]=4 1223 B13R1.201 CC(C)=CC(N)c1ccccc1F Amb25856617 [0,1,0,0,0,0|3,0,0]=4 1224 B13R1.201 CC(C)=CC(O)c1ccccc1Cl Amb25838879 [0,1,0,0,0,0|3,0,0]=4 1225 B13R1.201 CC(C)=CC(O)c1ccccc1O Amb25777478 [0,1,0,0,0,0|3,0,0]=4 1226 B13R1.201 CC(C)NC(C)c1ccccc1I Amb24393694 [0,1,0,0,0,0|2,0,1]=4 1227 B13R1.201 CC(C)NC(C)c1ccccc1N Amb23557748 [0,1,0,0,0,0|2,0,1]=4 1228 B13R1.201 CC(C)N[C@@H](C)c1ccccc1Br Amb25235148 [0,1,0,0,0,0|2,0,1]=4 1229 B13R1.201 CC(C)N[C@H](C)c1ccccc1Br Amb25192058 [0,1,0,0,0,0|2,0,1]=4 1230 B13R1.201 CC(C)SC(C)c1ccccc1Cl Amb24458327 [0,1,0,0,0,0|1,1,1]=4 1231 B13R1.201 CC(CC(C)N)c1ccccc1Cl Amb25803024 [0,1,0,0,0,0|2,0,1]=4 1232 B13R1.201 CC(CC(C)N)c1ccccc1F Amb24613466 [0,1,0,0,0,0|2,0,1]=4 1233 B13R1.201 CC(CC(C)O)c1ccccc1F Amb24362824 [0,1,0,0,0,0|1,0,2]=4 1234 B13R1.201 CC(CC(N)=N)c1ccccc1Br Amb24757079 [0,1,0,0,0,0|3,0,0]=4 1235 B13R1.201 CC(CC(N)=O)c1ccccc1O Amb25055113 [0,1,0,0,0,0|2,0,0]=3 1236 B13R1.201 CC(CC(O)=O)c1c[n]ccc1N Amb24697260 [0,1,0,0,0,0|3,0,0]=4 1237 B13R1.201 CC(CC(O)=O)c1ccc[n]c1F Amb25801891 [0,1,0,0,0,0|3,0,0]=4 1238 B13R1.201 CC(CC(O)=O)c1ccc[n]c1N Amb25805374 [0,1,0,0,0,0|3,0,0]=4 1239 B13R1.201 CC(CC(O)=O)c1ccccc1Br Amb19293241 [0,1,0,0,0,0|2,0,0]=3 1240 B13R1.201 CC(CC(O)=O)c1ccccc1O Amb25779942 [0,1,0,0,0,0|2,0,0]=3 1241 B13R1.201 CC(NC(N)=N)c1ccccc1Cl Amb18325438 [0,1,0,0,0,0|3,0,0]=4 1242 B13R1.201 CC(NC(N)=N)c1ccccc1F Amb18805219 [0,1,0,0,0,0|3,0,0]=4 1243 B13R1.201 CC(NC(N)=O)c1ccccc1Br Amb24363207 [0,1,0,0,0,0|2,0,0]=3 1244 B13R1.201 CC(NC(N)=O)c1ccccc1Cl Amb18332181 [0,1,0,0,0,0|2,0,0]=3 1245 B13R1.201 CC(NC(N)=O)c1ccccc1F Amb18809706 [0,1,0,0,0,0|2,0,0]=3 1246 B13R1.201 CC(NC(N)=S)c1ccccc1Cl Amb25361943 [0,1,0,0,0,0|2,1,0]=4 1247 B13R1.201 CC(NC(N)=S)c1ccccc1F Amb18321925 [0,1,0,0,0,0|2,1,0]=4 1248 B13R1.201 CN(C)NC(C)c1ccccc1Br Amb24363397 [0,1,0,0,0,0|3,0,0]=4 1249 B13R1.201 CN(C)NC(C)c1ccccc1N Amb25138711 [0,1,0,0,0,0|3,0,0]=4 1250 B13R1.201 CN(C)NC(C)c1ccccc1O Amb25774560 [0,1,0,0,0,0|3,0,0]=4 1251 B13R1.201 CN(CC(N)=O)c1ccccc1F Amb18179264 [0,1,0,0,0,0|3,0,0]=4 1252 B13R1.201 CN(CC(N)=O)c1ccccc1O Amb24335263 [0,1,0,0,0,0|3,0,0]=4 1253 B13R1.201 CN(CC(O)=O)c1ccccc1N Amb18297284 [0,1,0,0,0,0|3,0,0]=4 1254 B13R1.201 CS(=O)CC(O)c1ccccc1Cl Amb22446242 [0,1,0,0,0,0|3,0,0]=4 1255 B13R1.201 C[C@@H](CC(O)=O)c1ccccc1O Amb25088403 [0,1,0,0,0,0|2,0,0]=3 1256 B13R1.201 C[C@H](NC(N)=N)c1ccccc1Cl Amb24717655 [0,1,0,0,0,0|3,0,0]=4 1257 B13R1.201 C[C@H](NC(N)=S)c1ccccc1Cl Amb24409637 [0,1,0,0,0,0|2,1,0]=4 1258 B13R1.201 C\C(=C/C(C)=O)\c1ccccc1C Amb25282860 [0,1,0,0,0,0|1,0,1]=3 1259 B13R1.201 C\C(=C/C(O)=O)\c1ccccc1Cl Amb24669047 [0,1,0,0,0,0|2,0,1]=4 1260 B13R1.201 C\C(=C/C(O)=O)\c1ccccc1O Amb18128082 [0,1,0,0,0,0|2,0,1]=4 1261 B13R1.201 C\C(=C/C(O)=O)\c1ccccc1S Amb18130087 [0,1,0,0,0,0|2,0,1]=4 1262 B13R1.201 C\C(=C\C(C)=O)\c1ccccc1C Amb24723331 [0,1,0,0,0,0|1,0,1]=3 1263 B13R1.201 C\C(=C\C(O)=O)\c1ccccc1Br Amb25105123 [0,1,0,0,0,0|2,0,1]=4 1264 B13R1.201 C\C(=C\C(O)=O)\c1ccccc1O Amb25713041 [0,1,0,0,0,0|2,0,1]=4 1265 B13R1.201 C\C(=C\C(O)=O)\c1ccccc1S Amb24610077 [0,1,0,0,0,0|2,0,1]=4 1266 B13R1.201 Cc1cc[n]cc1C(C)CC(C)=O Amb25119429 [0,1,0,0,0,0|2,0,0]=3 1267 B13R1.201 Cc1cc[n]cc1C(C)CC(O)=O Amb24365116 [0,1,0,0,0,0|3,0,0]=4 1268 B13R1.201 Cc1cc[n]cc1C(C)NC(C)=O Amb24706369 [0,1,0,0,0,0|2,0,0]=3 1269 B13R1.201 Cc1ccccc1C(C)CC(=O)Cl Amb25260778 [0,1,0,0,0,0|2,0,0]=3 1270 B13R1.201 Cc1ccccc1C(C)CC(C)=O Amb25294687 [0,1,0,0,0,0|1,0,0]=2 1271 B13R1.201 Cc1ccccc1C(C)CC(C)N Amb25780550 [0,1,0,0,0,0|2,0,1]=4 1272 B13R1.201 Cc1ccccc1C(C)NC(C)=O Amb24493712 [0,1,0,0,0,0|1,0,0]=2 1273 B13R1.201 Cc1ccccc1C(C)NC(N)=N Amb18804656 [0,1,0,0,0,0|3,0,0]=4 1274 B13R1.201 Cc1ccccc1C(C)NC(N)=O Amb18186204 [0,1,0,0,0,0|2,0,0]=3 1275 B13R1.201 Cc1ccccc1C(C)NC(N)=S Amb18321279 [0,1,0,0,0,0|2,1,0]=4 1276 B13R1.201 Cc1ccccc1C(C)SC(C)=O Amb25173983 [0,1,0,0,0,0|0,1,0]=2 1277 B13R1.201 Cc1ccccc1C(C)SC(C)C Amb24751835 [0,1,0,0,0,0|1,1,1]=4 1278 B13R1.201 Cc1ccccc1C(N)CC(C)=C Amb24641326 [0,1,0,0,0,0|3,0,0]=4 1279 B13R1.201 Cc1ccccc1C(N)CS(C)=O Amb24763147 [0,1,0,0,0,0|3,0,0]=4 1280 B13R1.201 Cc1ccccc1C(O)CS(C)=O Amb22450121 [0,1,0,0,0,0|3,0,0]=4 1281 B13R1.201 Cc1ccccc1N(C)CC(C)=O Amb18790845 [0,1,0,0,0,0|2,0,0]=3 1282 B13R1.201 Cc1ccccc1N(C)CC(N)=O Amb18178559 [0,1,0,0,0,0|3,0,0]=4 1283 B13R1.201 Cc1ccccc1[C@@H](C)CC(C)=O Amb25767839 [0,1,0,0,0,0|1,0,0]=2 1284 B13R1.201 Cc1ccccc1[C@@H](C)NC(C)=O Amb24735511 [0,1,0,0,0,0|1,0,0]=2 1285 B13R1.201 Cc1ccccc1[C@@H](C)NC(N)=N Amb25738152 [0,1,0,0,0,0|3,0,0]=4 1286 B13R1.201 Cc1ccccc1[C@@H](C)OC(C)=O Amb25749567 [0,1,0,0,0,0|0,0,0]=1 1287 B13R1.201 Cc1ccccc1[C@@H](N)CC(N)=O Amb18180795 [0,1,0,0,0,0|3,0,0]=4 1288 B13R1.201 Cc1ccccc1[C@@H](N)CC(O)=O Amb18180923 [0,1,0,0,0,0|3,0,0]=4 1289 B13R1.201 Cc1ccccc1[C@@H](N)CC(O)=O Amb19349097 [0,1,0,0,0,0|3,0,0]=4 1290 B13R1.201 Cc1ccccc1[C@@H](O)CC(C)=O Amb24658732 [0,1,0,0,0,0|2,0,0]=3 1291 B13R1.201 Cc1ccccc1[C@H](C)NC(C)=O Amb25772447 [0,1,0,0,0,0|1,0,0]=2 1292 B13R1.201 Cc1ccccc1[C@H](C)NC(C)C Amb24701074 [0,1,0,0,0,0|2,0,1]=4 1293 B13R1.201 Cc1ccccc1[C@H](C)NC(N)=N Amb25311447 [0,1,0,0,0,0|3,0,0]=4 1294 B13R1.201 Cc1ccccc1[C@H](C)OC(C)=O Amb25323394 [0,1,0,0,0,0|0,0,0]=1 1295 B13R1.201 Cc1ccccc1[C@H](N)CC(C)=C Amb24597120 [0,1,0,0,0,0|3,0,0]=4 1296 B13R1.201 Cc1ccccc1[C@H](N)CC(O)=O Amb22225289 [0,1,0,0,0,0|3,0,0]=4 1297 B13R1.201 Cc1ccccc1[C@H](O)CC(O)=O Amb25362918 [0,1,0,0,0,0|3,0,0]=4 1298 B13R1.201 Cc1ccccc1\C(\C)=C/C(N)=O Amb25285440 [0,1,0,0,0,0|2,0,1]=4 1299 B13R1.201 NC(=O)CC(N)c1ccccc1O Amb25301978 [0,1,0,0,0,0|3,0,0]=4 1300 B13R1.201 NC(=O)CC(c1ccccc1C)C Amb17233287 [0,1,0,0,0,0|2,0,0]=3 1301 B13R1.201 NC(=O)CC(c1ccccc1Cl)C Amb17236668 [0,1,0,0,0,0|2,0,0]=3 1302 B13R1.201 NC(=O)CC(c1ccccc1F)C Amb17233789 [0,1,0,0,0,0|2,0,0]=3 1303 B13R1.201 NC(=O)CN(c1ccccc1I)C Amb12249100 [0,1,0,0,0,0|3,0,0]=4 1304 B13R1.201 NC(=O)C[C@@H](N)c1ccccc1Cl Amb18322121 [0,1,0,0,0,0|3,0,0]=4 1305 B13R1.201 NC(=O)C[C@@H](N)c1ccccc1F Amb18796565 [0,1,0,0,0,0|3,0,0]=4 1306 B13R1.201 NC(=O)C[C@H](N)c1ccccc1Cl Amb20622442 [0,1,0,0,0,0|3,0,0]=4 1307 B13R1.201 NC(=O)C[C@H](N)c1ccccc1Cl Amb24442619 [0,1,0,0,0,0|3,0,0]=4 1308 B13R1.201 NC(=O)C[C@H](N)c1ccccc1F Amb25278110 [0,1,0,0,0,0|3,0,0]=4 1309 B13R1.201 NC(CC(O)=O)c1ccccc1Br Amb17659134 [0,1,0,0,0,0|3,0,0]=4 1310 B13R1.201 NC(CC(O)=O)c1ccccc1I Amb25785027 [0,1,0,0,0,0|3,0,0]=4 1311 B13R1.201 N[C@@H](CC(O)=O)c1ccccc1Br Amb20240882 [0,1,0,0,0,0|3,0,0]=4 1312 B13R1.201 N[C@@H](CC(O)=O)c1ccccc1Cl Amb18319938 [0,1,0,0,0,0|3,0,0]=4 1313 B13R1.201 N[C@@H](CC(O)=O)c1ccccc1F Amb18322470 [0,1,0,0,0,0|3,0,0]=4 1314 B13R1.201 N[C@@H](CC(O)=O)c1ccccc1O Amb20240883 [0,1,0,0,0,0|3,0,0]=4 1315 B13R1.201 N[C@@H](CC(O)=O)c1ccccc1S Amb25709305 [0,1,0,0,0,0|3,0,0]=4 1316 B13R1.201 N[C@H](CC(O)=O)c1ccccc1Br Amb25102891 [0,1,0,0,0,0|3,0,0]=4 1317 B13R1.201 N[C@H](CC(O)=O)c1ccccc1Cl Amb19887656 [0,1,0,0,0,0|3,0,0]=4 1318 B13R1.201 N[C@H](CC(O)=O)c1ccccc1F Amb20240876 [0,1,0,0,0,0|3,0,0]=4 1319 B13R1.201 N[C@H](CC(O)=O)c1ccccc1O Amb20240877 [0,1,0,0,0,0|3,0,0]=4 1320 B13R1.201 Nc1ccccc1C(N)CC(O)=O Amb24747456 [0,1,0,0,0,0|3,0,0]=4 1321 B13R1.201 OC(=O)CC(F)c1ccccc1Br Amb24514037 [0,1,0,0,0,0|3,0,0]=4 1322 B13R1.201 OC(=O)CC(O)c1ccccc1Br Amb18298166 [0,1,0,0,0,0|3,0,0]=4 1323 B13R1.201 OC(=O)CC(c1ccccc1Br)N Amb1792801 [0,1,0,0,0,0|3,0,0]=4 1324 B13R1.201 OC(=O)CC(c1ccccc1C)N Amb2435882 [0,1,0,0,0,0|3,0,0]=4 1325 B13R1.201 OC(=O)CC(c1ccccc1C)O Amb17233658 [0,1,0,0,0,0|3,0,0]=4 1326 B13R1.201 OC(=O)CC(c1ccccc1Cl)C Amb17236833 [0,1,0,0,0,0|2,0,0]=3 1327 B13R1.201 OC(=O)CC(c1ccccc1Cl)N Amb1104745 [0,1,0,0,0,0|3,0,0]=4 1328 B13R1.201 OC(=O)CC(c1ccccc1Cl)O Amb17237172 [0,1,0,0,0,0|3,0,0]=4 1329 B13R1.201 OC(=O)CC(c1ccccc1F)N Amb10672391 [0,1,0,0,0,0|3,0,0]=4 1330 B13R1.201 OC(=O)CC(c1ccccc1F)N Amb1198056 [0,1,0,0,0,0|3,0,0]=4 1331 B13R1.201 OC(=O)CC(c1ccccc1F)O Amb17234053 [0,1,0,0,0,0|3,0,0]=4 1332 B13R1.201 OC(=O)CC(c1ccccc1I)C Amb16210922 [0,1,0,0,0,0|2,0,0]=3 1333 B13R1.201 OC(=O)CC(c1ccccc1O)N Amb2435865 [0,1,0,0,0,0|3,0,0]=4 1334 B13R1.201 OC(=O)CN(c1ccccc1Br)C Amb17349670 [0,1,0,0,0,0|3,0,0]=4 1335 B13R1.201 OC(=O)CN(c1ccccc1C)C Amb17335308 [0,1,0,0,0,0|3,0,0]=4 1336 B13R1.201 OC(=O)CN(c1ccccc1Cl)C Amb17337478 [0,1,0,0,0,0|3,0,0]=4 1337 B13R1.201 OC(=O)CN(c1ccccc1F)C Amb17335597 [0,1,0,0,0,0|3,0,0]=4 1338 B13R1.201 OC(=O)C[C@@H](O)c1ccccc1Br Amb24642857 [0,1,0,0,0,0|3,0,0]=4 1339 B13R1.201 OC(=O)C[C@@H](O)c1ccccc1Cl Amb24383133 [0,1,0,0,0,0|3,0,0]=4 1340 B13R1.201 OC(=O)C[C@H](O)c1ccccc1Br Amb25121791 [0,1,0,0,0,0|3,0,0]=4 1341 B13R1.201 OC(=O)C[C@H](O)c1ccccc1Cl Amb25208995 [0,1,0,0,0,0|3,0,0]=4 1342 B13R1.201 OC(=O)\C=C(/c1ccccc1F)\C Amb10718083 [0,1,0,0,0,0|2,0,1]=4 1343 B13R1.201 OC(=O)\C=C(\c1ccccc1F)/C Amb10610216 [0,1,0,0,0,0|2,0,1]=4 1344 B13R1.347 CC(=N)NC(C)(C)c1ccccc1 Amb24529846 [0,1,0,0,0,0|2,0,0]=3 1345 B13R1.347 CC(=O)CC(C)(C)c1c[n]c[n]c1 Amb24383747 [0,1,0,0,0,0|3,0,0]=4 1346 B13R1.347 CC(=O)CS(=O)(=O)c1ccccc1 Amb2222044 [0,1,0,0,0,0|3,0,0]=4 1347 B13R1.347 CC(=O)C[C@](C)(O)c1ccccc1 Amb25735198 [0,1,0,0,0,0|1,0,0]=2 1348 B13R1.347 CC(=O)C[S+]([O-])(=O)c1ccccc1 Amb17915235 [0,1,0,0,0,0|3,0,0]=4 1349 B13R1.347 CC(=O)NC(C)(C)c1cc[n]cc1 Amb24709586 [0,1,0,0,0,0|2,0,0]=3 1350 B13R1.347 CC(=O)NC(C)(C)c1ccccc1 Amb25041071 [0,1,0,0,0,0|1,0,0]=2 1351 B13R1.347 CC(=O)NS(=O)(=O)c1ccccc1 Amb1195882 [0,1,0,0,0,0|3,0,0]=4 1352 B13R1.347 CC(=O)O[Si](C)(C)c1ccccc1 Amb19894003 [0,1,0,0,0,0|0,1,0]=2 1353 B13R1.347 CC(C)(NC(=O)Cl)c1ccccc1 Amb25801534 [0,1,0,0,0,0|2,0,0]=3 1354 B13R1.347 CC(C)(OC(N)=O)c1ccccc1 Amb25362200 [0,1,0,0,0,0|1,0,0]=2 1355 B13R1.347 CC(C)(SC(N)=N)c1ccccc1 Amb25667738 [0,1,0,0,0,0|2,1,0]=4 1356 B13R1.347 CC(C)C[C@@](C)(N)c1ccccc1 Amb19889808 [0,1,0,0,0,0|2,0,1]=4 1357 B13R1.347 CC(C)NC(C)(C)c1ccccc1 Amb24346833 [0,1,0,0,0,0|2,0,1]=4 1358 B13R1.347 CC(CC(c1ccccc1)(C)C)N Amb17622184 [0,1,0,0,0,0|2,0,1]=4 1359 B13R1.347 CC(Cl)CC(C)(C)c1ccccc1 Amb25096500 [0,1,0,0,0,0|2,0,1]=4 1360 B13R1.347 CC(F)(CC(O)=O)c1cc[n]cc1 Amb25325222 [0,1,0,0,0,0|3,0,0]=4 1361 B13R1.347 CC(F)(CC(O)=O)c1ccc[n]c1 Amb25365357 [0,1,0,0,0,0|3,0,0]=4 1362 B13R1.347 CC(N)(CC(O)=O)c1cc[n]cc1 Amb25703072 [0,1,0,0,0,0|3,0,0]=4 1363 B13R1.347 CC(N)(CC(O)=O)c1ccc[n]c1 Amb25133412 [0,1,0,0,0,0|3,0,0]=4 1364 B13R1.347 CC(O)(CC(N)=O)c1ccccc1 Amb25138678 [0,1,0,0,0,0|2,0,0]=3 1365 B13R1.347 CC(O)CC(C)(O)c1ccccc1 Amb24387704 [0,1,0,0,0,0|1,0,2]=4 1366 B13R1.347 CN(C)CC(C)(C)c1ccccc1 Amb24665711 [0,1,0,0,0,0|3,0,0]=4 1367 B13R1.347 CN(C)CC(C)(O)c1ccccc1 Amb18184561 [0,1,0,0,0,0|3,0,0]=4 1368 B13R1.347 C[C@@](N)(CC(O)=O)c1cccc[n]1 Amb24701903 [0,1,0,0,0,0|3,0,0]=4 1369 B13R1.347 C[C@@](N)(CC(O)=O)c1ccccc1 Amb25707764 [0,1,0,0,0,0|2,0,0]=3 1370 B13R1.347 C[C@@](O)(CC(O)=O)c1ccccc1 Amb24634119 [0,1,0,0,0,0|2,0,0]=3 1371 B13R1.347 C[C@H](O)C[C@@](C)(O)c1ccccc1 Amb24748423 [0,1,0,0,0,0|1,0,2]=4 1372 B13R1.347 C[C@H](O)C[C@](C)(O)c1ccccc1 Amb25204745 [0,1,0,0,0,0|1,0,2]=4 1373 B13R1.347 C[C@](N)(CC(O)=O)c1cc[n]cc1 Amb24411461 [0,1,0,0,0,0|3,0,0]=4 1374 B13R1.347 C[C@](N)(CC(O)=O)c1ccc[n]c1 Amb25039380 [0,1,0,0,0,0|3,0,0]=4 1375 B13R1.347 C[C@](O)(CC(O)=O)c1ccccc1 Amb25039552 [0,1,0,0,0,0|2,0,0]=3 1376 B13R1.347 C[N+](C)(CC(O)=O)c1ccccc1 Amb25324135 [0,1,0,0,0,0|3,0,0]=4 1377 B13R1.347 C[P@@](=O)(CC(O)=O)c1ccccc1 Amb24692795 [0,1,0,0,0,0|3,0,0]=4 1378 B13R1.347 C[Si](C)(CC(O)=O)c1ccccc1 Amb19928695 [0,1,0,0,0,0|2,1,0]=4 1379 B13R1.347 NC(=O)OS(=O)(=O)c1ccccc1 Amb24344027 [0,1,0,0,0,0|3,0,0]=4 1380 B13R1.347 OC(=O)CC(F)(F)c1ccccc1 Amb24491494 [0,1,0,0,0,0|3,0,0]=4 1381 B13R1.347 OC(=O)CC(c1ccccc1)(N)C Amb17470595 [0,1,0,0,0,0|2,0,0]=3 1382 B13R1.347 OC(=O)CC(c1ccccc1)(O)C Amb17138952 [0,1,0,0,0,0|2,0,0]=3 1383 B13R1.347 [BH3-][P+](C)(CC(O)=O)c1ccccc1 Amb24653711 [0,1,0,0,0,0|3,0,0]=4 1384 B13R1.347 [BH3-][P@+](C)(CC(O)=O)c1ccccc1 Amb25242522 [0,1,0,0,0,0|3,0,0]=4 1385 B13R1.352 CC(C)(C)OC(O)c1ccccc1 Amb24495945 [0,1,0,0,0,0|2,0,1]=4 1386 B13R1.352 CC(CC(C)(C)O)c1ccccc1 Amb25175754 [0,1,0,0,0,0|1,0,2]=4 1387 B13R1.352 CC(CS(=O)(=O)Cl)c1ccccc1 Amb18985655 [0,1,0,0,0,0|3,0,0]=4 1388 B13R1.352 CC(CS(N)(=O)=O)c1ccccc1 Amb18332333 [0,1,0,0,0,0|3,0,0]=4 1389 B13R1.352 CC(C[Si](C)(Cl)Cl)c1ccccc1 Amb19893953 [0,1,0,0,0,0|2,1,0]=4 1390 B13R1.352 CC(NS(N)(=O)=O)c1ccccc1 Amb25815976 [0,1,0,0,0,0|3,0,0]=4 1391 B13R1.352 CC(OS(C)(=O)=O)c1c[n]cc[n]1 Amb25846524 [0,1,0,0,0,0|3,0,0]=4 1392 B13R1.352 CC(OS(C)(=O)=O)c1c[n]ccc1 Amb24387131 [0,1,0,0,0,0|2,0,0]=3 1393 B13R1.352 CC(SC(C)(C)C)c1ccccc1 Amb25356846 [0,1,0,0,0,0|1,1,1]=4 1394 B13R1.352 CC(c1ccccc1)NS(=O)(=O)Cl Amb17193931 [0,1,0,0,0,0|3,0,0]=4 1395 B13R1.352 CC(c1cccnc1)NS(=O)(=O)C Amb10689913 [0,1,0,0,0,0|3,0,0]=4 1396 B13R1.352 CS(=O)(=O)CC(Br)c1ccccc1 Amb24692327 [0,1,0,0,0,0|3,0,0]=4 1397 B13R1.352 CS(=O)(=O)CC(Cl)c1ccccc1 Amb24493976 [0,1,0,0,0,0|3,0,0]=4 1398 B13R1.352 CS(=O)(=O)CC(N)c1ccccc1 Amb20623795 [0,1,0,0,0,0|3,0,0]=4 1399 B13R1.352 CS(=O)(=O)C[C@@H](N)c1ccccc1 Amb25244157 [0,1,0,0,0,0|3,0,0]=4 1400 B13R1.352 CS(=O)(=O)C[C@H](Cl)c1ccccc1 Amb25192673 [0,1,0,0,0,0|3,0,0]=4 1401 B13R1.352 CS(=O)(=O)OI(O)c1ccccc1 Amb22729227 [0,1,0,0,0,0|3,0,0]=4 1402 B13R1.352 C[C@@H](NS(=O)(=O)Cl)c1ccccc1 Amb25039374 [0,1,0,0,0,0|3,0,0]=4 1403 B13R1.352 C[C@@H](NS(C)(=O)=O)c1cc[n]cc1 Amb24520940 [0,1,0,0,0,0|3,0,0]=4 1404 B13R1.352 C[C@@H](NS(N)(=O)=O)c1ccccc1 Amb25371487 [0,1,0,0,0,0|3,0,0]=4 1405 B13R1.352 C[C@H](NS(C)(=O)=O)c1cccc[n]1 Amb24706179 [0,1,0,0,0,0|3,0,0]=4 1406 B13R1.352 C[C@H](NS(C)(=O)=O)c1ccccc1 Amb25675397 [0,1,0,0,0,0|2,0,0]=3 1407 B13R1.352 NC(c1ccccc1)CS(=O)(=O)C Amb13951879 [0,1,0,0,0,0|3,0,0]=4 1408 B13R1.713 BrCC(c1ccccc1)CC(C)C Amb17255495 [0,1,0,0,0,0|2,0,1]=4 1409 B13R1.713 C=CC(CC(O)=O)c1ccccc1 Amb18647968 [0,1,0,0,0,0|2,0,1]=4 1410 B13R1.713 C=CC(c1ccccc1)CC(=O)C Amb17594412 [0,1,0,0,0,0|1,0,1]=3 1411 B13R1.713 CC(=C)\C=C(\CO)/c1ccccc1 Amb24415000 [0,1,0,0,0,0|2,0,1]=4 1412 B13R1.713 CC(=O)CC(C#N)c1cc[n]cc1 Amb25694281 [0,1,0,0,0,0|2,0,1]=4 1413 B13R1.713 CC(=O)CC(C#N)c1cccc[n]1 Amb24644006 [0,1,0,0,0,0|2,0,1]=4 1414 B13R1.713 CC(=O)CN(C#N)c1ccccc1 Amb25788679 [0,1,0,0,0,0|2,0,1]=4 1415 B13R1.713 CC(=O)C[C@H](C#C)c1ccccc1 Amb25086564 [0,1,0,0,0,0|1,0,1]=3 1416 B13R1.713 CC(=O)C\C(=N\C)\c1ccccc1 Amb25718365 [0,1,0,0,0,0|1,0,1]=3 1417 B13R1.713 CC(=O)NC(C#C)c1ccccc1 Amb22372050 [0,1,0,0,0,0|1,0,1]=3 1418 B13R1.713 CC(=O)NC(C#N)c1ccccc1 Amb17845067 [0,1,0,0,0,0|1,0,1]=3 1419 B13R1.713 CC(=O)NC(CC)c1c[n]ccc1 Amb25086723 [0,1,0,0,0,0|2,0,0]=3 1420 B13R1.713 CC(=O)NC(CC)c1cc[n]cc1 Amb25263640 [0,1,0,0,0,0|2,0,0]=3 1421 B13R1.713 CC(=O)NC(CC)c1cccc[n]1 Amb25288313 [0,1,0,0,0,0|2,0,0]=3 1422 B13R1.713 CC(=O)NC(CF)c1ccccc1 Amb24071988 [0,1,0,0,0,0|1,0,0]=2 1423 B13R1.713 CC(=O)NC(CN)c1ccccc1 Amb18909054 [0,1,0,0,0,0|1,0,0]=2 1424 B13R1.713 CC(=O)N[C@@H](CC)c1cc[n]cc1 Amb25690862 [0,1,0,0,0,0|2,0,0]=3 1425 B13R1.713 CC(=O)N[C@@H](CO)c1ccccc1 Amb22801576 [0,1,0,0,0,0|1,0,0]=2 1426 B13R1.713 CC(=O)N[C@H](CC)c1ccccc1 Amb25278238 [0,1,0,0,0,0|1,0,0]=2 1427 B13R1.713 CC(=O)N[C@H](CF)c1ccccc1 Amb24674275 [0,1,0,0,0,0|1,0,0]=2 1428 B13R1.713 CC(=O)N[C@H](CO)c1ccccc1 Amb25366132 [0,1,0,0,0,0|1,0,0]=2 1429 B13R1.713 CC(=O)N\C(=C\C)\c1ccccc1 Amb24741868 [0,1,0,0,0,0|1,0,1]=3 1430 B13R1.713 CC(=O)N\C(=C\Cl)\c1ccccc1 Amb25847148 [0,1,0,0,0,0|1,0,2]=4 1431 B13R1.713 CC(=O)OC(C#N)c1ccc[n]c1 Amb19650951 [0,1,0,0,0,0|1,0,1]=3 1432 B13R1.713 CC(=O)OC(C#N)c1cccc[n]1 Amb25336474 [0,1,0,0,0,0|1,0,1]=3 1433 B13R1.713 CC(=O)OC(C#N)c1ccccc1 Amb25117906 [0,1,0,0,0,0|0,0,1]=2 1434 B13R1.713 CC(=O)OC(CC)c1ccccc1 Amb24064892 [0,1,0,0,0,0|0,0,0]=1 1435 B13R1.713 CC(=O)OC(CN)c1ccccc1 Amb20246079 [0,1,0,0,0,0|0,0,0]=1 1436 B13R1.713 CC(=O)O[C@@H](C#N)c1ccccc1 Amb22225382 [0,1,0,0,0,0|0,0,1]=2 1437 B13R1.713 CC(=O)\C=C(/CC)\c1ccccc1 Amb25718266 [0,1,0,0,0,0|1,0,1]=3 1438 B13R1.713 CC(=O)\C=C(\C#N)/c1ccccc1 Amb25282698 [0,1,0,0,0,0|1,0,2]=4 1439 B13R1.713 CC(=O)\C=C(\C=C)/c1ccccc1 Amb25179606 [0,1,0,0,0,0|1,0,2]=4 1440 B13R1.713 CC(=O)\C=C(\C=O)/c1ccccc1 Amb24610113 [0,1,0,0,0,0|1,0,2]=4 1441 B13R1.713 CC(=O)\C=C(\OC)/c1ccccc1 Amb25714347 [0,1,0,0,0,0|1,0,1]=3 1442 B13R1.713 CC(=S)N[C@@H](CO)c1ccccc1 Amb25689720 [0,1,0,0,0,0|1,1,0]=3 1443 B13R1.713 CC(C)=CC(NC)c1cccc[n]1 Amb24610532 [0,1,0,0,0,0|3,0,0]=4 1444 B13R1.713 CC(C)=CC(NC)c1ccccc1 Amb25128430 [0,1,0,0,0,0|2,0,0]=3 1445 B13R1.713 CC(C)=CC(NN)c1ccccc1 Amb25157435 [0,1,0,0,0,0|3,0,0]=4 1446 B13R1.713 CC(C)=N[C@H](CO)c1ccccc1 Amb25855749 [0,1,0,0,0,0|2,0,0]=3 1447 B13R1.713 CC(C)OC(C#N)c1ccccc1 Amb25323301 [0,1,0,0,0,0|1,0,2]=4 1448 B13R1.713 CC(N)CC(CC)c1ccccc1 Amb24064889 [0,1,0,0,0,0|2,0,1]=4 1449 B13R1.713 CC(O)CC(CN)c1ccccc1 Amb20668981 [0,1,0,0,0,0|1,0,2]=4 1450 B13R1.713 CCC(CN(C)C)c1ccccc1 Amb22491733 [0,1,0,0,0,0|3,0,0]=4 1451 B13R1.713 CCC(NC(C)=O)c1ccccc1 Amb17844502 [0,1,0,0,0,0|1,0,0]=2 1452 B13R1.713 CCC(NC(N)=N)c1ccccc1 Amb18184206 [0,1,0,0,0,0|3,0,0]=4 1453 B13R1.713 CCC(NC(N)=O)c1ccccc1 Amb18186211 [0,1,0,0,0,0|2,0,0]=3 1454 B13R1.713 CCC(NC(N)=S)c1ccccc1 Amb19063182 [0,1,0,0,0,0|2,1,0]=4 1455 B13R1.713 CCC(c1ccccc1)CC(=O)N Amb17233286 [0,1,0,0,0,0|2,0,0]=3 1456 B13R1.713 CCN(c1ccccc1)CC(=O)Cl Amb17143179 [0,1,0,0,0,0|3,0,0]=4 1457 B13R1.713 CCN(c1ccccc1)CC(=O)O Amb10609568 [0,1,0,0,0,0|3,0,0]=4 1458 B13R1.713 CC[C@@H](NC(N)=O)c1ccccc1 Amb25320982 [0,1,0,0,0,0|2,0,0]=3 1459 B13R1.713 CC[C@@H](c1ccccc1)NC(=O)C Amb10559459 [0,1,0,0,0,0|1,0,0]=2 1460 B13R1.713 CC[C@H](NC(N)=N)c1ccccc1 Amb24628798 [0,1,0,0,0,0|3,0,0]=4 1461 B13R1.713 CC\C(=C/C(=O)Cl)\c1ccccc1 Amb25786405 [0,1,0,0,0,0|2,0,1]=4 1462 B13R1.713 CC\C(=C\C(=O)Cl)\c1ccccc1 Amb24518612 [0,1,0,0,0,0|2,0,1]=4 1463 B13R1.713 CN(C)NC(CN)c1ccccc1 Amb18563043 [0,1,0,0,0,0|3,0,0]=4 1464 B13R1.713 CNC(c1ccccc1)CN(C)C Amb10068793 [0,1,0,0,0,0|3,0,0]=4 1465 B13R1.713 CO\C(=C/C(=O)C)\c1ccccc1 Amb17594477 [0,1,0,0,0,0|1,0,1]=3 1466 B13R1.713 CO\C(=C\C(O)=O)\c1ccccc1 Amb25786653 [0,1,0,0,0,0|2,0,1]=4 1467 B13R1.713 CS\C(=C\C(O)=O)\c1ccccc1 Amb18130096 [0,1,0,0,0,0|2,0,1]=4 1468 B13R1.713 C\C=C(\CC(O)=O)/c1ccccc1 Amb24433905 [0,1,0,0,0,0|2,0,1]=4 1469 B13R1.713 C\C=C(\NC(N)=O)/c1ccccc1 Amb24649980 [0,1,0,0,0,0|2,0,1]=4 1470 B13R1.713 C\N=C(\NC(N)=O)/c1ccccc1 Amb25829483 [0,1,0,0,0,0|2,0,1]=4 1471 B13R1.713 ClCC(c1ccccc1)CC(C)C Amb17236522 [0,1,0,0,0,0|2,0,1]=4 1472 B13R1.713 N#CC(c1ccccc1)CC(=O)C Amb1019551 [0,1,0,0,0,0|1,0,1]=3 1473 B13R1.713 N#CC(c1ccccc1)CC(=O)O Amb16191991 [0,1,0,0,0,0|2,0,1]=4 1474 B13R1.713 N#CC(c1ccccc1)NC(=O)N Amb1077552 [0,1,0,0,0,0|2,0,1]=4 1475 B13R1.713 N#CC(c1ccccn1)NC(=O)C Amb17335038 [0,1,0,0,0,0|2,0,1]=4 1476 B13R1.713 N#CC(c1cccnc1)NC(=O)C Amb17335039 [0,1,0,0,0,0|2,0,1]=4 1477 B13R1.713 N#CC(c1ccncc1)NC(=O)C Amb17335040 [0,1,0,0,0,0|2,0,1]=4 1478 B13R1.713 NC(=N)NC(CO)c1ccccc1 Amb25770222 [0,1,0,0,0,0|3,0,0]=4 1479 B13R1.713 NC(=O)CC(CN)c1ccccc1 Amb23441535 [0,1,0,0,0,0|2,0,0]=3 1480 B13R1.713 NC(=O)NC(CF)c1ccccc1 Amb25072193 [0,1,0,0,0,0|2,0,0]=3 1481 B13R1.713 NC(=O)NC(CN)c1ccccc1 Amb18909103 [0,1,0,0,0,0|2,0,0]=3 1482 B13R1.713 NC(=O)N[C@H](CO)c1ccccc1 Amb25821890 [0,1,0,0,0,0|2,0,0]=3 1483 B13R1.713 NC(=O)OC(C#N)c1ccccc1 Amb25101575 [0,1,0,0,0,0|1,0,1]=3 1484 B13R1.713 NC(=O)SC(C#N)c1ccccc1 Amb25697148 [0,1,0,0,0,0|1,1,1]=4 1485 B13R1.713 NC(N)=N[C@@H](CO)c1ccccc1 Amb24741294 [0,1,0,0,0,0|3,0,0]=4 1486 B13R1.713 NCC(CC(O)=O)c1ccccc1 Amb22047642 [0,1,0,0,0,0|2,0,0]=3 1487 B13R1.713 NCC(c1ccccc1)CC(=O)O Amb1033044 [0,1,0,0,0,0|2,0,0]=3 1488 B13R1.713 NCC(c1ccccc1)OC(C)C Amb17605965 [0,1,0,0,0,0|1,0,1]=3 1489 B13R1.713 NCC(c1ccccn1)CC(=O)O Amb17400757 [0,1,0,0,0,0|3,0,0]=4 1490 B13R1.713 NCC(c1cccnc1)CC(=O)O Amb17400760 [0,1,0,0,0,0|3,0,0]=4 1491 B13R1.713 NCC(c1ccncc1)CC(=O)O Amb17400762 [0,1,0,0,0,0|3,0,0]=4 1492 B13R1.713 NC[C@@H](CC(O)=O)c1ccccc1 Amb20241745 [0,1,0,0,0,0|2,0,0]=3 1493 B13R1.713 NC[C@@H](CC(O)=O)c1ccccc1 Amb22747178 [0,1,0,0,0,0|2,0,0]=3 1494 B13R1.713 NC[C@H](CC(O)=O)c1ccccc1 Amb20241740 [0,1,0,0,0,0|2,0,0]=3 1495 B13R1.713 NNC(CC(O)=O)c1ccccc1 Amb19861028 [0,1,0,0,0,0|3,0,0]=4 1496 B13R1.713 OC(=O)\C=C(\CO)/c1ccccc1 Amb18128123 [0,1,0,0,0,0|2,0,1]=4 1497 B13R1.713 OCC(c1ccccc1)CC(C)C Amb17233456 [0,1,0,0,0,0|2,0,1]=4 1498 B13R1.713 OCC(c1ccccc1)NC(=O)C Amb17138902 [0,1,0,0,0,0|1,0,0]=2 1499 B13R2.10 BrC=1CCN(N1)c2ccccc2 Amb25224096 [0,0,0,1,0,0|3,0,0]=4 1500 B13R2.10 C=C1COC(C1)c2ccccc2 Amb25692265 [0,0,0,1,0,0|3,0,0]=4 1501 B13R2.10 CC1=NC(CO1)c2ccccc2 Amb24754160 [0,0,0,1,0,0|1,0,1]=3 1502 B13R2.10 CC1CC(CN1)c2ccccc2 Amb18563524 [0,0,0,1,0,0|2,0,1]=4 1503 B13R2.10 CC1CNC(O1)c2ccccc2 Amb18563573 [0,0,0,1,0,0|2,0,1]=4 1504 B13R2.10 CC1NC(CS1)c2ccccc2 Amb25375933 [0,0,0,1,0,0|1,1,1]=4 1505 B13R2.10 CC1N[C@H](CO1)c2ccccc2 Amb25150915 [0,0,0,1,0,0|1,0,2]=4 1506 B13R2.10 CC=1CC(NN1)c2ccccc2 Amb24069512 [0,0,0,1,0,0|3,0,0]=4 1507 B13R2.10 CC=1CNC(C1)c2ccccc2 Amb24727039 [0,0,0,1,0,0|3,0,0]=4 1508 B13R2.10 CC=1COC(C1)c2ccccc2 Amb25174191 [0,0,0,1,0,0|3,0,0]=4 1509 B13R2.10 CC=1CP(CC1)c2ccccc2 Amb22734694 [0,0,0,1,0,0|3,0,0]=4 1510 B13R2.10 CC=1NC(CN1)c2c[n]ccc2 Amb24085204 [0,0,0,1,0,0|3,0,0]=4 1511 B13R2.10 CN1CCC(O1)c2ccccc2 Amb22304711 [0,0,0,1,0,0|2,0,0]=3 1512 B13R2.10 C[C@@H]1CC[C@H](N1)c2ccccc2 Amb24627148 [0,0,0,1,0,0|2,0,1]=4 1513 B13R2.10 C[C@H]1CC[C@H](N1)c2ccccc2 Amb24519292 [0,0,0,1,0,0|2,0,1]=4 1514 B13R2.10 C[C@H]1NC[C@H](S1)c2ccccc2 Amb25327843 [0,0,0,1,0,0|1,1,1]=4 1515 B13R2.10 Cc1ccc(o1)-c2ccccc2 Amb25743959 [0,0,0,1,0,0|1,0,2]=4 1516 B13R2.10 Cc1nnc(o1)c2ccccc2 Amb16204058 [0,0,0,1,0,0|2,0,1]=4 1517 B13R2.10 N=C1CC(CN1)c2ccccc2 Amb25363924 [0,0,0,1,0,0|3,0,0]=4 1518 B13R2.10 N=C1N[C@H](CO1)c2ccccc2 Amb25326051 [0,0,0,1,0,0|2,0,1]=4 1519 B13R2.10 NC1=NC(CO1)c2ccccc2 Amb17619912 [0,0,0,1,0,0|2,0,1]=4 1520 B13R2.10 NC1=NCC(O1)c2ccccc2 Amb17608294 [0,0,0,1,0,0|2,0,0]=3 1521 B13R2.10 NC1=NCC(S1)c2ccccc2 Amb25060735 [0,0,0,1,0,0|2,1,0]=4 1522 B13R2.10 NC1CCC(C1)c2ccccc2 Amb17400101 [0,0,0,1,0,0|2,0,1]=4 1523 B13R2.10 NC1NCC(O1)c2ccccc2 Amb25135649 [0,0,0,1,0,0|2,0,1]=4 1524 B13R2.10 NC=1CCC(N1)c2ccccc2 Amb24391515 [0,0,0,1,0,0|2,0,0]=3 1525 B13R2.10 O=C1C=C(CO1)c2ccccc2 Amb24633865 [0,0,0,1,0,0|2,0,1]=4 1526 B13R2.10 O=C1C=CC(N1)c2ccccc2 Amb25311888 [0,0,0,1,0,0|1,0,2]=4 1527 B13R2.10 O=C1C=CC(O1)c2ccccc2 Amb24090251 [0,0,0,1,0,0|0,0,2]=3 1528 B13R2.10 O=C1CC(CC1)c2c[n]c[n]c2 Amb25233832 [0,0,0,1,0,0|3,0,0]=4 1529 B13R2.10 O=C1CC(CC1)c2c[n]cc[n]2 Amb24413348 [0,0,0,1,0,0|3,0,0]=4 1530 B13R2.10 O=C1CC=C(N1)c2ccccc2 Amb25130705 [0,0,0,1,0,0|1,0,2]=4 1531 B13R2.10 O=C1CC=C(O1)c2ccccc2 Amb10570673 [0,0,0,1,0,0|0,0,2]=3 1532 B13R2.10 O=C1CCC(=C1)c2ccccc2 Amb10669546 [0,0,0,1,0,0|1,0,1]=3 1533 B13R2.10 O=C1CCC(=C1)c2ccccn2 Amb17138484 [0,0,0,1,0,0|2,0,1]=4 1534 B13R2.10 O=C1CCC(=C1)c2cccnc2 Amb17138485 [0,0,0,1,0,0|2,0,1]=4 1535 B13R2.10 O=C1CCC(=C1)c2ccncc2 Amb17138486 [0,0,0,1,0,0|2,0,1]=4 1536 B13R2.10 O=C1CCC(C1)c2ccccc2 Amb17138497 [0,0,0,1,0,0|1,0,0]=2 1537 B13R2.10 O=C1CCC(C1)c2ccccn2 Amb17138526 [0,0,0,1,0,0|2,0,0]=3 1538 B13R2.10 O=C1CCC(C1)c2cccnc2 Amb17138527 [0,0,0,1,0,0|2,0,0]=3 1539 B13R2.10 O=C1CCC(C1)c2ccncc2 Amb17138528 [0,0,0,1,0,0|2,0,0]=3 1540 B13R2.10 O=C1CCC(N1)c2cccc[n]2 Amb25237487 [0,0,0,1,0,0|2,0,0]=3 1541 B13R2.10 O=C1CCC(N1)c2ccccc2 Amb17470413 [0,0,0,1,0,0|1,0,0]=2 1542 B13R2.10 O=C1CCC(N1)c2cccnc2 Amb17618670 [0,0,0,1,0,0|2,0,0]=3 1543 B13R2.10 O=C1CCC(O1)c2cccnc2 Amb17619714 [0,0,0,1,0,0|1,0,0]=2 1544 B13R2.10 O=C1CC[C@@H](N1)c2ccc[n]c2 Amb25233097 [0,0,0,1,0,0|2,0,0]=3 1545 B13R2.10 O=C1CN(CC1)c2cc[n]cc2 Amb23449311 [0,0,0,1,0,0|3,0,0]=4 1546 B13R2.10 O=C1CN(CN1)c2ccccc2 Amb24079614 [0,0,0,1,0,0|3,0,0]=4 1547 B13R2.10 O=C1CN=C(N1)c2ccccc2 Amb17842816 [0,0,0,1,0,0|2,0,1]=4 1548 B13R2.10 O=C1CNC(C1)c2ccccc2 Amb23437185 [0,0,0,1,0,0|2,0,0]=3 1549 B13R2.10 O=C1CNC(N1)c2c[n]ccc2 Amb25188367 [0,0,0,1,0,0|3,0,0]=4 1550 B13R2.10 O=C1CNC(N1)c2ccccc2 Amb24342220 [0,0,0,1,0,0|2,0,0]=3 1551 B13R2.10 O=C1COC(=C1)c2ccccc2 Amb24090252 [0,0,0,1,0,0|2,0,1]=4 1552 B13R2.10 O=C1COC(C1)c2ccccc2 Amb25830079 [0,0,0,1,0,0|2,0,0]=3 1553 B13R2.10 O=C1COC(N1)c2ccccc2 Amb25766459 [0,0,0,1,0,0|2,0,0]=3 1554 B13R2.10 O=C1CO[C@@H](N1)c2ccccc2 Amb24366993 [0,0,0,1,0,0|2,0,0]=3 1555 B13R2.10 O=C1CSC(=N1)c2ccccc2 Amb16231550 [0,0,0,1,0,0|2,0,1]=4 1556 B13R2.10 O=C1CSC(=N1)c2ccccc2 Amb2384341 [0,0,0,1,0,0|2,0,1]=4 1557 B13R2.10 O=C1CSC(C1)c2ccccc2 Amb25702041 [0,0,0,1,0,0|2,0,0]=3 1558 B13R2.10 O=C1CSC(N1)c2ccccc2 Amb2221753 [0,0,0,1,0,0|2,0,0]=3 1559 B13R2.10 O=C1CSC(O1)c2ccccc2 Amb25793869 [0,0,0,1,0,0|1,0,0]=2 1560 B13R2.10 O=C1C[C@@H](CC1)c2ccccc2 Amb24323281 [0,0,0,1,0,0|1,0,0]=2 1561 B13R2.10 O=C1C[C@@H](CN1)c2ccccc2 Amb23401452 [0,0,0,1,0,0|2,0,0]=3 1562 B13R2.10 O=C1C[C@H](CC1)c2ccccc2 Amb24484347 [0,0,0,1,0,0|1,0,0]=2 1563 B13R2.10 O=C1C[C@H](CN1)c2ccccc2 Amb25277165 [0,0,0,1,0,0|2,0,0]=3 1564 B13R2.10 O=C1NC(CS1)c2ccccc2 Amb23439132 [0,0,0,1,0,0|2,0,0]=3 1565 B13R2.10 O=C1NCC(C1)c2ccccc2 Amb1772919 [0,0,0,1,0,0|2,0,0]=3 1566 B13R2.10 O=C1NCC(C1)c2ccccn2 Amb13952281 [0,0,0,1,0,0|3,0,0]=4 1567 B13R2.10 O=C1NCC(C1)c2cccnc2 Amb13783612 [0,0,0,1,0,0|3,0,0]=4 1568 B13R2.10 O=C1NCC(C1)c2ccncc2 Amb17400108 [0,0,0,1,0,0|3,0,0]=4 1569 B13R2.10 O=C1NCC(N1)c2c[n]ccc2 Amb24346599 [0,0,0,1,0,0|3,0,0]=4 1570 B13R2.10 O=C1NCC(N1)c2cccc[n]2 Amb25331915 [0,0,0,1,0,0|3,0,0]=4 1571 B13R2.10 O=C1NCC(N1)c2ccccc2 Amb22056050 [0,0,0,1,0,0|2,0,0]=3 1572 B13R2.10 O=C1NCC(O1)c2cc[n]cc2 Amb18639408 [0,0,0,1,0,0|2,0,0]=3 1573 B13R2.10 O=C1NCC(O1)c2cccc[n]2 Amb18639394 [0,0,0,1,0,0|2,0,0]=3 1574 B13R2.10 O=C1NCC(O1)c2ccccc2 Amb16232576 [0,0,0,1,0,0|1,0,0]=2 1575 B13R2.10 O=C1NCC(O1)c2cccnc2 Amb17232462 [0,0,0,1,0,0|2,0,0]=3 1576 B13R2.10 O=C1NC[C@@H](N1)c2cccc[n]2 Amb24730704 [0,0,0,1,0,0|3,0,0]=4 1577 B13R2.10 O=C1NC[C@@H](N1)c2ccccc2 Amb24568910 [0,0,0,1,0,0|2,0,0]=3 1578 B13R2.10 O=C1NC[C@@H](O1)c2ccccc2 Amb22338660 [0,0,0,1,0,0|1,0,0]=2 1579 B13R2.10 O=C1NC[C@H](N1)c2c[n]ccc2 Amb25251578 [0,0,0,1,0,0|3,0,0]=4 1580 B13R2.10 O=C1NC[C@H](N1)c2cccc[n]2 Amb24492823 [0,0,0,1,0,0|3,0,0]=4 1581 B13R2.10 O=C1NC[C@H](N1)c2ccccc2 Amb25054081 [0,0,0,1,0,0|2,0,0]=3 1582 B13R2.10 O=C1NC[C@H](O1)c2ccccc2 Amb24574681 [0,0,0,1,0,0|1,0,0]=2 1583 B13R2.10 O=C1NC[C@H](S1)c2ccccc2 Amb25246623 [0,0,0,1,0,0|1,1,0]=3 1584 B13R2.10 O=C1NN=C(O1)c2ccccc2 Amb19654483 [0,0,0,1,0,0|2,0,1]=4 1585 B13R2.10 O=C1N[C@@H](CO1)c2cc[n]cc2 Amb24731875 [0,0,0,1,0,0|3,0,0]=4 1586 B13R2.10 O=C1N[C@@H](CS1)c2ccccc2 Amb24653499 [0,0,0,1,0,0|2,0,0]=3 1587 B13R2.10 O=C1N[C@H](CO1)c2ccc[n]c2 Amb25159332 [0,0,0,1,0,0|3,0,0]=4 1588 B13R2.10 O=C1OC(=NS1)c2ccccc2 Amb21871013 [0,0,0,1,0,0|2,0,1]=4 1589 B13R2.10 O=C1SSC(C1)c2ccccc2 Amb16757360 [0,0,0,1,0,0|3,0,0]=4 1590 B13R2.10 OC1=NN(CC1)c2ccccc2 Amb1811510 [0,0,0,1,0,0|2,0,1]=4 1591 B13R2.10 OC1CCC(C1)c2ccccc2 Amb17400115 [0,0,0,1,0,0|1,0,2]=4 1592 B13R2.10 OC1CCC(O1)c2c[n]ccc2 Amb25284284 [0,0,0,1,0,0|1,0,2]=4 1593 B13R2.10 OC1CCC(O1)c2cc[n]cc2 Amb25704378 [0,0,0,1,0,0|1,0,2]=4 1594 B13R2.10 OC1CCC(O1)c2ccccc2 Amb22752551 [0,0,0,1,0,0|0,0,2]=3 1595 B13R2.10 OC1CC[C@@H](O1)c2ccccc2 Amb22752552 [0,0,0,1,0,0|0,0,2]=3 1596 B13R2.10 OC=1CC(CN1)c2ccccc2 Amb19866679 [0,0,0,1,0,0|2,0,1]=4 1597 B13R2.10 S=C1CSC(N1)c2ccccc2 Amb24451187 [0,0,0,1,0,0|2,1,0]=4 1598 B13R2.10 S=C1NC(CS1)c2ccccc2 Amb24101079 [0,0,0,1,0,0|2,1,0]=4 1599 B13R2.10 S=C1NCC(S1)c2ccccc2 Amb10810186 [0,0,0,1,0,0|1,2,0]=4 1600 B13R2.10 S=C1NC[C@@H](O1)c2ccccc2 Amb24728461 [0,0,0,1,0,0|1,1,0]=3 1601 B13R2.10 S=C1NC[C@H](S1)c2ccccc2 Amb25150880 [0,0,0,1,0,0|1,2,0]=4 1602 B13R2.238 CC1(CC(=O)C1)c2ccccc2 Amb19373258 [0,0,0,1,0,0|1,0,0]=2 1603 B13R2.238 CC1(CC(=O)N1)c2cc[n]cc2 Amb25152369 [0,0,0,1,0,0|2,0,0]=3 1604 B13R2.238 CC1(CC(=O)N1)c2ccc[n]c2 Amb25152364 [0,0,0,1,0,0|2,0,0]=3 1605 B13R2.238 CC1(CC(=O)N1)c2cccc[n]2 Amb25128326 [0,0,0,1,0,0|2,0,0]=3 1606 B13R2.238 CC1(CC(=O)N1)c2ccccc2 Amb23444108 [0,0,0,1,0,0|1,0,0]=2 1607 B13R2.238 CC1(CC(N)C1)c2ccccc2 Amb19373291 [0,0,0,1,0,0|2,0,1]=4 1608 B13R2.238 C[C@@]1(CC(=O)N1)c2ccccc2 Amb24532712 [0,0,0,1,0,0|1,0,0]=2 1609 B13R2.238 C[C@]1(CC(=O)N1)c2ccccc2 Amb24343443 [0,0,0,1,0,0|1,0,0]=2 1610 B13R2.238 OC1(CC(=O)C1)c2ccccc2 Amb25729108 [0,0,0,1,0,0|2,0,0]=3 1611 B13R2.244 CC1C(c2ccccc21)C(O)=O Amb25108282 [0,0,0,1,0,0|2,0,0]=3 1612 B13R2.244 C[C@@H]1[C@H](c2ccccc21)C(O)=O Amb24550599 [0,0,0,1,0,0|2,0,0]=3 1613 B13R2.328 C=C1OC(=O)Nc2ccccc21 Amb24497158 [0,0,0,1,0,0|1,0,2]=4 1614 B13R2.328 CC1=CC(=O)Nc2ccccc21 Amb19654011 [0,0,0,1,0,0|2,0,1]=4 1615 B13R2.328 CC1=CC(=O)Oc2ccccc21 Amb20001467 [0,0,0,1,0,0|2,0,1]=4 1616 B13R2.328 CC1=Cc2ccccc2C(=O)O1 Amb20247502 [0,0,0,1,0,0|2,0,1]=4 1617 B13R2.328 CC1=Nc2ccccc2C(=O)O1 Amb18800494 [0,0,0,1,0,0|2,0,1]=4 1618 B13R2.328 CC1CC(=N)Nc2ccccc21 Amb24681069 [0,0,0,1,0,0|3,0,0]=4 1619 B13R2.328 CC1CC(=O)N=C2C=CC=CN21 Amb25080115 [0,0,0,1,0,0|3,0,0]=4 1620 B13R2.328 CC1CC(=O)Nc2ccccc12 Amb17836212 [0,0,0,1,0,0|2,0,0]=3 1621 B13R2.328 CC1CN(C)Cc2ccccc21 Amb17971060 [0,0,0,1,0,0|3,0,0]=4 1622 B13R2.328 CC1Cc2[n]cccc2C(C)O1 Amb25152352 [0,0,0,1,0,0|2,0,1]=4 1623 B13R2.328 CC1Cc2ccccc2C(C)N1 Amb18829882 [0,0,0,1,0,0|2,0,1]=4 1624 B13R2.328 CC1NC(=O)Cc2cc[n]cc21 Amb25159362 [0,0,0,1,0,0|2,0,0]=3 1625 B13R2.328 CC1NC(=O)Cc2ccccc21 Amb23454628 [0,0,0,1,0,0|1,0,0]=2 1626 B13R2.328 CC1NC(=O)Nc2ccccc21 Amb22756019 [0,0,0,1,0,0|2,0,0]=3 1627 B13R2.328 CC1NC(=O)Oc2ccccc21 Amb25823463 [0,0,0,1,0,0|2,0,0]=3 1628 B13R2.328 CC1NC(=S)Nc2ccccc21 Amb25751539 [0,0,0,1,0,0|2,1,0]=4 1629 B13R2.328 CC1NC(C)c2ccccc2O1 Amb25770676 [0,0,0,1,0,0|1,0,2]=4 1630 B13R2.328 CC1NC(N)=Nc2ccccc21 Amb25106087 [0,0,0,1,0,0|3,0,0]=4 1631 B13R2.328 CC1Nc2ccccc2C(C)O1 Amb25095786 [0,0,0,1,0,0|1,0,1]=3 1632 B13R2.328 CC1OC(=O)Nc2ccccc21 Amb25063171 [0,0,0,1,0,0|1,0,0]=2 1633 B13R2.328 CC1OC(C)c2ccccc2O1 Amb17940033 [0,0,0,1,0,0|0,0,2]=3 1634 B13R2.328 CC1OC(O)Cc2ccccc21 Amb24355171 [0,0,0,1,0,0|0,0,2]=3 1635 B13R2.328 CC=1CN(C)c2ccccc2N1 Amb24591845 [0,0,0,1,0,0|3,0,0]=4 1636 B13R2.328 CC=1NC(=O)C=C2C=CC=CC21 Amb22371049 [0,0,0,1,0,0|1,0,2]=4 1637 B13R2.328 CC=1NC(=O)N=C2C=CC=CC21 Amb22493795 [0,0,0,1,0,0|2,0,1]=4 1638 B13R2.328 CN1CC(=O)Nc2ccccc12 Amb21864918 [0,0,0,1,0,0|3,0,0]=4 1639 B13R2.328 CS1=NC(=O)Nc2ccccc12 Amb25372251 [0,0,0,1,0,0|3,0,0]=4 1640 B13R2.328 C[C@@H]1CC(=O)Nc2ccccc21 Amb24445921 [0,0,0,1,0,0|2,0,0]=3 1641 B13R2.328 C[C@H]1CC(=O)Nc2ccccc21 Amb25335663 [0,0,0,1,0,0|2,0,0]=3 1642 B13R2.328 C[C@H]1C[C@@H](C)c2ccccc2N1 Amb25360226 [0,0,0,1,0,0|2,0,1]=4 1643 B13R2.328 C[C@H]1NC(=O)Cc2ccccc21 Amb25315064 [0,0,0,1,0,0|1,0,0]=2 1644 B13R2.328 C[C@H]1N[C@@H](C)c2ccccc2O1 Amb24666555 [0,0,0,1,0,0|1,0,2]=4 1645 B13R2.328 Cc1[n]c2ccccc2c(C)[n]1 Amb19957953 [0,0,0,1,0,0|2,0,1]=4 1646 B13R2.328 Cc1cc2ccccc2c(C)[n]1 Amb24382962 [0,0,0,1,0,0|2,0,1]=4 1647 B13R2.328 Cc1nc2ccccc2c(=O)o1 Amb1216866 [0,0,0,1,0,0|2,0,1]=4 1648 B13R2.328 N=C1NC(=O)Cc2ccccc21 Amb25309609 [0,0,0,1,0,0|2,0,1]=4 1649 B13R2.328 NC1CC(=O)Nc2ccccc21 Amb22586933 [0,0,0,1,0,0|3,0,0]=4 1650 B13R2.328 NC1CC(=O)Oc2ccccc21 Amb25249264 [0,0,0,1,0,0|3,0,0]=4 1651 B13R2.328 N[C@@H]1CC(=O)Nc2ccccc21 Amb25766431 [0,0,0,1,0,0|3,0,0]=4 1652 B13R2.328 O=C1CC(C)c2c(C1)cccc2 Amb17594002 [0,0,0,1,0,0|1,0,0]=2 1653 B13R2.328 O=C1CC(N)c2c(N1)cccc2 Amb10607650 [0,0,0,1,0,0|3,0,0]=4 1654 B13R2.328 O=C1Cc2ccccc2C(=S)N1 Amb17843901 [0,0,0,1,0,0|2,0,1]=4 1655 B13R2.328 O=C1NC(=O)c2c(C1)cccc2 Amb1221580 [0,0,0,1,0,0|2,0,1]=4 1656 B13R2.328 O=C1OC(=O)Cc2[n]cccc12 Amb24559883 [0,0,0,1,0,0|2,0,1]=4 1657 B13R2.328 O=C1OC(=O)Nc2ccccc12 Amb18183505 [0,0,0,1,0,0|2,0,1]=4 1658 B13R2.328 O=C1OC(=O)c2c(C1)cccc2 Amb1157145 [0,0,0,1,0,0|1,0,1]=3 1659 B13R2.328 OC1CC(=O)Cc2ccccc21 Amb24707065 [0,0,0,1,0,0|2,0,0]=3 1660 B13R2.328 OC1NC(=O)Oc2ccccc21 Amb25278301 [0,0,0,1,0,0|3,0,0]=4 1661 B13R2.382 C=C1CC1C(O)c2ccccc2 Amb22363901 [0,0,0,1,0,0|3,0,0]=4 1662 B13R2.382 C=C1C[C@@H]1C(O)c2ccccc2 Amb25725445 [0,0,0,1,0,0|3,0,0]=4 1663 B13R2.382 CC=1CC1C(O)c2ccccc2 Amb24465590 [0,0,0,1,0,0|3,0,0]=4 1664 B13R2.382 OC(C1=CC1=O)c2ccccc2 Amb25059756 [0,0,0,1,0,0|2,0,1]=4 1665 B13R2.423 CC(=O)C1OC1c2ccccc2 Amb17594030 [0,0,0,1,0,0|2,0,0]=3 1666 B13R2.423 CC(=O)[C@@H]1CC1c2ccccc2 Amb25759554 [0,0,0,1,0,0|1,0,0]=2 1667 B13R2.423 CC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25168893 [0,0,0,1,0,0|1,0,0]=2 1668 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2cc[n]cc2 Amb25375191 [0,0,0,1,0,0|3,0,0]=4 1669 B13R2.423 CC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25174918 [0,0,0,1,0,0|2,0,0]=3 1670 B13R2.423 CC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24540267 [0,0,0,1,0,0|1,0,0]=2 1671 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2cc[n]cc2 Amb25174919 [0,0,0,1,0,0|3,0,0]=4 1672 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccc[n]c2 Amb24649931 [0,0,0,1,0,0|3,0,0]=4 1673 B13R2.423 CC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24601834 [0,0,0,1,0,0|2,0,0]=3 1674 B13R2.423 CC(C)C1CC1c2ccccc2 Amb24070198 [0,0,0,1,0,0|2,0,1]=4 1675 B13R2.423 CC(C)[C@@H]1C[C@H]1c2ccccc2 Amb25253110 [0,0,0,1,0,0|2,0,1]=4 1676 B13R2.423 CC(C)[C@H]1C[C@H]1c2ccccc2 Amb24068901 [0,0,0,1,0,0|2,0,1]=4 1677 B13R2.423 CC(C1CC1c2ccccc2)N Amb10610180 [0,0,0,1,0,0|2,0,1]=4 1678 B13R2.423 CC(C1CC1c2ccccc2)O Amb17605479 [0,0,0,1,0,0|1,0,2]=4 1679 B13R2.423 CC(O)[C@@H]1C[C@@H]1c2ccccc2 Amb25306520 [0,0,0,1,0,0|1,0,2]=4 1680 B13R2.423 C[C@H](O)[C@@H]1C[C@@H]1c2ccccc2 Amb24520371 [0,0,0,1,0,0|1,0,2]=4 1681 B13R2.423 C[C@H](O)[C@H]1C[C@@H]1c2ccccc2 Amb24583667 [0,0,0,1,0,0|1,0,2]=4 1682 B13R2.423 NC(=N)C1CC1c2ccccc2 Amb25242569 [0,0,0,1,0,0|3,0,0]=4 1683 B13R2.423 NC(=O)C1CC1c2ccc[n]c2 Amb25701875 [0,0,0,1,0,0|3,0,0]=4 1684 B13R2.423 NC(=O)C1CC1c2ccccc2 Amb24709280 [0,0,0,1,0,0|2,0,0]=3 1685 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2cc[n]cc2 Amb24678885 [0,0,0,1,0,0|3,0,0]=4 1686 B13R2.423 NC(=O)[C@@H]1C[C@@H]1c2ccc[n]c2 Amb24709317 [0,0,0,1,0,0|3,0,0]=4 1687 B13R2.423 NC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25294667 [0,0,0,1,0,0|3,0,0]=4 1688 B13R2.423 NC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24519129 [0,0,0,1,0,0|3,0,0]=4 1689 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2cc[n]cc2 Amb24724910 [0,0,0,1,0,0|3,0,0]=4 1690 B13R2.423 NC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb25227794 [0,0,0,1,0,0|2,0,0]=3 1691 B13R2.423 NC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24512021 [0,0,0,1,0,0|2,0,0]=3 1692 B13R2.423 O=C(Cl)C1CC1c2ccccc2 Amb24655655 [0,0,0,1,0,0|2,0,0]=3 1693 B13R2.423 O=C(Cl)C1C[C@H]1c2ccccc2 Amb25835857 [0,0,0,1,0,0|2,0,0]=3 1694 B13R2.423 O=C(Cl)C1OC1c2ccccc2 Amb25275213 [0,0,0,1,0,0|3,0,0]=4 1695 B13R2.423 O=C(Cl)[C@@H]1O[C@H]1c2ccccc2 Amb25205379 [0,0,0,1,0,0|3,0,0]=4 1696 B13R2.423 O=C(Cl)[C@H]1C[C@H]1c2ccccc2 Amb24654857 [0,0,0,1,0,0|2,0,0]=3 1697 B13R2.423 O=C(Cl)[C@H]1O[C@H]1c2ccccc2 Amb24621250 [0,0,0,1,0,0|3,0,0]=4 1698 B13R2.423 OC(=O)C1CC1c2cc[n]cc2 Amb19514911 [0,0,0,1,0,0|3,0,0]=4 1699 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2cccc[n]2 Amb25209805 [0,0,0,1,0,0|3,0,0]=4 1700 B13R2.423 OC(=O)[C@@H]1C[C@@H]1c2ccccc2 Amb17621816 [0,0,0,1,0,0|2,0,0]=3 1701 B13R2.423 OC(=O)[C@@H]1C[C@H]1c2cc[n]cc2 Amb25299768 [0,0,0,1,0,0|3,0,0]=4 1702 B13R2.423 OC(=O)[C@@H]1O[C@@H]1c2ccccc2 Amb25216955 [0,0,0,1,0,0|3,0,0]=4 1703 B13R2.423 OC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb24080018 [0,0,0,1,0,0|3,0,0]=4 1704 B13R2.423 OC(=O)[C@@H]1S[C@H]1c2ccccc2 Amb25286929 [0,0,0,1,0,0|3,0,0]=4 1705 B13R2.423 OC(=O)[C@H]1CC1c2cc[n]cc2 Amb24685293 [0,0,0,1,0,0|3,0,0]=4 1706 B13R2.423 OC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb10071353 [0,0,0,1,0,0|2,0,0]=3 1707 B13R2.423 OC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25231831 [0,0,0,1,0,0|2,0,0]=3 1708 B13R2.423 OC(=O)[C@H]1O[C@H]1c2ccccc2 Amb24519473 [0,0,0,1,0,0|3,0,0]=4 1709 B13R2.423 OS(=O)C1CC1c2ccccc2 Amb24747050 [0,0,0,1,0,0|3,0,0]=4 1710 B13R2.690 CC(CC1CO1)c2ccccc2 Amb18798136 [0,0,0,1,0,0|1,0,2]=4 1711 B13R2.690 CC(c1ccccc1)NC2CC2 Amb1114089 [0,0,0,1,0,0|2,0,1]=4 1712 B13R2.3201 CC1(C)NC1(C)c2ccccc2 Amb24056778 [0,0,0,1,0,0|2,0,1]=4 1713 B13R2.5881 CC(=O)CC1Cc2ccccc21 Amb25129209 [0,0,0,1,0,0|1,0,0]=2 1714 B13R2.5881 CC(=O)NC1Cc2ccccc12 Amb17778879 [0,0,0,1,0,0|1,0,0]=2 1715 B13R2.5881 CC(=O)OC1Cc2ccccc12 Amb17778687 [0,0,0,1,0,0|0,0,0]=1 1716 B13R2.5881 CC(=O)\C=C\1/Cc2ccccc21 Amb21948332 [0,0,0,1,0,0|1,0,1]=3 1717 B13R2.5881 CC(C)NC1Cc2ccccc21 Amb24749344 [0,0,0,1,0,0|2,0,1]=4 1718 B13R2.5881 CC(Cl)CC1Cc2ccccc21 Amb24570076 [0,0,0,1,0,0|2,0,1]=4 1719 B13R2.5881 CC(N)CC1Cc2ccccc21 Amb24738028 [0,0,0,1,0,0|2,0,1]=4 1720 B13R2.5881 CN(C)CC1Cc2ccccc21 Amb22446492 [0,0,0,1,0,0|3,0,0]=4 1721 B13R2.5881 NC(=N)CC1Cc2ccccc21 Amb25150145 [0,0,0,1,0,0|3,0,0]=4 1722 B13R2.5881 OC(=O)CC1Cc2ccccc21 Amb25279494 [0,0,0,1,0,0|2,0,0]=3 1723 B13R2.12159 CC1(O)OC(C)c2c[n]ccc12 Amb24487187 [0,0,0,1,0,0|1,0,2]=4 1724 B13R2.12159 CC1CC(C)(C)c2ccccc21 Amb25198302 [0,0,0,1,0,0|2,0,1]=4 1725 B13R2.12159 CC1CC(C)(O)c2ccccc21 Amb24359344 [0,0,0,1,0,0|1,0,2]=4 1726 B13R2.12159 CC1NS(=O)(=O)c2ccccc21 Amb22497137 [0,0,0,1,0,0|3,0,0]=4 1727 B11R1.36 BrC(c1ccccc1)C(=O)C Amb16234147 [0,0,0,0,1,0|1,0,0]=2 1728 B11R1.36 C=C(C(=O)Cl)c1ccccc1 Amb24687929 [0,0,0,0,1,0|1,0,2]=4 1729 B11R1.36 CC(=C)C(Cl)c1ccccc1 Amb25320926 [0,0,0,0,1,0|2,0,0]=3 1730 B11R1.36 CC(=C)C(N)c1cc[n]cc1 Amb25149238 [0,0,0,0,1,0|3,0,0]=4 1731 B11R1.36 CC(=C)C(N)c1ccc[n]c1 Amb25297470 [0,0,0,0,1,0|3,0,0]=4 1732 B11R1.36 CC(=C)C(N)c1ccccc1 Amb18124853 [0,0,0,0,1,0|2,0,0]=3 1733 B11R1.36 CC(=C)C(O)c1cc[n]cc1 Amb24447288 [0,0,0,0,1,0|3,0,0]=4 1734 B11R1.36 CC(=C)C(O)c1ccc[n]c1 Amb25687146 [0,0,0,0,1,0|3,0,0]=4 1735 B11R1.36 CC(=N)C(=O)c1ccccc1 Amb24612580 [0,0,0,0,1,0|2,0,1]=4 1736 B11R1.36 CC(=N)N(C)c1ccccc1 Amb24432936 [0,0,0,0,1,0|2,0,0]=3 1737 B11R1.36 CC(=O)C(=C)c1ccccc1 Amb24062191 [0,0,0,0,1,0|0,0,2]=3 1738 B11R1.36 CC(=O)C(=O)c1c[n]ccc1 Amb25152863 [0,0,0,0,1,0|2,0,1]=4 1739 B11R1.36 CC(=O)C(F)c1cc[n]cc1 Amb25739565 [0,0,0,0,1,0|2,0,0]=3 1740 B11R1.36 CC(=O)C(N)c1cccc[n]1 Amb25082427 [0,0,0,0,1,0|2,0,0]=3 1741 B11R1.36 CC(=O)C(N)c1ccccc1 Amb25131723 [0,0,0,0,1,0|1,0,0]=2 1742 B11R1.36 CC(=O)C(O)c1ccc[n]c1 Amb24486339 [0,0,0,0,1,0|2,0,0]=3 1743 B11R1.36 CC(=O)C(O)c1cccc[n]1 Amb24392468 [0,0,0,0,1,0|2,0,0]=3 1744 B11R1.36 CC(=O)C(c1ccccn1)C Amb17593714 [0,0,0,0,1,0|1,0,0]=2 1745 B11R1.36 CC(=O)C(c1ccccn1)Cl Amb17477809 [0,0,0,0,1,0|2,0,0]=3 1746 B11R1.36 CC(=O)C(c1cccnc1)Cl Amb17477811 [0,0,0,0,1,0|2,0,0]=3 1747 B11R1.36 CC(=O)N(C)c1[n]ccc[n]1 Amb24484056 [0,0,0,0,1,0|3,0,0]=4 1748 B11R1.36 CC(=O)N(C)c1c[n]cc[n]1 Amb25220782 [0,0,0,0,1,0|3,0,0]=4 1749 B11R1.36 CC(=O)N(C)c1cc[n]c[n]1 Amb25098245 [0,0,0,0,1,0|3,0,0]=4 1750 B11R1.36 CC(=O)N(C)c1cc[n]cc1 Amb25049376 [0,0,0,0,1,0|2,0,0]=3 1751 B11R1.36 CC(=O)N(C)c1cccc[n]1 Amb24096739 [0,0,0,0,1,0|2,0,0]=3 1752 B11R1.36 CC(=O)N(Cl)c1ccccc1 Amb17672882 [0,0,0,0,1,0|2,0,0]=3 1753 B11R1.36 CC(=O)[C@H](F)c1ccccc1 Amb24486354 [0,0,0,0,1,0|1,0,0]=2 1754 B11R1.36 CC(=O)[C@H](O)c1ccccc1 Amb25088683 [0,0,0,0,1,0|1,0,0]=2 1755 B11R1.36 CC(=S)N(C)c1cccc[n]1 Amb24096740 [0,0,0,0,1,0|2,1,0]=4 1756 B11R1.36 CC(Br)C(Br)c1ccccc1 Amb25067299 [0,0,0,0,1,0|2,0,1]=4 1757 B11R1.36 CC(Br)C(F)c1ccccc1 Amb24375780 [0,0,0,0,1,0|2,0,1]=4 1758 B11R1.36 CC(Br)C(N)c1ccccc1 Amb24542749 [0,0,0,0,1,0|2,0,1]=4 1759 B11R1.36 CC(Br)[C@@H](O)c1ccccc1 Amb25218214 [0,0,0,0,1,0|2,0,1]=4 1760 B11R1.36 CC(Br)[C@H](O)c1ccccc1 Amb25835623 [0,0,0,0,1,0|2,0,1]=4 1761 B11R1.36 CC(C(C)Br)c1c[n]ccc1 Amb24594038 [0,0,0,0,1,0|2,0,1]=4 1762 B11R1.36 CC(C(C)Br)c1cccc[n]1 Amb24585036 [0,0,0,0,1,0|2,0,1]=4 1763 B11R1.36 CC(C(C)Br)c1ccccc1 Amb25191202 [0,0,0,0,1,0|1,0,1]=3 1764 B11R1.36 CC(C(C)Cl)c1c[n]ccc1 Amb24660277 [0,0,0,0,1,0|2,0,1]=4 1765 B11R1.36 CC(C(C)Cl)c1ccccc1 Amb25832184 [0,0,0,0,1,0|1,0,1]=3 1766 B11R1.36 CC(C(C)N)c1c[n]ccc1 Amb18201853 [0,0,0,0,1,0|2,0,1]=4 1767 B11R1.36 CC(C(C)N)c1cc[n]cc1 Amb18201858 [0,0,0,0,1,0|2,0,1]=4 1768 B11R1.36 CC(C(C)N)c1ccccc1 Amb18125050 [0,0,0,0,1,0|1,0,1]=3 1769 B11R1.36 CC(C(C)N)c1ccccc1 Amb22477704 [0,0,0,0,1,0|1,0,1]=3 1770 B11R1.36 CC(C(Cl)Cl)c1ccccc1 Amb24390914 [0,0,0,0,1,0|2,0,1]=4 1771 B11R1.36 CC(C(F)F)c1ccccc1 Amb20669786 [0,0,0,0,1,0|2,0,1]=4 1772 B11R1.36 CC(C(N)=N)c1ccccc1 Amb22886648 [0,0,0,0,1,0|2,0,0]=3 1773 B11R1.36 CC(C(N)=O)c1c[n]c[n]c1 Amb24704219 [0,0,0,0,1,0|3,0,0]=4 1774 B11R1.36 CC(C(N)=O)c1c[n]cc[n]1 Amb25708509 [0,0,0,0,1,0|3,0,0]=4 1775 B11R1.36 CC(C(N)=O)c1cccc[n]1 Amb25217360 [0,0,0,0,1,0|2,0,0]=3 1776 B11R1.36 CC(C(N)=O)c1ccccc1 Amb25837417 [0,0,0,0,1,0|1,0,0]=2 1777 B11R1.36 CC(C(N)=S)c1cccc[n]1 Amb22397083 [0,0,0,0,1,0|2,1,0]=4 1778 B11R1.36 CC(C(O)=O)[n+]1ccccc1 Amb25708377 [0,0,0,0,1,0|2,0,0]=3 1779 B11R1.36 CC(C(O)=O)c1c[n]c[n]c1 Amb18962092 [0,0,0,0,1,0|3,0,0]=4 1780 B11R1.36 CC(C(O)=O)c1c[n]cc[n]1 Amb24070205 [0,0,0,0,1,0|3,0,0]=4 1781 B11R1.36 CC(C(O)=O)c1cc[n]c[n]1 Amb18201427 [0,0,0,0,1,0|3,0,0]=4 1782 B11R1.36 CC(C(O)=O)c1cc[n]cc1 Amb18952037 [0,0,0,0,1,0|2,0,0]=3 1783 B11R1.36 CC(C(O)=O)c1ccc[n]c1 Amb18952038 [0,0,0,0,1,0|2,0,0]=3 1784 B11R1.36 CC(C(O)=O)c1cccc[n]1 Amb18951446 [0,0,0,0,1,0|2,0,0]=3 1785 B11R1.36 CC(C(c1ccccn1)C)C Amb10573727 [0,0,0,0,1,0|2,0,1]=4 1786 B11R1.36 CC(C)=C(N)c1ccccc1 Amb24453064 [0,0,0,0,1,0|2,0,1]=4 1787 B11R1.36 CC(C)C(Br)c1ccccc1 Amb20667915 [0,0,0,0,1,0|2,0,1]=4 1788 B11R1.36 CC(C)C(N)c1ccccc1 Amb22001648 [0,0,0,0,1,0|2,0,1]=4 1789 B11R1.36 CC(C)C(S)c1ccccc1 Amb18180117 [0,0,0,0,1,0|2,0,1]=4 1790 B11R1.36 CC(C)N(C)c1ccccc1 Amb24096678 [0,0,0,0,1,0|2,0,1]=4 1791 B11R1.36 CC(C)[C@@H](N)c1ccccc1 Amb22288656 [0,0,0,0,1,0|2,0,1]=4 1792 B11R1.36 CC(C)[C@@H](O)c1ccccc1 Amb22225177 [0,0,0,0,1,0|2,0,1]=4 1793 B11R1.36 CC(C)[C@H](Cl)c1ccccc1 Amb25028094 [0,0,0,0,1,0|2,0,1]=4 1794 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22284327 [0,0,0,0,1,0|2,0,1]=4 1795 B11R1.36 CC(C)[C@H](N)c1ccccc1 Amb22288702 [0,0,0,0,1,0|2,0,1]=4 1796 B11R1.36 CC(C)[C@H](O)c1ccccc1 Amb22226521 [0,0,0,0,1,0|2,0,1]=4 1797 B11R1.36 CC(Cl)C(F)c1ccccc1 Amb25095827 [0,0,0,0,1,0|2,0,1]=4 1798 B11R1.36 CC(N)C(Br)c1ccccc1 Amb24542874 [0,0,0,0,1,0|2,0,1]=4 1799 B11R1.36 CC(N)C(F)c1ccccc1 Amb25189148 [0,0,0,0,1,0|2,0,1]=4 1800 B11R1.36 CC(N)C(N)c1ccccc1 Amb18644444 [0,0,0,0,1,0|2,0,1]=4 1801 B11R1.36 CC(O)C(Cl)c1ccccc1 Amb25724947 [0,0,0,0,1,0|1,0,2]=4 1802 B11R1.36 CC(O)C(F)c1ccccc1 Amb25148218 [0,0,0,0,1,0|1,0,2]=4 1803 B11R1.36 CC(O)C(S)c1ccccc1 Amb25145349 [0,0,0,0,1,0|1,0,2]=4 1804 B11R1.36 CC(O)[C@H](N)c1ccccc1 Amb24659547 [0,0,0,0,1,0|1,0,2]=4 1805 B11R1.36 CC(c1cc[n]cc1)[N+]([O-])=O Amb24620457 [0,0,0,0,1,0|3,0,0]=4 1806 B11R1.36 CC(c1ccccc1)C(=O)C Amb17593697 [0,0,0,0,1,0|0,0,0]=1 1807 B11R1.36 CC(c1ccccc1)C(=S)N Amb17465747 [0,0,0,0,1,0|1,1,0]=3 1808 B11R1.36 CN(C(N)=N)c1ccccc1 Amb19148904 [0,0,0,0,1,0|3,0,0]=4 1809 B11R1.36 CN(C(N)=O)c1ccc[n]c1 Amb25352855 [0,0,0,0,1,0|3,0,0]=4 1810 B11R1.36 CN(C(S)=S)c1ccccc1 Amb24732198 [0,0,0,0,1,0|2,1,0]=4 1811 B11R1.36 CN(C)C(Cl)c1ccccc1 Amb25690215 [0,0,0,0,1,0|3,0,0]=4 1812 B11R1.36 CN(C)C(N)c1ccccc1 Amb19516165 [0,0,0,0,1,0|3,0,0]=4 1813 B11R1.36 CN(C)C(O)c1ccccc1 Amb24421296 [0,0,0,0,1,0|3,0,0]=4 1814 B11R1.36 CN(c1ccccc1)C(=O)N Amb1137584 [0,0,0,0,1,0|2,0,0]=3 1815 B11R1.36 CN(c1ccccc1)C(=S)N Amb1132381 [0,0,0,0,1,0|2,1,0]=4 1816 B11R1.36 CS(=O)C(Cl)c1ccccc1 Amb25778206 [0,0,0,0,1,0|2,0,0]=3 1817 B11R1.36 C[C@@H](B(O)O)c1ccccc1 Amb25687626 [0,0,0,0,1,0|2,0,1]=4 1818 B11R1.36 C[C@@H](C(C)N)c1ccccc1 Amb25200252 [0,0,0,0,1,0|1,0,1]=3 1819 B11R1.36 C[C@@H](C(N)=S)c1ccccc1 Amb25112155 [0,0,0,0,1,0|1,1,0]=3 1820 B11R1.36 C[C@@H](Cl)[C@@H](Cl)c1ccccc1 Amb24635727 [0,0,0,0,1,0|2,0,1]=4 1821 B11R1.36 C[C@@H](Cl)[C@@H](O)c1ccccc1 Amb24602441 [0,0,0,0,1,0|2,0,1]=4 1822 B11R1.36 C[C@@H](Cl)[C@H](O)c1ccccc1 Amb24433948 [0,0,0,0,1,0|2,0,1]=4 1823 B11R1.36 C[C@@H](F)[C@@H](O)c1ccccc1 Amb25346193 [0,0,0,0,1,0|2,0,1]=4 1824 B11R1.36 C[C@@H](N)[C@@H](S)c1ccccc1 Amb25129484 [0,0,0,0,1,0|2,0,1]=4 1825 B11R1.36 C[C@@H](O)[C@@H](Br)c1ccccc1 Amb25075563 [0,0,0,0,1,0|1,0,2]=4 1826 B11R1.36 C[C@@H](O)[C@@H](Cl)c1ccccc1 Amb25310965 [0,0,0,0,1,0|1,0,2]=4 1827 B11R1.36 C[C@@H](O)[C@@H](N)c1ccccc1 Amb24695036 [0,0,0,0,1,0|1,0,2]=4 1828 B11R1.36 C[C@@H](O)[C@@H](O)c1ccccc1 Amb23604600 [0,0,0,0,1,0|1,0,2]=4 1829 B11R1.36 C[C@@H](O)[C@H](Cl)c1ccccc1 Amb24433930 [0,0,0,0,1,0|1,0,2]=4 1830 B11R1.36 C[C@@H](O)[C@H](N)c1ccccc1 Amb25794225 [0,0,0,0,1,0|1,0,2]=4 1831 B11R1.36 C[C@@H](O)[C@H](O)c1ccccc1 Amb25789551 [0,0,0,0,1,0|1,0,2]=4 1832 B11R1.36 C[C@@H]([C@@H](C)N)c1ccccc1 Amb25789348 [0,0,0,0,1,0|1,0,1]=3 1833 B11R1.36 C[C@@H](c1cccc[n]1)N(C)C Amb25858370 [0,0,0,0,1,0|3,0,0]=4 1834 B11R1.36 C[C@@H](c1ccccc1)N(C)C Amb10807413 [0,0,0,0,1,0|2,0,0]=3 1835 B11R1.36 C[C@@H](c1ccccc1)[C@@H](O)C Amb16210577 [0,0,0,0,1,0|0,0,2]=3 1836 B11R1.36 C[C@H](Br)[C@@H](F)c1ccccc1 Amb25055861 [0,0,0,0,1,0|2,0,1]=4 1837 B11R1.36 C[C@H](Br)[C@@H](O)c1ccccc1 Amb25844405 [0,0,0,0,1,0|2,0,1]=4 1838 B11R1.36 C[C@H](Br)[C@H](F)c1ccccc1 Amb25313145 [0,0,0,0,1,0|2,0,1]=4 1839 B11R1.36 C[C@H](C(C)N)c1ccccc1 Amb25339523 [0,0,0,0,1,0|1,0,1]=3 1840 B11R1.36 C[C@H](C(C)O)c1ccccc1 Amb24372048 [0,0,0,0,1,0|0,0,2]=3 1841 B11R1.36 C[C@H](Cl)[C@@H](N)c1ccccc1 Amb25211090 [0,0,0,0,1,0|2,0,1]=4 1842 B11R1.36 C[C@H](Cl)[C@H](Cl)c1ccccc1 Amb25322171 [0,0,0,0,1,0|2,0,1]=4 1843 B11R1.36 C[C@H](Cl)[C@H](O)c1ccccc1 Amb24442982 [0,0,0,0,1,0|2,0,1]=4 1844 B11R1.36 C[C@H](N)[C@@H](Cl)c1ccccc1 Amb24740855 [0,0,0,0,1,0|2,0,1]=4 1845 B11R1.36 C[C@H](N)[C@@H](F)c1ccccc1 Amb25251481 [0,0,0,0,1,0|2,0,1]=4 1846 B11R1.36 C[C@H](N)[C@@H](N)c1ccccc1 Amb25053950 [0,0,0,0,1,0|2,0,1]=4 1847 B11R1.36 C[C@H](N)[C@@H](O)c1ccccc1 Amb22349976 [0,0,0,0,1,0|2,0,1]=4 1848 B11R1.36 C[C@H](N)[C@@H](S)c1ccccc1 Amb25241973 [0,0,0,0,1,0|2,0,1]=4 1849 B11R1.36 C[C@H](N)[C@H](F)c1ccccc1 Amb25073105 [0,0,0,0,1,0|2,0,1]=4 1850 B11R1.36 C[C@H](O)C(O)c1ccccc1 Amb25806789 [0,0,0,0,1,0|1,0,2]=4 1851 B11R1.36 C[C@H](O)[C@@H](Cl)c1ccccc1 Amb25288148 [0,0,0,0,1,0|1,0,2]=4 1852 B11R1.36 C[C@H](O)[C@@H](N)c1ccccc1 Amb25791116 [0,0,0,0,1,0|1,0,2]=4 1853 B11R1.36 C[C@H](O)[C@@H](O)c1ccccc1 Amb25149680 [0,0,0,0,1,0|1,0,2]=4 1854 B11R1.36 C[C@H](O)[C@H](Cl)c1ccccc1 Amb25211675 [0,0,0,0,1,0|1,0,2]=4 1855 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 Amb25362712 [0,0,0,0,1,0|1,0,2]=4 1856 B11R1.36 C[C@H]([C@@H](C)Cl)c1ccccc1 Amb24652492 [0,0,0,0,1,0|1,0,1]=3 1857 B11R1.36 C\C(\N)=C(/O)\c1ccccc1 Amb24097762 [0,0,0,0,1,0|2,0,1]=4 1858 B11R1.36 C\C(\c1ccccc1)=C(\C)/Br Amb25211055 [0,0,0,0,1,0|1,0,1]=3 1859 B11R1.36 ClC(c1ccccc1)C(=O)N Amb1678054 [0,0,0,0,1,0|2,0,0]=3 1860 B11R1.36 ClC(c1ccccc1)C(C)C Amb17138646 [0,0,0,0,1,0|2,0,1]=4 1861 B11R1.36 ClC(c1ccccc1)C(N)C Amb17594246 [0,0,0,0,1,0|2,0,1]=4 1862 B11R1.36 ClC(c1ccncc1)C(=O)C Amb17477810 [0,0,0,0,1,0|2,0,0]=3 1863 B11R1.36 N=C(C(O)=O)c1ccccc1 Amb24581249 [0,0,0,0,1,0|2,0,1]=4 1864 B11R1.36 N=C(Cl)C(O)c1ccccc1 Amb25149713 [0,0,0,0,1,0|3,0,0]=4 1865 B11R1.36 NC(=N)C(F)c1ccccc1 Amb25069563 [0,0,0,0,1,0|3,0,0]=4 1866 B11R1.36 NC(=N)C(O)c1ccccc1 Amb19890170 [0,0,0,0,1,0|3,0,0]=4 1867 B11R1.36 NC(=N)[C@@H](O)c1ccccc1 Amb22587581 [0,0,0,0,1,0|3,0,0]=4 1868 B11R1.36 NC(=N)[C@H](O)c1ccccc1 Amb22587530 [0,0,0,0,1,0|3,0,0]=4 1869 B11R1.36 NC(=O)C(=N)c1ccccc1 Amb24714517 [0,0,0,0,1,0|2,0,1]=4 1870 B11R1.36 NC(=O)C(=O)c1ccccc1 Amb18560879 [0,0,0,0,1,0|2,0,1]=4 1871 B11R1.36 NC(=O)C(Br)c1ccccc1 Amb23450271 [0,0,0,0,1,0|2,0,0]=3 1872 B11R1.36 NC(=O)C(Cl)c1ccc[n]c1 Amb18185667 [0,0,0,0,1,0|3,0,0]=4 1873 B11R1.36 NC(=O)C(N)c1ccccc1 Amb22469872 [0,0,0,0,1,0|2,0,0]=3 1874 B11R1.36 NC(=O)C(O)c1cc[n]cc1 Amb25783931 [0,0,0,0,1,0|3,0,0]=4 1875 B11R1.36 NC(=O)C(O)c1ccc[n]c1 Amb18182774 [0,0,0,0,1,0|3,0,0]=4 1876 B11R1.36 NC(=O)C(O)c1cccc[n]1 Amb24396108 [0,0,0,0,1,0|3,0,0]=4 1877 B11R1.36 NC(=O)C(c1ccccn1)N Amb17334311 [0,0,0,0,1,0|3,0,0]=4 1878 B11R1.36 NC(=O)C(c1cccnc1)N Amb17334312 [0,0,0,0,1,0|3,0,0]=4 1879 B11R1.36 NC(=O)N(N)c1ccccc1 Amb18125271 [0,0,0,0,1,0|3,0,0]=4 1880 B11R1.36 NC(=O)N(O)c1ccccc1 Amb25765611 [0,0,0,0,1,0|3,0,0]=4 1881 B11R1.36 NC(=O)[C@@H](Br)c1ccccc1 Amb24611041 [0,0,0,0,1,0|2,0,0]=3 1882 B11R1.36 NC(=O)[C@@H](N)c1ccccc1 Amb22745343 [0,0,0,0,1,0|2,0,0]=3 1883 B11R1.36 NC(=O)[C@@H](O)c1ccccc1 Amb20671372 [0,0,0,0,1,0|2,0,0]=3 1884 B11R1.36 NC(=O)[C@H](Cl)c1ccccc1 Amb25320858 [0,0,0,0,1,0|2,0,0]=3 1885 B11R1.36 NC(=O)[C@H](F)c1ccccc1 Amb25027917 [0,0,0,0,1,0|2,0,0]=3 1886 B11R1.36 NC(=O)[C@H](N)c1ccccc1 Amb22353208 [0,0,0,0,1,0|2,0,0]=3 1887 B11R1.36 NC(=O)[C@H](O)c1ccccc1 Amb20671371 [0,0,0,0,1,0|2,0,0]=3 1888 B11R1.36 NC(=S)C(N)c1ccccc1 Amb19374911 [0,0,0,0,1,0|2,1,0]=4 1889 B11R1.36 NC(C(=O)Cl)c1ccccc1 Amb21912493 [0,0,0,0,1,0|2,0,0]=3 1890 B11R1.36 NC(C(O)=O)c1cccc[n]1 Amb22496612 [0,0,0,0,1,0|3,0,0]=4 1891 B11R1.36 NC(c1ccccc1)C(=O)Cl Amb16203807 [0,0,0,0,1,0|2,0,0]=3 1892 B11R1.36 NC(c1ccccc1)C(=O)N Amb13951330 [0,0,0,0,1,0|2,0,0]=3 1893 B11R1.36 NC(c1ccccc1)C(=O)O Amb1869285 [0,0,0,0,1,0|2,0,0]=3 1894 B11R1.36 NC(c1ccccc1)C(C)C Amb1129834 [0,0,0,0,1,0|2,0,1]=4 1895 B11R1.36 NC(c1ccccc1)P(O)=O Amb25191187 [0,0,0,0,1,0|3,0,0]=4 1896 B11R1.36 NC(c1ccncc1)C(=O)N Amb17334313 [0,0,0,0,1,0|3,0,0]=4 1897 B11R1.36 N[C@@H](C(=O)Cl)c1ccccc1 Amb22351781 [0,0,0,0,1,0|2,0,0]=3 1898 B11R1.36 N[C@@H](C(O)=O)[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22351396 [0,0,0,0,1,0|2,0,0]=3 1899 B11R1.36 N[C@@H](C(O)=O)c1ccc[n]c1 Amb24074448 [0,0,0,0,1,0|3,0,0]=4 1900 B11R1.36 N[C@@H](C(O)=O)c1ccccc1 Amb22745585 [0,0,0,0,1,0|2,0,0]=3 1901 B11R1.36 N[C@@H](c1ccccc1)C(=O)N Amb10603128 [0,0,0,0,1,0|2,0,0]=3 1902 B11R1.36 N[C@@H](c1ccccc1)C(C)C Amb10608147 [0,0,0,0,1,0|2,0,1]=4 1903 B11R1.36 N[C@H](C(=O)Cl)c1ccccc1 Amb25152830 [0,0,0,0,1,0|2,0,0]=3 1904 B11R1.36 O=C(Cl)[C@@H](Cl)c1ccccc1 Amb24657090 [0,0,0,0,1,0|2,0,0]=3 1905 B11R1.36 O=C(c1ccccc1)C(=C)C Amb17593661 [0,0,0,0,1,0|2,0,1]=4 1906 B11R1.36 O=C(c1ccccc1)C(=O)Br Amb24096833 [0,0,0,0,1,0|2,0,1]=4 1907 B11R1.36 O=C(c1ccccc1)C(=O)C Amb2099500 [0,0,0,0,1,0|1,0,1]=3 1908 B11R1.36 O=C(c1ccccc1)C(=O)Cl Amb17594226 [0,0,0,0,1,0|2,0,1]=4 1909 B11R1.36 OC(=O)C(Br)c1ccc[n]c1 Amb19929998 [0,0,0,0,1,0|3,0,0]=4 1910 B11R1.36 OC(=O)C(Br)c1cccc[n]1 Amb24081184 [0,0,0,0,1,0|3,0,0]=4 1911 B11R1.36 OC(=O)C(Cl)c1cc[n]cc1 Amb24488132 [0,0,0,0,1,0|3,0,0]=4 1912 B11R1.36 OC(=O)C(Cl)c1ccc[n]c1 Amb24089492 [0,0,0,0,1,0|3,0,0]=4 1913 B11R1.36 OC(=O)C(F)c1cc[n]cc1 Amb24466152 [0,0,0,0,1,0|3,0,0]=4 1914 B11R1.36 OC(=O)C(F)c1cccc[n]1 Amb25149165 [0,0,0,0,1,0|3,0,0]=4 1915 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb18952024 [0,0,0,0,1,0|3,0,0]=4 1916 B11R1.36 OC(=O)C(O)c1c[n]ccc1 Amb19373382 [0,0,0,0,1,0|3,0,0]=4 1917 B11R1.36 OC(=O)C(O)c1cc[n]cc1 Amb18201200 [0,0,0,0,1,0|3,0,0]=4 1918 B11R1.36 OC(=O)C(O)c1cccc[n]1 Amb18201201 [0,0,0,0,1,0|3,0,0]=4 1919 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22729762 [0,0,0,0,1,0|2,0,0]=3 1920 B11R1.36 OC(=O)C(O)c1ccccc1 Amb22732258 [0,0,0,0,1,0|2,0,0]=3 1921 B11R1.36 OC(=O)C(c1ccccc1)N Amb2228457 [0,0,0,0,1,0|2,0,0]=3 1922 B11R1.36 OC(=O)C(c1cccnc1)N Amb10632723 [0,0,0,0,1,0|3,0,0]=4 1923 B11R1.36 OC(=O)[C@@H](Br)c1ccccc1 Amb25056175 [0,0,0,0,1,0|2,0,0]=3 1924 B11R1.36 OC(=O)[C@@H](O)c1c[n]ccc1 Amb24595431 [0,0,0,0,1,0|3,0,0]=4 1925 B11R1.36 OC(=O)[C@H](Cl)c1ccccc1 Amb24650918 [0,0,0,0,1,0|2,0,0]=3 1926 B11R1.36 OC(=O)[C@H](O)c1c[n]ccc1 Amb25060746 [0,0,0,0,1,0|3,0,0]=4 1927 B11R1.36 OC(C(=O)Br)c1ccccc1 Amb24095709 [0,0,0,0,1,0|2,0,0]=3 1928 B11R1.36 OC(C(=O)S)c1ccccc1 Amb25681441 [0,0,0,0,1,0|2,0,0]=3 1929 B11R1.36 OC(c1ccccc1)C(=C)C Amb10807411 [0,0,0,0,1,0|2,0,0]=3 1930 B11R1.36 OC(c1ccccc1)C(=O)C Amb17593725 [0,0,0,0,1,0|1,0,0]=2 1931 B11R1.36 OC(c1ccccc1)C(Br)C Amb17595842 [0,0,0,0,1,0|2,0,1]=4 1932 B11R1.36 OC(c1ccccc1)P(O)=O Amb21618921 [0,0,0,0,1,0|3,0,0]=4 1933 B11R1.36 O[C@@H](C(=O)Cl)c1ccccc1 Amb25683267 [0,0,0,0,1,0|2,0,0]=3 1934 B11R1.36 O[C@@H](c1ccccc1)C(=O)C Amb17619252 [0,0,0,0,1,0|1,0,0]=2 1935 B11R1.36 O[C@@H](c1ccccc1)[C@@H](N)C Amb17619646 [0,0,0,0,1,0|2,0,1]=4 1936 B11R1.36 O[C@H](c1ccccc1)[C@H](N)C Amb10071337 [0,0,0,0,1,0|2,0,1]=4 1937 B11R1.36 SC(c1ccccc1)C(=O)C Amb17594139 [0,0,0,0,1,0|1,0,0]=2 1938 B11R1.36 [NH3+]C(C(O)=O)c1ccccc1 Amb22641589 [0,0,0,0,1,0|2,0,0]=3 1939 B11R1.36 [O-]C(=O)C(O)c1cccc[n]1 Amb23452663 [0,0,0,0,1,0|3,0,0]=4 1940 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22729281 [0,0,0,0,1,0|2,0,0]=3 1941 B11R1.36 [O-]C(=O)C(O)c1ccccc1 Amb22732065 [0,0,0,0,1,0|2,0,0]=3 1942 B11R1.36 [O-]C(c1cccc[n]1)C(O)=O Amb22453597 [0,0,0,0,1,0|3,0,0]=4 1943 B11R1.77 CC(=N)NC(C)c1c[s]cc1 Amb24635264 [0,0,0,0,1,0|3,0,0]=4 1944 B11R1.77 CC(=O)CC(C)c1c[s]c[n]1 Amb24408556 [0,0,0,0,1,0|3,0,0]=4 1945 B11R1.77 CC(=O)CC(C)c1c[s]cc1 Amb25062699 [0,0,0,0,1,0|2,0,0]=3 1946 B11R1.77 CC(=O)CC(C)c1cocc1 Amb25223137 [0,0,0,0,1,0|2,0,0]=3 1947 B11R1.77 CC(=O)CC(N)c1cc[s]c1 Amb24565933 [0,0,0,0,1,0|3,0,0]=4 1948 B11R1.77 CC(=O)CC(N)c1ccc[s]1 Amb25260094 [0,0,0,0,1,0|3,0,0]=4 1949 B11R1.77 CC(=O)CC(O)c1cc[s]c1 Amb25150153 [0,0,0,0,1,0|3,0,0]=4 1950 B11R1.77 CC(=O)CC(O)c1ccc[s]1 Amb25142708 [0,0,0,0,1,0|3,0,0]=4 1951 B11R1.77 CC(=O)C[C@@H](O)c1ccco1 Amb25151584 [0,0,0,0,1,0|3,0,0]=4 1952 B11R1.77 CC(=O)C[C@H](C)c1ccco1 Amb24691777 [0,0,0,0,1,0|2,0,0]=3 1953 B11R1.77 CC(=O)NC(C)c1[nH]cc[n]1 Amb25355063 [0,0,0,0,1,0|3,0,0]=4 1954 B11R1.77 CC(=O)NC(C)c1cc[n][nH]1 Amb25187624 [0,0,0,0,1,0|3,0,0]=4 1955 B11R1.77 CC(=O)NC(C)c1cocc1 Amb25803320 [0,0,0,0,1,0|2,0,0]=3 1956 B11R1.77 CC(=O)N[C@@H](C)c1c[n]c[s]1 Amb24631717 [0,0,0,0,1,0|3,0,0]=4 1957 B11R1.77 CC(=O)N[C@@H](C)c1ccc[s]1 Amb25777895 [0,0,0,0,1,0|2,0,0]=3 1958 B11R1.77 CC(=O)N[C@@H](C)c1ccco1 Amb25808220 [0,0,0,0,1,0|2,0,0]=3 1959 B11R1.77 CC(=O)OC(=O)c1ccc[nH]1 Amb25771862 [0,0,0,0,1,0|2,0,1]=4 1960 B11R1.77 CC(=O)OC(C)c1ccc[s]1 Amb25667972 [0,0,0,0,1,0|1,0,0]=2 1961 B11R1.77 CC(=O)OC(Cl)c1ccco1 Amb24487882 [0,0,0,0,1,0|2,0,0]=3 1962 B11R1.77 CC(=O)O[C@@H](C)c1[n]cc[s]1 Amb24582041 [0,0,0,0,1,0|2,0,0]=3 1963 B11R1.77 CC(=O)O[C@@H](C)c1ccco1 Amb22801668 [0,0,0,0,1,0|1,0,0]=2 1964 B11R1.77 CC(=O)O[C@H](C)c1c[n]c[s]1 Amb25334370 [0,0,0,0,1,0|2,0,0]=3 1965 B11R1.77 CC(CC(C)=O)[n]1ccc[n]1 Amb25074243 [0,0,0,0,1,0|3,0,0]=4 1966 B11R1.77 CC(CC(N)=O)[n]1cccc1 Amb23450286 [0,0,0,0,1,0|3,0,0]=4 1967 B11R1.77 CC(CC(O)=O)c1cc[nH]c1 Amb18065399 [0,0,0,0,1,0|3,0,0]=4 1968 B11R1.77 CC(CC(O)=O)c1cc[s]c1 Amb25274979 [0,0,0,0,1,0|3,0,0]=4 1969 B11R1.77 CC(CC(O)=O)c1ccc[nH]1 Amb25150500 [0,0,0,0,1,0|3,0,0]=4 1970 B11R1.77 CC(NC(C)=O)=C1C=CC=C1 Amb25125806 [0,0,0,0,1,0|1,0,1]=3 1971 B11R1.77 CC(NC(N)=O)c1cc[s]c1 Amb18180271 [0,0,0,0,1,0|3,0,0]=4 1972 B11R1.77 CC(NC(N)=O)c1ccc[nH]1 Amb25283961 [0,0,0,0,1,0|3,0,0]=4 1973 B11R1.77 CC(OC(C)=O)[n]1c[n]c[n]1 Amb24194534 [0,0,0,0,1,0|3,0,0]=4 1974 B11R1.77 CC(OC(C)=O)[n]1c[n]cc1 Amb25145933 [0,0,0,0,1,0|2,0,0]=3 1975 B11R1.77 C\C(=C/C(C)=O)\c1cocc1 Amb25128924 [0,0,0,0,1,0|2,0,1]=4 1976 B11R1.77 C\C(=C\C(C)=O)\c1ccc[s]1 Amb24630689 [0,0,0,0,1,0|2,0,1]=4 1977 B11R1.77 NC(=O)CC(c1cccs1)C Amb17232718 [0,0,0,0,1,0|3,0,0]=4 1978 B13R1.45 CC(=C)C#CC(O)c1ccccc1 Amb25123690 [0,0,0,0,0,1|3,0,0]=4 1979 B13R1.45 CC(=CCC(C)=O)c1ccccc1 Amb24090254 [0,0,0,0,0,1|1,0,1]=3 1980 B13R1.45 CC(=N\N=C(/C)\N)c1ccccc1 Amb24709368 [0,0,0,0,0,1|2,0,1]=4 1981 B13R1.45 CC(=O)C#CC(=O)c1ccccc1 Amb25134098 [0,0,0,0,0,1|2,0,1]=4 1982 B13R1.45 CC(=O)C=CC(C)c1ccccc1 Amb24090253 [0,0,0,0,0,1|1,0,0]=2 1983 B13R1.45 CC(=O)CCC(c1ccccn1)Cl Amb17402226 [0,0,0,0,0,1|3,0,0]=4 1984 B13R1.45 CC(=O)CCC(c1cccnc1)Cl Amb17402227 [0,0,0,0,0,1|3,0,0]=4 1985 B13R1.45 CC(=O)COC(=O)c1ccccc1 Amb22497327 [0,0,0,0,0,1|1,0,1]=3 1986 B13R1.45 CC(=O)N/N=C(/C)c1ccccn1 Amb17791316 [0,0,0,0,0,1|2,0,1]=4 1987 B13R1.45 CC(=O)NCC(C)c1cc[n]cc1 Amb25167442 [0,0,0,0,0,1|2,0,0]=3 1988 B13R1.45 CC(=O)NCC(O)c1ccc[n]c1 Amb25091917 [0,0,0,0,0,1|3,0,0]=4 1989 B13R1.45 CC(=O)NC[C@@H](C)c1ccccc1 Amb25311245 [0,0,0,0,0,1|1,0,0]=2 1990 B13R1.45 CC(=O)NC[C@@H](O)c1ccccc1 Amb24435357 [0,0,0,0,0,1|2,0,0]=3 1991 B13R1.45 CC(=O)NC[C@H](N)c1ccccc1 Amb25752007 [0,0,0,0,0,1|2,0,0]=3 1992 B13R1.45 CC(=O)NNC(C)c1ccccc1 Amb24573888 [0,0,0,0,0,1|1,0,0]=2 1993 B13R1.45 CC(=O)NOC(=O)c1ccccc1 Amb24726089 [0,0,0,0,0,1|1,0,1]=3 1994 B13R1.45 CC(=O)O/C=C(\C)c1ccccc1 Amb17778975 [0,0,0,0,0,1|0,0,1]=2 1995 B13R1.45 CC(=O)OCC(=C)c1ccccc1 Amb17778927 [0,0,0,0,0,1|0,0,2]=3 1996 B13R1.45 CC(=O)ONC(=O)c1cc[n]cc1 Amb25160710 [0,0,0,0,0,1|2,0,1]=4 1997 B13R1.45 CC(=O)ONC(=O)c1cccc[n]1 Amb24745497 [0,0,0,0,0,1|2,0,1]=4 1998 B13R1.45 CC(=O)ONC(=O)c1ccccc1 Amb24106396 [0,0,0,0,0,1|1,0,1]=3 1999 B13R1.45 CC(=O)OOC(=O)c1ccccc1 Amb17672876 [0,0,0,0,0,1|1,0,1]=3 2000 B13R1.45 CC(=O)\C=C\C(=O)c1ccccc1 Amb25094370 [0,0,0,0,0,1|2,0,1]=4 2001 B13R1.45 CC(=O)\C=C\C(C)c1ccccc1 Amb25292084 [0,0,0,0,0,1|1,0,0]=2 2002 B13R1.45 CC(=O)\C=C\C(O)c1ccccc1 Amb25318863 [0,0,0,0,0,1|2,0,0]=3 2003 B13R1.45 CC(=O)\C=C\[C@H](C)c1ccccc1 Amb25059669 [0,0,0,0,0,1|1,0,0]=2 2004 B13R1.45 CC(=O)\C=N\N(C)c1ccccc1 Amb24625825 [0,0,0,0,0,1|2,0,0]=3 2005 B13R1.45 CC(C#CC(C)O)c1ccccc1 Amb25191741 [0,0,0,0,0,1|1,0,2]=4 2006 B13R1.45 CC(C)=CCN(C)c1ccccc1 Amb22546825 [0,0,0,0,0,1|3,0,0]=4 2007 B13R1.45 CC(C)=CC[C@@H](N)c1ccccc1 Amb25188074 [0,0,0,0,0,1|3,0,0]=4 2008 B13R1.45 CC(C)=NCC(O)c1ccccc1 Amb25670758 [0,0,0,0,0,1|3,0,0]=4 2009 B13R1.45 CC(C)=NOC(=O)c1ccccc1 Amb22733229 [0,0,0,0,0,1|2,0,1]=4 2010 B13R1.45 CC(CNC(N)=N)c1ccccc1 Amb25286782 [0,0,0,0,0,1|3,0,0]=4 2011 B13R1.45 CC(CNC(N)=O)c1ccccc1 Amb25156032 [0,0,0,0,0,1|2,0,0]=3 2012 B13R1.45 CC(CSC(N)=N)c1ccccc1 Amb20676022 [0,0,0,0,0,1|2,1,0]=4 2013 B13R1.45 CC(NNC(N)=O)c1ccccc1 Amb24070020 [0,0,0,0,0,1|2,0,0]=3 2014 B13R1.45 CC(NNC(N)=S)c1ccccc1 Amb24693853 [0,0,0,0,0,1|2,1,0]=4 2015 B13R1.45 CC(SCC(O)=O)c1ccccc1 Amb22275729 [0,0,0,0,0,1|1,1,0]=3 2016 B13R1.45 CC(\C=C\C(C)O)c1ccccc1 Amb25797120 [0,0,0,0,0,1|1,0,2]=4 2017 B13R1.45 CC(\N=C\C(C)Cl)c1ccccc1 Amb24677854 [0,0,0,0,0,1|2,0,1]=4 2018 B13R1.45 CC(\N=C\C(N)=O)c1ccccc1 Amb24635800 [0,0,0,0,0,1|2,0,0]=3 2019 B13R1.45 CC(\N=C\C(O)=O)c1ccccc1 Amb24545007 [0,0,0,0,0,1|2,0,0]=3 2020 B13R1.45 CC(\N=C\N(C)C)c1ccccc1 Amb25284094 [0,0,0,0,0,1|3,0,0]=4 2021 B13R1.45 CC(c1ccccc1)CNC(C)C Amb2119052 [0,0,0,0,0,1|2,0,1]=4 2022 B13R1.45 CC(c1ccccc1)NCC(=O)N Amb1114995 [0,0,0,0,0,1|2,0,0]=3 2023 B13R1.45 CN(CCC(O)=O)c1ccccc1 Amb19373406 [0,0,0,0,0,1|3,0,0]=4 2024 B13R1.45 CN(\C=C\C(O)=O)c1ccccc1 Amb25303464 [0,0,0,0,0,1|3,0,0]=4 2025 B13R1.45 CN(c1ccccc1)CCC(=O)Cl Amb17143181 [0,0,0,0,0,1|3,0,0]=4 2026 B13R1.45 CN(c1ccccc1)CCC(=O)N Amb17142975 [0,0,0,0,0,1|3,0,0]=4 2027 B13R1.45 C[C@@H](NCC(N)=O)c1ccccc1 Amb24271280 [0,0,0,0,0,1|2,0,0]=3 2028 B13R1.45 C[C@@H](NCC(O)=O)c1ccccc1 Amb17935709 [0,0,0,0,0,1|2,0,0]=3 2029 B13R1.45 C[C@@H](\N=C\[C@H](C)Cl)c1ccccc1 Amb24635636 [0,0,0,0,0,1|2,0,1]=4 2030 B13R1.45 C[C@H](C#CC(O)=O)c1ccccc1 Amb24390872 [0,0,0,0,0,1|2,0,0]=3 2031 B13R1.45 C[C@H](NCC(O)=O)c1ccccc1 Amb17935708 [0,0,0,0,0,1|2,0,0]=3 2032 B13R1.45 C[C@H](c1ccccc1)\N=C\C(C)C Amb10562654 [0,0,0,0,0,1|2,0,1]=4 2033 B13R1.45 C\C(=C/CC(O)=O)\c1ccccc1 Amb25189805 [0,0,0,0,0,1|2,0,1]=4 2034 B13R1.45 C\C(=C\CC(C)=O)\c1ccccc1 Amb24392921 [0,0,0,0,0,1|1,0,1]=3 2035 B13R1.45 C\C(=C\OC(C)=O)\c1ccccc1 Amb25290986 [0,0,0,0,0,1|0,0,1]=2 2036 B13R1.45 C\C(=N/NC(=O)C)\c1ccccc1 Amb1834900 [0,0,0,0,0,1|1,0,1]=3 2037 B13R1.45 C\C(=N\CC(O)=O)\c1ccccc1 Amb25294322 [0,0,0,0,0,1|2,0,1]=4 2038 B13R1.45 C\C(=N\OC(=O)C)\c1ccccc1 Amb1014467 [0,0,0,0,0,1|0,0,1]=2 2039 B13R1.45 C\C(\Cl)=C\CC(O)c1ccccc1 Amb24752308 [0,0,0,0,0,1|3,0,0]=4 2040 B13R1.45 C\C(\N)=N\OC(=O)c1ccccc1 Amb24710149 [0,0,0,0,0,1|2,0,1]=4 2041 B13R1.45 ClC(c1ccccc1)CCC(=O)C Amb17402167 [0,0,0,0,0,1|2,0,0]=3 2042 B13R1.45 ClC(c1ccncc1)CCC(=O)C Amb17402228 [0,0,0,0,0,1|3,0,0]=4 2043 B13R1.45 NC(=O)NOC(=O)c1ccccc1 Amb25806893 [0,0,0,0,0,1|2,0,1]=4 2044 B13R1.45 NC(=O)ONC(=O)c1ccccc1 Amb24635646 [0,0,0,0,0,1|2,0,1]=4 2045 B13R1.45 NC(CCC(O)=O)c1ccccc1 Amb19514853 [0,0,0,0,0,1|3,0,0]=4 2046 B13R1.45 N[C@@H](CCC(O)=O)c1ccccc1 Amb22745911 [0,0,0,0,0,1|3,0,0]=4 2047 B13R1.45 N[C@@H](CCC(O)=O)c1ccccc1 Amb23399581 [0,0,0,0,0,1|3,0,0]=4 2048 B13R1.45 N[C@@H](c1ccccc1)COC(C)C Amb17061653 [0,0,0,0,0,1|2,0,1]=4 2049 B13R1.45 N\C(=N/OC(=O)C)\c1ccncc1 Amb16757873 [0,0,0,0,0,1|2,0,1]=4 2050 B13R1.45 N\C(=N\OC(=O)C)\c1ccccc1 Amb2228036 [0,0,0,0,0,1|1,0,1]=3 2051 B13R1.45 O=C(c1ccccc1)CNC(=O)C Amb17335159 [0,0,0,0,0,1|2,0,1]=4 2052 B13R1.45 O=C(c1ccccc1)OCC(=O)O Amb17594607 [0,0,0,0,0,1|2,0,1]=4 2053 B13R1.45 OC(=O)C#CC(O)c1ccccc1 Amb24355315 [0,0,0,0,0,1|3,0,0]=4 2054 B13R1.45 OC(=O)\C=C\C(O)c1ccccc1 Amb18128124 [0,0,0,0,0,1|3,0,0]=4 2055 B13R1.45 OC(c1ccccc1)CCC(=O)N Amb17335290 [0,0,0,0,0,1|3,0,0]=4 2056 B13R1.45 OC(c1ccccc1)COC(=O)N Amb17594650 [0,0,0,0,0,1|2,0,0]=3 2057 B13R1.348 CC(=C)OC(=O)Nc1ccccc1 Amb25121132 [0,0,0,0,0,1|2,0,1]=4 2058 B13R1.348 CC(=Cc1ccccc1)C=C(C)C Amb10842055 [0,0,0,0,0,1|2,0,1]=4 2059 B13R1.348 CC(=O)/C=C(\C)Cc1ccccc1 Amb17778969 [0,0,0,0,0,1|1,0,1]=3 2060 B13R1.348 CC(=O)C/C(C)=C/c1ccccc1 Amb17778970 [0,0,0,0,0,1|1,0,1]=3 2061 B13R1.348 CC(=O)CC(=O)Oc1ccccc1 Amb22586480 [0,0,0,0,0,1|2,0,1]=4 2062 B13R1.348 CC(=O)CC(=S)Nc1ccccc1 Amb25190045 [0,0,0,0,0,1|2,0,1]=4 2063 B13R1.348 CC(=O)CN(C)Cc1ccccc1 Amb18808988 [0,0,0,0,0,1|2,0,0]=3 2064 B13R1.348 CC(=O)NC(=N)Nc1ccccc1 Amb25046689 [0,0,0,0,0,1|2,0,1]=4 2065 B13R1.348 CC(=O)NC(=O)Cc1ccccc1 Amb24073557 [0,0,0,0,0,1|2,0,1]=4 2066 B13R1.348 CC(=O)NC(=S)Cc1ccccc1 Amb25689518 [0,0,0,0,0,1|2,0,1]=4 2067 B13R1.348 CC(=O)NC(=S)Oc1ccccc1 Amb25758641 [0,0,0,0,0,1|2,0,1]=4 2068 B13R1.348 CC(=O)NC(C)Cc1c[n]ccc1 Amb25095297 [0,0,0,0,0,1|2,0,0]=3 2069 B13R1.348 CC(=O)NC(C)Cc1cc[n]cc1 Amb24705489 [0,0,0,0,0,1|2,0,0]=3 2070 B13R1.348 CC(=O)NC(N)Cc1ccccc1 Amb25322191 [0,0,0,0,0,1|2,0,0]=3 2071 B13R1.348 CC(=O)N[C@H](C)Cc1ccccc1 Amb24496665 [0,0,0,0,0,1|1,0,0]=2 2072 B13R1.348 CC(=O)OC(C)Cc1ccccc1 Amb24323251 [0,0,0,0,0,1|0,0,0]=1 2073 B13R1.348 CC(=O)SC(=O)Nc1ccccc1 Amb24396677 [0,0,0,0,0,1|1,1,1]=4 2074 B13R1.348 CC(=O)\C=C(\N)/Cc1ccccc1 Amb24739677 [0,0,0,0,0,1|2,0,1]=4 2075 B13R1.348 CC(=O)\C=C(\S)/Nc1ccccc1 Amb25840398 [0,0,0,0,0,1|2,0,1]=4 2076 B13R1.348 CC(C)=CC(C)=Nc1ccccc1 Amb25224743 [0,0,0,0,0,1|2,0,1]=4 2077 B13R1.348 CC(C)C[C@@H](C)Nc1ccccc1 Amb24520693 [0,0,0,0,0,1|2,0,1]=4 2078 B13R1.348 CC(C)C[C@H](C)Nc1ccccc1 Amb25040127 [0,0,0,0,0,1|2,0,1]=4 2079 B13R1.348 CC(CC(N)=O)Nc1cc[n]cc1 Amb25698803 [0,0,0,0,0,1|3,0,0]=4 2080 B13R1.348 CC(CC(N)=O)Nc1cccc[n]1 Amb25378311 [0,0,0,0,0,1|3,0,0]=4 2081 B13R1.348 CC(CN(C)C)Nc1ccccc1 Amb24707149 [0,0,0,0,0,1|3,0,0]=4 2082 B13R1.348 CC(Cc1cc[n]cc1)NC(N)=O Amb24380353 [0,0,0,0,0,1|3,0,0]=4 2083 B13R1.348 CC(Cc1ccccc1)CC(=O)O Amb17233403 [0,0,0,0,0,1|2,0,0]=3 2084 B13R1.348 CC(Cc1ccccc1)NC(N)=N Amb18178447 [0,0,0,0,0,1|3,0,0]=4 2085 B13R1.348 CC(Cc1ccccn1)CC(=O)O Amb17335285 [0,0,0,0,0,1|3,0,0]=4 2086 B13R1.348 CC(Cc1cccnc1)CC(=O)O Amb17335287 [0,0,0,0,0,1|3,0,0]=4 2087 B13R1.348 CC(Cc1ccncc1)CC(=O)O Amb17335288 [0,0,0,0,0,1|3,0,0]=4 2088 B13R1.348 CC(Nc1ccccc1)CC(=O)N Amb17233441 [0,0,0,0,0,1|2,0,0]=3 2089 B13R1.348 CC(Oc1ccccc1)CC(=O)N Amb17233539 [0,0,0,0,0,1|2,0,0]=3 2090 B13R1.348 CN(Cc1ccccc1)CC(=O)Cl Amb17143178 [0,0,0,0,0,1|3,0,0]=4 2091 B13R1.348 CN(Cc1ccccc1)CC(=O)N Amb17142972 [0,0,0,0,0,1|3,0,0]=4 2092 B13R1.348 CN(Cc1ccccc1)CC(=O)O Amb10610460 [0,0,0,0,0,1|3,0,0]=4 2093 B13R1.348 C[C@@H](CC(N)=O)Nc1ccccc1 Amb24727147 [0,0,0,0,0,1|2,0,0]=3 2094 B13R1.348 C[C@H](CC(N)=O)Nc1ccccc1 Amb25707756 [0,0,0,0,0,1|2,0,0]=3 2095 B13R1.348 C[C@H](C[C@H](C)O)Nc1ccccc1 Amb25858831 [0,0,0,0,0,1|1,0,2]=4 2096 B13R1.348 C[C@H](Cc1ccccc1)NC(N)=O Amb25766034 [0,0,0,0,0,1|2,0,0]=3 2097 B13R1.348 C\C(=C/C(=O)O)\Cc1ccccc1 Amb17233183 [0,0,0,0,0,1|2,0,1]=4 2098 B13R1.348 C\C(=C/C(C)=O)\Nc1cccc[n]1 Amb25718422 [0,0,0,0,0,1|2,0,1]=4 2099 B13R1.348 C\C(=C/C(C)=O)\Nc1ccccc1 Amb20672001 [0,0,0,0,0,1|1,0,1]=3 2100 B13R1.348 C\C(=C/C(O)=O)\Sc1ccccc1 Amb18130094 [0,0,0,0,0,1|2,0,1]=4 2101 B13R1.348 C\C(=C/c1ccccc1)\CC(=O)O Amb17594482 [0,0,0,0,0,1|2,0,1]=4 2102 B13R1.348 C\C(=C\C(=O)C)\Nc1ccccc1 Amb2386561 [0,0,0,0,0,1|1,0,1]=3 2103 B13R1.348 C\C(=C\C(C)=O)\Nc1cccc[n]1 Amb25743025 [0,0,0,0,0,1|2,0,1]=4 2104 B13R1.348 C\C(=C\C(N)=O)\Sc1ccccc1 Amb25178969 [0,0,0,0,0,1|2,0,1]=4 2105 B13R1.348 C\C(=C\c1ccccc1)\C=C(C)C Amb10606581 [0,0,0,0,0,1|2,0,1]=4 2106 B13R1.348 C\C(\CC(N)=O)=C/c1ccccc1 Amb22734412 [0,0,0,0,0,1|2,0,1]=4 2107 B13R1.348 C\C(\CC(N)=O)=C\c1ccccc1 Amb24603442 [0,0,0,0,0,1|2,0,1]=4 2108 B13R1.348 C\C(\CC(O)=O)=C\c1ccccc1 Amb25229524 [0,0,0,0,0,1|2,0,1]=4 2109 B13R1.348 Cl\C(=C/C(=O)C)\Sc1ccccc1 Amb17595760 [0,0,0,0,0,1|2,0,1]=4 2110 B13R1.348 NC(=O)OC(=O)Nc1ccccc1 Amb25350415 [0,0,0,0,0,1|2,0,1]=4 2111 B13R1.348 NC(Cc1ccccc1)CC(O)=O Amb20623358 [0,0,0,0,0,1|3,0,0]=4 2112 B13R1.348 O=C(Cc1ccccc1)CC(=O)C Amb15692856 [0,0,0,0,0,1|2,0,1]=4 2113 B13R1.348 O=C(Nc1ccccc1)CC(=O)C Amb1210069 [0,0,0,0,0,1|2,0,1]=4 2114 B13R1.348 OC(=O)CC(Br)Cc1ccccc1 Amb18111137 [0,0,0,0,0,1|3,0,0]=4 2115 B13R1.348 OC(=O)CC(Cl)Cc1ccccc1 Amb18111136 [0,0,0,0,0,1|3,0,0]=4 2116 B13R1.348 OC(Cc1ccccc1)CC(=O)O Amb17233662 [0,0,0,0,0,1|3,0,0]=4 2117 B13R1.348 S=C(Nc1ccccc1)NC(=O)C Amb2456399 [0,0,0,0,0,1|2,0,1]=4 2118 B13R1.348 [2H]C(Cc1ccccc1)C=C(C)C Amb22546630 [0,0,0,0,0,1|3,0,0]=4 2119 B10R1.15 C/C=C(\C)c1ccccc1 Amb17940650 [2,0,0,0,0,0|0,0,1]=3 2120 B10R1.15 C=CC(N)c1ccccc1 Amb18642931 [2,0,0,0,0,0|1,0,1]=4 2121 B10R1.15 C=CC(N)c1ccccc1 Amb22584092 [2,0,0,0,0,0|1,0,1]=4 2122 B10R1.15 C=CC(O)c1ccccc1 Amb21520382 [2,0,0,0,0,0|1,0,1]=4 2123 B10R1.15 C=C[C@@H](O)c1ccccc1 Amb22348498 [2,0,0,0,0,0|1,0,1]=4 2124 B10R1.15 C=C[C@H](O)c1ccccc1 Amb22348430 [2,0,0,0,0,0|1,0,1]=4 2125 B10R1.15 CC(C#C)c1ccccc1 Amb24106607 [2,0,0,0,0,0|0,0,2]=4 2126 B10R1.15 CC(C=O)c1c[n]ccc1 Amb24100578 [2,0,0,0,0,0|1,0,0]=3 2127 B10R1.15 CC(CN)c1ccccc1 Amb19958781 [2,0,0,0,0,0|1,0,1]=4 2128 B10R1.15 CC(ON)c1cc[n]cc1 Amb22397090 [2,0,0,0,0,0|2,0,0]=4 2129 B10R1.15 CC(ON)c1cccc[n]1 Amb22397048 [2,0,0,0,0,0|2,0,0]=4 2130 B10R1.15 CC(ON)c1ccccc1 Amb22491086 [2,0,0,0,0,0|1,0,0]=3 2131 B10R1.15 CC([Zn]Br)c1ccccc1 Amb22000433 [2,0,0,0,0,0|2,0,0]=4 2132 B10R1.15 CC([Zn]Cl)c1ccccc1 Amb22052836 [2,0,0,0,0,0|2,0,0]=4 2133 B10R1.15 CC(c1ccccc1)C#N Amb2387010 [2,0,0,0,0,0|1,0,1]=4 2134 B10R1.15 CC=C(F)c1ccccc1 Amb22008093 [2,0,0,0,0,0|1,0,1]=4 2135 B10R1.15 CCC(C)c1c[n]ccc1 Amb24690132 [2,0,0,0,0,0|1,0,1]=4 2136 B10R1.15 CCC(N)c1ccccc1 Amb19959910 [2,0,0,0,0,0|1,0,1]=4 2137 B10R1.15 CCC(c1ccccc1)N Amb1108026 [2,0,0,0,0,0|1,0,1]=4 2138 B10R1.15 CC[C@@H](N)c1ccccc1 Amb22265426 [2,0,0,0,0,0|1,0,1]=4 2139 B10R1.15 CC[C@H](C)c1cc[n]cc1 Amb24599884 [2,0,0,0,0,0|1,0,1]=4 2140 B10R1.15 CC[C@H](Cl)c1ccccc1 Amb24429104 [2,0,0,0,0,0|1,0,1]=4 2141 B10R1.15 CC[C@H](N)c1ccccc1 Amb22265559 [2,0,0,0,0,0|1,0,1]=4 2142 B10R1.15 CN(C=O)c1cc[n]cc1 Amb24096778 [2,0,0,0,0,0|2,0,0]=4 2143 B10R1.15 CN([13CH]=O)c1ccccc1 Amb22351846 [2,0,0,0,0,0|1,0,0]=3 2144 B10R1.15 CNC(C)c1c[n]ccc1 Amb22587688 [2,0,0,0,0,0|2,0,0]=4 2145 B10R1.15 CNC(C)c1cc[n]cc1 Amb22492289 [2,0,0,0,0,0|2,0,0]=4 2146 B10R1.15 CNC(C)c1cc[n]cc1 Amb22587687 [2,0,0,0,0,0|2,0,0]=4 2147 B10R1.15 CNC(C)c1cccc[n]1 Amb22274428 [2,0,0,0,0,0|2,0,0]=4 2148 B10R1.15 CNC(C)c1cccc[n]1 Amb22587689 [2,0,0,0,0,0|2,0,0]=4 2149 B10R1.15 CNC(c1ccccc1)C Amb1215689 [2,0,0,0,0,0|1,0,0]=3 2150 B10R1.15 CNC(c1ccccn1)C Amb10189608 [2,0,0,0,0,0|2,0,0]=4 2151 B10R1.15 CNC(c1ccccn1)C Amb1115311 [2,0,0,0,0,0|2,0,0]=4 2152 B10R1.15 CNC(c1cccnc1)C Amb10189690 [2,0,0,0,0,0|2,0,0]=4 2153 B10R1.15 CNC(c1cccnc1)C Amb1121577 [2,0,0,0,0,0|2,0,0]=4 2154 B10R1.15 CNC(c1ccncc1)C Amb10189609 [2,0,0,0,0,0|2,0,0]=4 2155 B10R1.15 CNC(c1ccncc1)C Amb1119143 [2,0,0,0,0,0|2,0,0]=4 2156 B10R1.15 CN[C@@H](C)c1cccc[n]1 Amb24744532 [2,0,0,0,0,0|2,0,0]=4 2157 B10R1.15 CN[C@@H](C)c1ccccc1 Amb17740009 [2,0,0,0,0,0|1,0,0]=3 2158 B10R1.15 CN[C@@H](C)c1ccccc1 Amb22899444 [2,0,0,0,0,0|1,0,0]=3 2159 B10R1.15 CN[C@@H](c1ccccc1)C Amb10844610 [2,0,0,0,0,0|1,0,0]=3 2160 B10R1.15 CN[C@H](C)c1c[n]ccc1 Amb25084519 [2,0,0,0,0,0|2,0,0]=4 2161 B10R1.15 CN[C@H](C)c1cc[n]cc1 Amb25114028 [2,0,0,0,0,0|2,0,0]=4 2162 B10R1.15 COC(=C)c1ccccc1 Amb10558859 [2,0,0,0,0,0|0,0,2]=4 2163 B10R1.15 COC(=S)c1ccccc1 Amb10569749 [2,0,0,0,0,0|1,0,1]=4 2164 B10R1.15 COC(=[NH2+])c1ccccc1 Amb10241351 [2,0,0,0,0,0|1,0,1]=4 2165 B10R1.15 COC(C)c1c[n][n]cc1 Amb24518776 [2,0,0,0,0,0|2,0,0]=4 2166 B10R1.15 COC(C)c1cc[n]cc1 Amb24102684 [2,0,0,0,0,0|1,0,0]=3 2167 B10R1.15 COC(C)c1ccccc1 Amb23568513 [2,0,0,0,0,0|0,0,0]=2 2168 B10R1.15 COC(Cl)c1ccccc1 Amb17940179 [2,0,0,0,0,0|1,0,0]=3 2169 B10R1.15 COC(O)c1c[n]ccc1 Amb25213606 [2,0,0,0,0,0|2,0,0]=4 2170 B10R1.15 COC(O)c1cccc[n]1 Amb25236210 [2,0,0,0,0,0|2,0,0]=4 2171 B10R1.15 COC(O)c1ccccc1 Amb25225981 [2,0,0,0,0,0|1,0,0]=3 2172 B10R1.15 CO[13C](=O)c1ccccc1 Amb22363354 [2,0,0,0,0,0|1,0,1]=4 2173 B10R1.15 CO[C@@H](Cl)c1ccccc1 Amb25108131 [2,0,0,0,0,0|1,0,0]=3 2174 B10R1.15 CPC(O)c1ccccc1 Amb25144461 [2,0,0,0,0,0|2,0,0]=4 2175 B10R1.15 CSC(C)c1cc[n]cc1 Amb25829904 [2,0,0,0,0,0|1,1,0]=4 2176 B10R1.15 C[C@@H](C=O)c1ccccc1 Amb24399258 [2,0,0,0,0,0|0,0,0]=2 2177 B10R1.15 C[C@@H](CBr)c1ccccc1 Amb25786304 [2,0,0,0,0,0|1,0,1]=4 2178 B10R1.15 C[C@@H](CCl)c1ccccc1 Amb24632311 [2,0,0,0,0,0|1,0,1]=4 2179 B10R1.15 C[C@@H](NN)c1ccccc1 Amb25824988 [2,0,0,0,0,0|2,0,0]=4 2180 B10R1.15 C[C@@H](NO)c1ccccc1 Amb20670899 [2,0,0,0,0,0|1,0,1]=4 2181 B10R1.15 C[C@@H](NO)c1ccccc1 Amb22736690 [2,0,0,0,0,0|1,0,1]=4 2182 B10R1.15 C[C@@H](ON)c1ccccc1 Amb25850037 [2,0,0,0,0,0|1,0,0]=3 2183 B10R1.15 C[C@H](C=O)c1ccccc1 Amb24476962 [2,0,0,0,0,0|0,0,0]=2 2184 B10R1.15 C[C@H](CCl)c1ccccc1 Amb24658260 [2,0,0,0,0,0|1,0,1]=4 2185 B10R1.15 C[C@H](NO)c1ccccc1 Amb20670900 [2,0,0,0,0,0|1,0,1]=4 2186 B10R1.15 C[C@H](NO)c1ccccc1 Amb22736688 [2,0,0,0,0,0|1,0,1]=4 2187 B10R1.15 C\C(=C/Br)\c1ccccc1 Amb25066105 [2,0,0,0,0,0|1,0,1]=4 2188 B10R1.15 C\C(=C/C)\c1c[n]ccc1 Amb24085629 [2,0,0,0,0,0|1,0,1]=4 2189 B10R1.15 C\C(=C/C)\c1cc[n]cc1 Amb24103190 [2,0,0,0,0,0|1,0,1]=4 2190 B10R1.15 C\C(=C\C)\c1cc[n]cc1 Amb24619216 [2,0,0,0,0,0|1,0,1]=4 2191 B10R1.15 C\C(=C\C)\c1cccc[n]1 Amb24580985 [2,0,0,0,0,0|1,0,1]=4 2192 B10R1.15 C\C(=C\N)\c1ccccc1 Amb24674165 [2,0,0,0,0,0|1,0,1]=4 2193 B10R1.15 C\[N+](=C\Cl)\c1ccccc1 Amb24740754 [2,0,0,0,0,0|2,0,0]=4 2194 B10R1.15 ClC(C=C)c1ccccc1 Amb17943120 [2,0,0,0,0,0|1,0,1]=4 2195 B10R1.15 ClCC(c1ccccc1)C Amb17232147 [2,0,0,0,0,0|1,0,1]=4 2196 B10R1.15 NCC(c1ccccc1)C Amb1085937 [2,0,0,0,0,0|1,0,1]=4 2197 B10R1.15 NC[C@H](c1ccccc1)C Amb10070369 [2,0,0,0,0,0|1,0,1]=4 2198 B10R1.15 NNC(c1ccccc1)C Amb10610271 [2,0,0,0,0,0|2,0,0]=4 2199 B10R1.15 NOC(c1ccccc1)C Amb17089185 [2,0,0,0,0,0|1,0,0]=3 2200 B10R1.15 O=CC(=C)c1ccccc1 Amb16233227 [2,0,0,0,0,0|0,0,2]=4 2201 B10R1.15 O=CC(Br)c1ccccc1 Amb18130512 [2,0,0,0,0,0|1,0,0]=3 2202 B10R1.15 O=CC(Cl)c1ccccc1 Amb18644699 [2,0,0,0,0,0|1,0,0]=3 2203 B10R1.15 O=CC(F)c1ccccc1 Amb24117053 [2,0,0,0,0,0|1,0,0]=3 2204 B10R1.15 O=CC(c1ccccc1)O Amb17593446 [2,0,0,0,0,0|1,0,0]=3 2205 B10R1.15 O=C[C@@H](F)c1ccccc1 Amb24564571 [2,0,0,0,0,0|1,0,0]=3 2206 B10R1.15 ON(C=O)c1ccccc1 Amb25027443 [2,0,0,0,0,0|2,0,0]=4 2207 B10R1.15 ONC(c1ccccc1)C Amb10605006 [2,0,0,0,0,0|1,0,1]=4 2208 B10R1.17 Br\C=C\Cc1ccccc1 Amb22053885 [2,0,0,0,0,0|2,0,0]=4 2209 B10R1.17 C=CNCc1ccccc1 Amb24505107 [2,0,0,0,0,0|1,0,1]=4 2210 B10R1.17 C=COCc1ccccc1 Amb17940722 [2,0,0,0,0,0|0,0,1]=3 2211 B10R1.17 C=NOCc1ccccc1 Amb24704253 [2,0,0,0,0,0|1,0,1]=4 2212 B10R1.17 CNCCc1ccccc1 Amb1132990 [2,0,0,0,0,0|2,0,0]=4 2213 B10R1.17 CNCCc1ccccc1 Amb2119452 [2,0,0,0,0,0|2,0,0]=4 2214 B10R1.17 CNNCc1ccccc1 Amb10553073 [2,0,0,0,0,0|2,0,0]=4 2215 B10R1.17 CNOCc1ccccc1 Amb22059601 [2,0,0,0,0,0|1,0,0]=3 2216 B10R1.17 CSSCc1ccccc1 Amb22230274 [2,0,0,0,0,0|1,1,0]=4 2217 B10R1.17 C\C=C\C[n+]1ccccc1 Amb24464480 [2,0,0,0,0,0|2,0,0]=4 2218 B10R1.17 C\C=C\Oc1ccccc1 Amb10564701 [2,0,0,0,0,0|2,0,0]=4 2219 B10R1.17 C\C=C\Sc1ccccc1 Amb24665698 [2,0,0,0,0,0|2,0,0]=4 2220 B10R1.17 C\C=N\Cc1cc[n]cc1 Amb25243601 [2,0,0,0,0,0|2,0,0]=4 2221 B10R1.17 ClC=CCc1ccccc1 Amb24093913 [2,0,0,0,0,0|2,0,0]=4 2222 B10R1.17 Cl\C=C\Cc1ccccc1 Amb24384369 [2,0,0,0,0,0|2,0,0]=4 2223 B10R1.17 N=COCc1ccccc1 Amb22269902 [2,0,0,0,0,0|1,0,0]=3 2224 B10R1.17 N=COCc1ccccc1 Amb24652885 [2,0,0,0,0,0|1,0,0]=3 2225 B10R1.17 O=CCCc1ccccn1 Amb17081674 [2,0,0,0,0,0|2,0,0]=4 2226 B10R1.17 O=CCCc1cccnc1 Amb17081675 [2,0,0,0,0,0|2,0,0]=4 2227 B10R1.17 O=CCNc1ccccc1 Amb24566865 [2,0,0,0,0,0|2,0,0]=4 2228 B10R1.17 O=CCSc1ccccc1 Amb17082903 [2,0,0,0,0,0|2,0,0]=4 2229 B10R1.17 O=CNCc1cccc[n]1 Amb22370826 [2,0,0,0,0,0|2,0,0]=4 2230 B10R1.17 O=CNCc1ccccc1 Amb1916036 [2,0,0,0,0,0|1,0,0]=3 2231 B10R1.17 O=C\C=C/c1ccccc1 Amb20246989 [2,0,0,0,0,0|1,0,1]=4 2232 B10R1.17 O=C\C=N\c1ccccc1 Amb24561719 [2,0,0,0,0,0|2,0,0]=4 2233 B10R1.17 OCOCc1ccccc1 Amb25727798 [2,0,0,0,0,0|0,0,2]=4 2234 B12R1.3 C=CC(NC=O)c1ccccc1 Amb24668872 [1,1,0,0,0,0|1,0,1]=4 2235 B12R1.3 CCC(NOC)c1ccccc1 Amb22896961 [1,1,0,0,0,0|2,0,0]=4 2236 B12R1.3 CCCC(CN)c1ccccc1 Amb22052580 [1,1,0,0,0,0|1,0,1]=4 2237 B12R1.3 CCCC(c1ccccc1)CBr Amb17247626 [1,1,0,0,0,0|1,0,1]=4 2238 B12R1.3 CCCC(c1ccccc1)CCl Amb17233968 [1,1,0,0,0,0|1,0,1]=4 2239 B12R1.3 CCCC(c1ccccc1)CO Amb17232487 [1,1,0,0,0,0|1,0,1]=4 2240 B12R1.3 CCN[C@@H](CO)c1ccccc1 Amb22745949 [1,1,0,0,0,0|1,0,1]=4 2241 B12R1.3 CC[C@@H](NC=O)c1ccccc1 Amb24756579 [1,1,0,0,0,0|1,0,0]=3 2242 B12R1.3 CC[C@H](N=C=O)c1ccccc1 Amb22045308 [1,1,0,0,0,0|1,0,1]=4 2243 B12R1.3 CC[C@H](NC=S)c1ccccc1 Amb25700860 [1,1,0,0,0,0|1,1,0]=4 2244 B12R1.3 CC\C(=C/C=O)\c1ccccc1 Amb24356754 [1,1,0,0,0,0|1,0,1]=4 2245 B12R1.3 CC\C(=C\C=O)\c1ccccc1 Amb18645367 [1,1,0,0,0,0|1,0,1]=4 2246 B12R1.3 CNCC(c1ccccc1)OC Amb17605856 [1,1,0,0,0,0|2,0,0]=4 2247 B12R1.3 CN\C(=C\C=O)\c1ccccc1 Amb25176166 [1,1,0,0,0,0|1,0,1]=4 2248 B12R1.3 COC(N=C=O)c1ccccc1 Amb25102728 [1,1,0,0,0,0|1,0,1]=4 2249 B12R1.3 COC(\C=C/Cl)c1ccccc1 Amb24426163 [1,1,0,0,0,0|2,0,0]=4 2250 B12R1.3 CO\C(=C/C=O)\c1ccccc1 Amb18645645 [1,1,0,0,0,0|1,0,1]=4 2251 B12R1.3 CS\C(=C/C=O)\c1ccccc1 Amb18648154 [1,1,0,0,0,0|1,0,1]=4 2252 B12R1.3 CS\C(=C\C=O)\c1ccccc1 Amb25798313 [1,1,0,0,0,0|1,0,1]=4 2253 B12R1.3 C\C=C\C(C=O)c1ccccc1 Amb24628954 [1,1,0,0,0,0|1,0,1]=4 2254 B12R1.3 C\C=C\C(CN)c1ccccc1 Amb24483889 [1,1,0,0,0,0|1,0,0]=3 2255 B12R1.3 C\C=C\C(CO)c1ccccc1 Amb24431887 [1,1,0,0,0,0|1,0,0]=3 2256 B12R1.3 C\C=C\C(NC)c1ccccc1 Amb18645551 [1,1,0,0,0,0|1,0,0]=3 2257 B12R1.3 C\C=N\C(CO)c1ccccc1 Amb25038797 [1,1,0,0,0,0|1,0,0]=3 2258 B12R1.3 C\C=N\[C@@H](CO)c1ccccc1 Amb25236547 [1,1,0,0,0,0|1,0,0]=3 2259 B12R1.3 NCC(c1ccccc1)OCC Amb17605997 [1,1,0,0,0,0|0,0,1]=3 2260 B12R1.3 OC[C@@H](N=C=O)c1ccccc1 Amb25137163 [1,1,0,0,0,0|1,0,1]=4 2261 B12R1.3 OC[C@H](c1ccccc1)NC=O Amb16203101 [1,1,0,0,0,0|1,0,0]=3 2262 B12R1.16 CC(N=C=O)c1ccc(Cl)cc1 Amb24709048 [1,1,0,0,0,0|1,0,1]=4 2263 B12R1.16 CC(N=C=O)c1ccc(O)cc1 Amb24636992 [1,1,0,0,0,0|1,0,1]=4 2264 B12R1.16 CC(NC=O)c1ccc(Cl)cc1 Amb24692281 [1,1,0,0,0,0|1,0,0]=3 2265 B12R1.16 CC(NC=O)c1ccc(F)c[n]1 Amb24753711 [1,1,0,0,0,0|2,0,0]=4 2266 B12R1.16 CC(NC=O)c1ccc(F)cc1 Amb25793871 [1,1,0,0,0,0|1,0,0]=3 2267 B12R1.16 CC(NC=O)c1ccc(O)cc1 Amb24432160 [1,1,0,0,0,0|1,0,0]=3 2268 B12R1.16 CC(c1ccc(cc1)Br)N=C=O Amb10808012 [1,1,0,0,0,0|1,0,1]=4 2269 B12R1.16 CCCC(C)c1ccc(N)cc1 Amb18126395 [1,1,0,0,0,0|1,0,1]=4 2270 B12R1.16 CCCC(c1ccc(cc1)O)C Amb17594074 [1,1,0,0,0,0|1,0,1]=4 2271 B12R1.16 CCNC(c1ccc(cc1)Br)C Amb1095032 [1,1,0,0,0,0|1,0,1]=4 2272 B12R1.16 CCNC(c1ccc(cc1)F)C Amb10188230 [1,1,0,0,0,0|1,0,1]=4 2273 B12R1.16 CCN[C@@H](C)c1ccc(Cl)cc1 Amb25138514 [1,1,0,0,0,0|1,0,1]=4 2274 B12R1.16 CCN[C@H](C)c1ccc(Br)cc1 Amb25788596 [1,1,0,0,0,0|1,0,1]=4 2275 B12R1.16 CCN[C@H](C)c1ccc(Cl)cc1 Amb24383514 [1,1,0,0,0,0|1,0,1]=4 2276 B12R1.16 CCOC(C)c1ccc(Br)cc1 Amb23443733 [1,1,0,0,0,0|0,0,1]=3 2277 B12R1.16 CCOC(C)c1ccc(N)cc1 Amb18974004 [1,1,0,0,0,0|0,0,1]=3 2278 B12R1.16 CCOC(C)c1ccc(S)cc1 Amb23568732 [1,1,0,0,0,0|0,0,1]=3 2279 B12R1.16 CCSC(C)c1ccc(N)cc1 Amb18974009 [1,1,0,0,0,0|0,1,1]=4 2280 B12R1.16 CN(CC=O)c1ccc(F)cc1 Amb18788556 [1,1,0,0,0,0|2,0,0]=4 2281 B12R1.16 CNCC(C)c1ccc(N)cc1 Amb24355889 [1,1,0,0,0,0|2,0,0]=4 2282 B12R1.16 CNCC(c1ccc(cc1)Br)C Amb17248095 [1,1,0,0,0,0|2,0,0]=4 2283 B12R1.16 CNCC(c1ccc(cc1)C)C Amb17232442 [1,1,0,0,0,0|2,0,0]=4 2284 B12R1.16 CNCC(c1ccc(cc1)Cl)C Amb17234045 [1,1,0,0,0,0|2,0,0]=4 2285 B12R1.16 CNCC(c1ccc(cc1)F)C Amb17232642 [1,1,0,0,0,0|2,0,0]=4 2286 B12R1.16 COCC(C)c1ccc(N)cc1 Amb25362017 [1,1,0,0,0,0|2,0,0]=4 2287 B12R1.16 CONC(C)c1ccc(Br)cc1 Amb18747016 [1,1,0,0,0,0|2,0,0]=4 2288 B12R1.16 CONC(C)c1ccc(F)cc1 Amb25109738 [1,1,0,0,0,0|2,0,0]=4 2289 B12R1.16 C[C@@H](N=C=O)c1ccc(Br)cc1 Amb22053849 [1,1,0,0,0,0|1,0,1]=4 2290 B12R1.16 C[C@@H](NC=O)c1ccc(F)cc1 Amb25088808 [1,1,0,0,0,0|1,0,0]=3 2291 B12R1.16 C[C@H](CC=O)c1ccc(Cl)cc1 Amb25039267 [1,1,0,0,0,0|1,0,0]=3 2292 B12R1.16 C[C@H](N=C=O)c1ccc(Br)cc1 Amb22045324 [1,1,0,0,0,0|1,0,1]=4 2293 B12R1.16 C[C@H](N=C=O)c1ccc(Cl)cc1 Amb22045301 [1,1,0,0,0,0|1,0,1]=4 2294 B12R1.16 C[C@H](N=C=O)c1ccc(F)cc1 Amb22045303 [1,1,0,0,0,0|1,0,1]=4 2295 B12R1.16 C[C@H](NC=O)c1ccc(Br)cc1 Amb25674481 [1,1,0,0,0,0|1,0,0]=3 2296 B12R1.16 C[C@H](NC=O)c1ccc(F)cc1 Amb25039112 [1,1,0,0,0,0|1,0,0]=3 2297 B12R1.16 C\C(=C/C=O)\c1ccc(Cl)cc1 Amb24678835 [1,1,0,0,0,0|1,0,1]=4 2298 B12R1.16 C\C(=C/C=O)\c1ccc(F)cc1 Amb25773437 [1,1,0,0,0,0|1,0,1]=4 2299 B12R1.16 C\C(=C/C=O)\c1ccc(O)cc1 Amb24532739 [1,1,0,0,0,0|1,0,1]=4 2300 B12R1.16 C\C=C\C(C)c1ccc(N)cc1 Amb18645538 [1,1,0,0,0,0|1,0,0]=3 2301 B12R1.16 C\C=C\C(C)c1ccc(O)cc1 Amb24737403 [1,1,0,0,0,0|1,0,0]=3 2302 B12R1.16 Cc1ccc(cc1)C(C)CC=C Amb24556400 [1,1,0,0,0,0|1,0,1]=4 2303 B12R1.16 Cc1ccc(cc1)C(C)CC=O Amb18645706 [1,1,0,0,0,0|1,0,0]=3 2304 B12R1.16 Cc1ccc(cc1)C(C)N=C=O Amb25189504 [1,1,0,0,0,0|1,0,1]=4 2305 B12R1.16 Cc1ccc(cc1)C(C)NC=O Amb25675923 [1,1,0,0,0,0|1,0,0]=3 2306 B12R1.16 Cc1ccc(cc1)C(C)NOC Amb25829141 [1,1,0,0,0,0|2,0,0]=4 2307 B12R1.16 Cc1ccc(cc1)C(Cl)\C=C\C Amb25779946 [1,1,0,0,0,0|2,0,0]=4 2308 B12R1.16 Cc1ccc(cc1)C(O)CC=O Amb24391927 [1,1,0,0,0,0|2,0,0]=4 2309 B12R1.16 Cc1ccc(cc1)N(C)CC=O Amb18788188 [1,1,0,0,0,0|2,0,0]=4 2310 B12R1.16 Cc1ccc(cc1)[C@@H](C)NCC Amb24425911 [1,1,0,0,0,0|1,0,1]=4 2311 B12R1.16 Cc1ccc(cc1)[C@H](C)CC=O Amb24697433 [1,1,0,0,0,0|1,0,0]=3 2312 B12R1.16 Cc1ccc(cc1)[C@H](C)NC=O Amb24442760 [1,1,0,0,0,0|1,0,0]=3 2313 B12R1.16 Cc1ccc(cc1)[C@H](C)NCC Amb24415678 [1,1,0,0,0,0|1,0,1]=4 2314 B12R1.16 Cc1ccc(cc1)\C(\C)=C/C=O Amb18645364 [1,1,0,0,0,0|1,0,1]=4 2315 B12R1.16 Cc1ccc(cc1)\C(\C)=C\C=O Amb25124863 [1,1,0,0,0,0|1,0,1]=4 2316 B12R1.16 OC(CC=O)c1ccc(Cl)cc1 Amb25094341 [1,1,0,0,0,0|2,0,0]=4 2317 B12R1.16 OC(CC=O)c1ccc(F)cc1 Amb25053144 [1,1,0,0,0,0|2,0,0]=4 2318 B12R1.17 CC(CC=O)c1cccc(O)c1 Amb25195457 [1,1,0,0,0,0|1,0,0]=3 2319 B12R1.17 CC(N=C=O)c1cccc(Br)c1 Amb25045945 [1,1,0,0,0,0|1,0,1]=4 2320 B12R1.17 CC(N=C=O)c1cccc(Cl)c1 Amb25189503 [1,1,0,0,0,0|1,0,1]=4 2321 B12R1.17 CC(N=C=O)c1cccc(F)c1 Amb25782325 [1,1,0,0,0,0|1,0,1]=4 2322 B12R1.17 CC(N=C=O)c1cccc(O)c1 Amb25253119 [1,1,0,0,0,0|1,0,1]=4 2323 B12R1.17 CC(NC=O)c1cccc(Cl)c1 Amb25042206 [1,1,0,0,0,0|1,0,0]=3 2324 B12R1.17 CC(NC=O)c1cccc(F)c1 Amb24432563 [1,1,0,0,0,0|1,0,0]=3 2325 B12R1.17 CC(NC=O)c1cccc(O)c1 Amb24406138 [1,1,0,0,0,0|1,0,0]=3 2326 B12R1.17 CCCC(C)c1cccc(Br)c1 Amb25281341 [1,1,0,0,0,0|1,0,1]=4 2327 B12R1.17 CCNC(C)c1cccc(I)c1 Amb25061694 [1,1,0,0,0,0|1,0,1]=4 2328 B12R1.17 CCNC(C)c1cccc(S)c1 Amb25798719 [1,1,0,0,0,0|1,0,1]=4 2329 B12R1.17 CCN[C@@H](C)c1cccc(Cl)c1 Amb25081589 [1,1,0,0,0,0|1,0,1]=4 2330 B12R1.17 CCN[C@H](C)c1cccc(Br)c1 Amb25075777 [1,1,0,0,0,0|1,0,1]=4 2331 B12R1.17 CCN[C@H](C)c1cccc(Cl)c1 Amb25067502 [1,1,0,0,0,0|1,0,1]=4 2332 B12R1.17 CCOC(C)c1cc(Cl)cc[n]1 Amb24458654 [1,1,0,0,0,0|1,0,1]=4 2333 B12R1.17 CCOC(C)c1cccc(N)c1 Amb18973987 [1,1,0,0,0,0|0,0,1]=3 2334 B12R1.17 CCOC(Cl)c1cccc(F)c1 Amb24429076 [1,1,0,0,0,0|1,0,1]=4 2335 B12R1.17 CCSC(C)c1cccc(Cl)c1 Amb25036538 [1,1,0,0,0,0|0,1,1]=4 2336 B12R1.17 CCSC(C)c1cccc(N)c1 Amb18973995 [1,1,0,0,0,0|0,1,1]=4 2337 B12R1.17 CN(CC=O)c1cccc(F)c1 Amb18788558 [1,1,0,0,0,0|2,0,0]=4 2338 B12R1.17 CNCC(C)c1cccc(O)c1 Amb25804026 [1,1,0,0,0,0|2,0,0]=4 2339 B12R1.17 CNC[C@H](C)c1cccc(O)c1 Amb25774924 [1,1,0,0,0,0|2,0,0]=4 2340 B12R1.17 CONC(C)c1cccc(Br)c1 Amb25097009 [1,1,0,0,0,0|2,0,0]=4 2341 B12R1.17 CONC(C)c1cccc(F)c1 Amb24429508 [1,1,0,0,0,0|2,0,0]=4 2342 B12R1.17 CONC(C)c1cccc(O)c1 Amb24372902 [1,1,0,0,0,0|2,0,0]=4 2343 B12R1.17 CSCC(C)c1cccc(Cl)c1 Amb24525351 [1,1,0,0,0,0|2,0,0]=4 2344 B12R1.17 C[C@@H](NC=O)c1cccc(Br)c1 Amb24342087 [1,1,0,0,0,0|1,0,0]=3 2345 B12R1.17 C[C@@H](NC=O)c1cccc(Cl)c1 Amb25708277 [1,1,0,0,0,0|1,0,0]=3 2346 B12R1.17 C[C@H](CC=O)c1cccc(Cl)c1 Amb24640335 [1,1,0,0,0,0|1,0,0]=3 2347 B12R1.17 C[C@H](NC=O)c1cccc(Br)c1 Amb24525072 [1,1,0,0,0,0|1,0,0]=3 2348 B12R1.17 C[C@H](NC=O)c1cccc(F)c1 Amb25844630 [1,1,0,0,0,0|1,0,0]=3 2349 B12R1.17 Cc1cc(ccc1)C(O)CC=O Amb24366566 [1,1,0,0,0,0|2,0,0]=4 2350 B12R1.17 Cc1cccc(c1)C(C)CNC Amb25069401 [1,1,0,0,0,0|2,0,0]=4 2351 B12R1.17 Cc1cccc(c1)C(C)N=C=O Amb25160024 [1,1,0,0,0,0|1,0,1]=4 2352 B12R1.17 Cc1cccc(c1)C(C)NC=O Amb25274948 [1,1,0,0,0,0|1,0,0]=3 2353 B12R1.17 Cc1cccc(c1)C(C)SCC Amb25792019 [1,1,0,0,0,0|0,1,1]=4 2354 B12R1.17 Cc1cccc(c1)N(C)CC=O Amb18788187 [1,1,0,0,0,0|2,0,0]=4 2355 B12R1.17 Cc1cccc(c1)[C@@H](C)NCC Amb24448414 [1,1,0,0,0,0|1,0,1]=4 2356 B12R1.17 Cc1cccc(c1)[C@H](C)NC=O Amb25141298 [1,1,0,0,0,0|1,0,0]=3 2357 B12R1.17 Cc1cccc(c1)\C(\C)=C/C=O Amb24633639 [1,1,0,0,0,0|1,0,1]=4 2358 B12R1.17 Cc1cccc(c1)\C(\C)=C\C=O Amb25087188 [1,1,0,0,0,0|1,0,1]=4 2359 B12R1.17 OC(CC=O)c1cccc(Br)c1 Amb25258748 [1,1,0,0,0,0|2,0,0]=4 2360 B12R1.30 CC(=C=CCO)c1ccccc1 Amb25855530 [1,1,0,0,0,0|1,0,1]=4 2361 B12R1.30 CC(C#CCO)c1ccccc1 Amb24457769 [1,1,0,0,0,0|1,0,1]=4 2362 B12R1.30 CC(CCC=C)c1ccccc1 Amb24062989 [1,1,0,0,0,0|1,0,1]=4 2363 B12R1.30 CC(CCCN)c1ccccc1 Amb18563593 [1,1,0,0,0,0|1,0,1]=4 2364 B12R1.30 CC(C\C=N\N)c1ccccc1 Amb24685554 [1,1,0,0,0,0|2,0,0]=4 2365 B12R1.30 CC(OCCO)c1ccccc1 Amb24103429 [1,1,0,0,0,0|0,0,1]=3 2366 B12R1.30 CC(\C=C\C#N)c1ccccc1 Amb18644939 [1,1,0,0,0,0|1,0,1]=4 2367 B12R1.30 CC(\C=C\C=O)c1ccccc1 Amb24554527 [1,1,0,0,0,0|1,0,0]=3 2368 B12R1.30 CC(\C=C\CCl)c1ccccc1 Amb25776220 [1,1,0,0,0,0|1,0,0]=3 2369 B12R1.30 CC(\C=C\CN)c1ccccc1 Amb24702766 [1,1,0,0,0,0|1,0,0]=3 2370 B12R1.30 CC(\N=C\CCl)c1ccccc1 Amb24558631 [1,1,0,0,0,0|1,0,0]=3 2371 B12R1.30 CC=C=CC(N)c1ccccc1 Amb25679572 [1,1,0,0,0,0|2,0,0]=4 2372 B12R1.30 CC=C=C[C@H](N)c1ccccc1 Amb25771886 [1,1,0,0,0,0|2,0,0]=4 2373 B12R1.30 CC=CCC(C)c1ccccc1 Amb24062990 [1,1,0,0,0,0|1,0,0]=3 2374 B12R1.30 CCCNC(c1ccccc1)C Amb1833463 [1,1,0,0,0,0|1,0,1]=4 2375 B12R1.30 CCNCC(c1ccccc1)C Amb2119469 [1,1,0,0,0,0|1,0,1]=4 2376 B12R1.30 CCOC[C@H](c1ccccc1)N Amb17061646 [1,1,0,0,0,0|1,0,1]=4 2377 B12R1.30 CC\C=C/C(N)c1ccccc1 Amb25696046 [1,1,0,0,0,0|2,0,0]=4 2378 B12R1.30 CC\C=C/N(C)c1ccccc1 Amb24072870 [1,1,0,0,0,0|2,0,0]=4 2379 B12R1.30 CC\C=C\C(O)c1ccccc1 Amb22546781 [1,1,0,0,0,0|2,0,0]=4 2380 B12R1.30 CC\C=C\N(C)c1ccccc1 Amb24575001 [1,1,0,0,0,0|2,0,0]=4 2381 B12R1.30 CC\C=N\C(C)c1ccccc1 Amb24436889 [1,1,0,0,0,0|1,0,0]=3 2382 B12R1.30 CN(OCC=C)c1ccccc1 Amb22366090 [1,1,0,0,0,0|1,0,1]=4 2383 B12R1.30 CN\C=N\N(C)c1ccccc1 Amb24443088 [1,1,0,0,0,0|2,0,0]=4 2384 B12R1.30 CN\N=C\C(C)c1ccccc1 Amb24476432 [1,1,0,0,0,0|2,0,0]=4 2385 B12R1.30 CO\C=C\C(O)c1ccccc1 Amb25204750 [1,1,0,0,0,0|2,0,0]=4 2386 B12R1.30 CO\N=C\C(C)c1ccccc1 Amb24403672 [1,1,0,0,0,0|2,0,0]=4 2387 B12R1.30 C[C@@H](OCC=O)c1ccccc1 Amb22896802 [1,1,0,0,0,0|0,0,0]=2 2388 B12R1.30 C[C@@H](\N=C\CCl)c1ccccc1 Amb25187511 [1,1,0,0,0,0|1,0,0]=3 2389 B12R1.30 C[C@H]([NH2+]CCCl)c1ccccc1 Amb17773001 [1,1,0,0,0,0|1,0,1]=4 2390 B12R1.30 C\C(=C/CC=O)\c1ccccc1 Amb18645375 [1,1,0,0,0,0|1,0,1]=4 2391 B12R1.30 C\C(=C/NC=O)\c1ccccc1 Amb24637832 [1,1,0,0,0,0|1,0,1]=4 2392 B12R1.30 C\C(=C\CC=O)\c1ccccc1 Amb24757521 [1,1,0,0,0,0|1,0,1]=4 2393 B12R1.30 C\C(=N/NC=O)\c1ccccc1 Amb25844967 [1,1,0,0,0,0|1,0,1]=4 2394 B12R1.30 C\C(=N\NC=O)\c1ccccc1 Amb25091882 [1,1,0,0,0,0|1,0,1]=4 2395 B12R1.30 C\C(=N\OCC)\c1ccccc1 Amb25833281 [1,1,0,0,0,0|0,0,2]=4 2396 B12R1.30 C\C=C/NC(C)c1ccccc1 Amb25158747 [1,1,0,0,0,0|1,0,0]=3 2397 B12R1.30 C\C=C\CN(C)c1ccccc1 Amb22546831 [1,1,0,0,0,0|2,0,0]=4 2398 B12R1.30 C\C=N\CC(O)c1ccccc1 Amb25256333 [1,1,0,0,0,0|2,0,0]=4 2399 B12R1.30 ClCCNC(c1ccccc1)C Amb10069614 [1,1,0,0,0,0|1,0,1]=4 2400 B12R1.30 ClCCNC(c1ccccc1)C Amb17335659 [1,1,0,0,0,0|1,0,1]=4 2401 B12R1.30 ClC\C=C\C(Cl)c1ccccc1 Amb24642037 [1,1,0,0,0,0|2,0,0]=4 2402 B12R1.30 NC(\C=C\CO)c1ccccc1 Amb25312103 [1,1,0,0,0,0|2,0,0]=4 2403 B12R1.30 NCCNC(c1ccccc1)C Amb17091024 [1,1,0,0,0,0|1,0,1]=4 2404 B12R1.30 NCCSC(c1ccccc1)C Amb17500453 [1,1,0,0,0,0|0,1,1]=4 2405 B12R1.30 O=C(OCC=O)c1ccccc1 Amb18645965 [1,1,0,0,0,0|1,0,1]=4 2406 B12R1.30 OC(CNC=O)c1ccccc1 Amb18792635 [1,1,0,0,0,0|2,0,0]=4 2407 B12R1.30 OC(\C=C\C=O)c1ccccc1 Amb18645664 [1,1,0,0,0,0|2,0,0]=4 2408 B12R1.30 OCCNC(c1ccccc1)C Amb2092663 [1,1,0,0,0,0|1,0,1]=4 2409 B12R1.30 OC\C=C\C(O)c1ccccc1 Amb25071691 [1,1,0,0,0,0|2,0,0]=4 2410 B12R1.30 OC\C=C\[C@@H](O)c1ccccc1 Amb25285682 [1,1,0,0,0,0|2,0,0]=4 2411 B12R1.34 C=C(C=O)C(O)c1ccccc1 Amb18645656 [1,1,0,0,0,0|2,0,0]=4 2412 B12R1.34 CC(C(=O)C=C)c1ccccc1 Amb24537754 [1,1,0,0,0,0|1,0,1]=4 2413 B12R1.34 CC(C(Br)CC)c1ccccc1 Amb25805104 [1,1,0,0,0,0|1,0,1]=4 2414 B12R1.34 CC(C(C)C=O)c1ccccc1 Amb24065337 [1,1,0,0,0,0|1,0,0]=3 2415 B12R1.34 CC(C(Cl)C=O)c1ccccc1 Amb18648719 [1,1,0,0,0,0|1,0,0]=3 2416 B12R1.34 CC(C(N)CC)c1ccccc1 Amb18829127 [1,1,0,0,0,0|1,0,1]=4 2417 B12R1.34 CC(C(N)CC)c1ccccc1 Amb20623710 [1,1,0,0,0,0|1,0,1]=4 2418 B12R1.34 CC(C(O)C=C)c1ccccc1 Amb25310831 [1,1,0,0,0,0|1,0,1]=4 2419 B12R1.34 CC(N(C)C=O)c1ccccc1 Amb17672989 [1,1,0,0,0,0|1,0,0]=3 2420 B12R1.34 CC(c1cc[n]cc1)N(C)C=O Amb24425339 [1,1,0,0,0,0|2,0,0]=4 2421 B12R1.34 CC(c1ccccc1)N(C)N=O Amb24408926 [1,1,0,0,0,0|2,0,0]=4 2422 B12R1.34 CCC(=C)C(C)c1ccccc1 Amb24617256 [1,1,0,0,0,0|1,0,1]=4 2423 B12R1.34 CCC(=O)[C@@H](C)c1ccccc1 Amb25706991 [1,1,0,0,0,0|1,0,1]=4 2424 B12R1.34 CCC(=O)[C@H](C)c1ccccc1 Amb25730209 [1,1,0,0,0,0|1,0,1]=4 2425 B12R1.34 CNC(=O)[C@@H](C)c1ccccc1 Amb24682080 [1,1,0,0,0,0|2,0,0]=4 2426 B12R1.34 CNC(=O)[C@H](C)c1ccccc1 Amb25277288 [1,1,0,0,0,0|2,0,0]=4 2427 B12R1.34 CNC(=S)C(C)c1ccccc1 Amb24756688 [1,1,0,0,0,0|2,0,0]=4 2428 B12R1.34 CNC(=S)[C@@H](C)c1ccccc1 Amb24383001 [1,1,0,0,0,0|2,0,0]=4 2429 B12R1.34 CNC(C)C(C)c1ccccc1 Amb18645936 [1,1,0,0,0,0|2,0,0]=4 2430 B12R1.34 CN[C@@H](C)[C@@H](C)c1ccccc1 Amb25674163 [1,1,0,0,0,0|2,0,0]=4 2431 B12R1.34 CN[C@H](C)[C@@H](C)c1ccccc1 Amb24373827 [1,1,0,0,0,0|2,0,0]=4 2432 B12R1.34 COC(=N)C(C)c1ccccc1 Amb24095998 [1,1,0,0,0,0|2,0,0]=4 2433 B12R1.34 COC(=O)C(c1ccccc1)C Amb16185437 [1,1,0,0,0,0|2,0,0]=4 2434 B12R1.34 COC(=O)[C@@H](C)c1ccccc1 Amb24704365 [1,1,0,0,0,0|2,0,0]=4 2435 B12R1.34 C[C@@H](C=O)C(O)c1ccccc1 Amb24341884 [1,1,0,0,0,0|2,0,0]=4 2436 B12R1.34 C[C@@H](C=O)[C@H](O)c1ccccc1 Amb25780663 [1,1,0,0,0,0|2,0,0]=4 2437 B12R1.34 C[C@@H]([C@@H](Cl)C=O)c1ccccc1 Amb24634357 [1,1,0,0,0,0|1,0,0]=3 2438 B12R1.34 C[C@@H]([C@H](Cl)C=O)c1ccccc1 Amb25322070 [1,1,0,0,0,0|1,0,0]=3 2439 B12R1.34 C[C@@H]([C@H](O)CC)c1ccccc1 Amb25317557 [1,1,0,0,0,0|1,0,1]=4 2440 B12R1.34 C[C@H](C(=C)C=O)c1ccccc1 Amb25800041 [1,1,0,0,0,0|1,0,0]=3 2441 B12R1.34 C[C@H](C(Cl)C=O)c1ccccc1 Amb24358040 [1,1,0,0,0,0|1,0,0]=3 2442 B12R1.34 C[C@H](C=O)[C@@H](O)c1ccccc1 Amb25255331 [1,1,0,0,0,0|2,0,0]=4 2443 B12R1.34 C[C@H]([C@@H](O)NC)c1ccccc1 Amb25803440 [1,1,0,0,0,0|2,0,0]=4 2444 B12R1.34 C[C@H]([C@H](N)CC)c1ccccc1 Amb25800098 [1,1,0,0,0,0|1,0,1]=4 2445 B12R1.34 C[C@H]([C@H](O)C=C)c1ccccc1 Amb25097849 [1,1,0,0,0,0|1,0,1]=4 2446 B12R1.34 C\C(=C(\F)/C=O)\c1ccccc1 Amb24757282 [1,1,0,0,0,0|1,0,1]=4 2447 B12R1.34 C\C(\c1ccccc1)=C(\C)/C=O Amb18645379 [1,1,0,0,0,0|1,0,1]=4 2448 B12R1.34 C\C=C(/Cl)\C(Cl)c1ccccc1 Amb24728456 [1,1,0,0,0,0|2,0,0]=4 2449 B12R1.34 C\C=C(\Cl)/C(Cl)c1ccccc1 Amb24593524 [1,1,0,0,0,0|2,0,0]=4 2450 B12R1.34 C\C=C(\Cl)/C(O)c1ccccc1 Amb25092807 [1,1,0,0,0,0|2,0,0]=4 2451 B12R1.34 O=CC(C(c1ccccc1)Br)Br Amb16233220 [1,1,0,0,0,0|2,0,0]=4 2452 B12R1.34 O=CC(Cl)C(Cl)c1ccccc1 Amb25123958 [1,1,0,0,0,0|2,0,0]=4 2453 B12R1.34 O=CN(C(c1ccccc1)C)O Amb10606548 [1,1,0,0,0,0|1,0,0]=3 2454 B12R1.34 O=C[C@H](Cl)[C@@H](Cl)c1ccccc1 Amb25119234 [1,1,0,0,0,0|2,0,0]=4 2455 B12R1.34 OC(C(O)C=O)c1ccccc1 Amb25309597 [1,1,0,0,0,0|2,0,0]=4 2456 B12R1.34 O[C@H]([C@@H](O)C=O)c1ccccc1 Amb25785152 [1,1,0,0,0,0|2,0,0]=4 2457 B12R1.39 CC(C)(CC=C)c1ccccc1 Amb25674101 [1,1,0,0,0,0|1,0,1]=4 2458 B12R1.39 CC(C)(CC=O)c1cccc[n]1 Amb24458826 [1,1,0,0,0,0|2,0,0]=4 2459 B12R1.39 CC(C)(CC=O)c1ccccc1 Amb18645712 [1,1,0,0,0,0|1,0,0]=3 2460 B12R1.39 CC(O)(CC=O)c1c[n]ccc1 Amb24631274 [1,1,0,0,0,0|2,0,0]=4 2461 B12R1.39 CC(O)(CC=O)c1ccccc1 Amb18646085 [1,1,0,0,0,0|1,0,0]=3 2462 B12R1.39 CC(O)(\C=C\Cl)c1ccccc1 Amb25257949 [1,1,0,0,0,0|2,0,0]=4 2463 B12R1.39 CCOP(C)(=O)c1ccccc1 Amb24487373 [1,1,0,0,0,0|1,0,1]=4 2464 B12R1.39 CCO[Si](C)(C)c1ccccc1 Amb19894004 [1,1,0,0,0,0|0,1,1]=4 2465 B12R1.39 CNCC(C)(N)c1ccccc1 Amb18298752 [1,1,0,0,0,0|2,0,0]=4 2466 B12R1.39 COCC(C)(N)c1ccccc1 Amb18992592 [1,1,0,0,0,0|2,0,0]=4 2467 B12R1.39 COCC(C)(O)c1ccccc1 Amb18801043 [1,1,0,0,0,0|2,0,0]=4 2468 B12R1.39 COC[C@@](C)(N)c1ccccc1 Amb25856946 [1,1,0,0,0,0|2,0,0]=4 2469 B12R1.39 CP(=S)(CC=O)c1ccccc1 Amb25743462 [1,1,0,0,0,0|2,0,0]=4 2470 B12R1.39 CSCC(C)(O)c1ccccc1 Amb19061286 [1,1,0,0,0,0|2,0,0]=4 2471 B12R1.39 C[C@@](N)(CC=C)c1ccccc1 Amb25111215 [1,1,0,0,0,0|1,0,1]=4 2472 B12R1.39 C[Si](C)(CC=O)c1ccccc1 Amb25264011 [1,1,0,0,0,0|1,1,0]=4 2473 B12R1.39 O=C=NC(c1ccccc1)(C)C Amb17232367 [1,1,0,0,0,0|1,0,1]=4 2474 B12R1.39 [BH3-][P+](C)(CC=O)c1ccccc1 Amb24378353 [1,1,0,0,0,0|2,0,0]=4 2475 B12R1.308 CC#CC(C)c1ccccc1O Amb24497018 [1,1,0,0,0,0|1,0,1]=4 2476 B12R1.308 CC(CC=O)c1ccccc1Cl Amb18648717 [1,1,0,0,0,0|1,0,0]=3 2477 B12R1.308 CC(CC=O)c1ccccc1F Amb25253611 [1,1,0,0,0,0|1,0,0]=3 2478 B12R1.308 CC(N=C=O)c1ccccc1F Amb24483318 [1,1,0,0,0,0|1,0,1]=4 2479 B12R1.308 CC(N=C=O)c1ccccc1O Amb25178459 [1,1,0,0,0,0|1,0,1]=4 2480 B12R1.308 CC(NC=O)c1ccccc1Cl Amb25717177 [1,1,0,0,0,0|1,0,0]=3 2481 B12R1.308 CC(NC=O)c1ccccc1F Amb25700735 [1,1,0,0,0,0|1,0,0]=3 2482 B12R1.308 CC(NC=O)c1ccccc1O Amb24485592 [1,1,0,0,0,0|1,0,0]=3 2483 B12R1.308 CCCC(C)c1ccccc1N Amb24729496 [1,1,0,0,0,0|1,0,1]=4 2484 B12R1.308 CCN[C@@H](C)c1ccccc1Br Amb25073112 [1,1,0,0,0,0|1,0,1]=4 2485 B12R1.308 CCN[C@@H](C)c1ccccc1Cl Amb25764966 [1,1,0,0,0,0|1,0,1]=4 2486 B12R1.308 CCN[C@H](C)c1ccccc1F Amb24665516 [1,1,0,0,0,0|1,0,1]=4 2487 B12R1.308 CCOC(C)c1ccccc1Cl Amb24061174 [1,1,0,0,0,0|0,0,1]=3 2488 B12R1.308 CCOC(C)c1ccccc1O Amb25667447 [1,1,0,0,0,0|0,0,1]=3 2489 B12R1.308 CCSC(C)c1ccccc1Br Amb24732685 [1,1,0,0,0,0|0,1,1]=4 2490 B12R1.308 CCSC(C)c1ccccc1O Amb18648671 [1,1,0,0,0,0|0,1,1]=4 2491 B12R1.308 CN(CC=O)c1ccccc1F Amb18788557 [1,1,0,0,0,0|2,0,0]=4 2492 B12R1.308 CN(OCC)c1ccccc1N Amb24760740 [1,1,0,0,0,0|1,0,1]=4 2493 B12R1.308 CNCC(C)c1ccccc1Br Amb25035170 [1,1,0,0,0,0|2,0,0]=4 2494 B12R1.308 CNCC(C)c1ccccc1F Amb25827937 [1,1,0,0,0,0|2,0,0]=4 2495 B12R1.308 CONC(C)c1ccccc1O Amb24441195 [1,1,0,0,0,0|2,0,0]=4 2496 B12R1.308 C[C@@H](NC=O)c1ccccc1Br Amb24406943 [1,1,0,0,0,0|1,0,0]=3 2497 B12R1.308 C[C@@H](NC=O)c1ccccc1Cl Amb24665517 [1,1,0,0,0,0|1,0,0]=3 2498 B12R1.308 C[C@@H](NC=O)c1ccccc1F Amb24756310 [1,1,0,0,0,0|1,0,0]=3 2499 B12R1.308 C[C@H](CC=O)c1ccccc1Cl Amb24537615 [1,1,0,0,0,0|1,0,0]=3 2500 B12R1.308 C[C@H](NC=O)c1ccccc1Br Amb25073668 [1,1,0,0,0,0|1,0,0]=3 2501 B12R1.308 C[C@H](NC=O)c1ccccc1Cl Amb25736127 [1,1,0,0,0,0|1,0,0]=3 2502 B12R1.308 C\C(=C\C=O)\c1ccccc1Cl Amb25302195 [1,1,0,0,0,0|1,0,1]=4 2503 B12R1.308 C\C=C/C(C)c1ccccc1O Amb25059645 [1,1,0,0,0,0|1,0,0]=3 2504 B12R1.308 C\C=C\C(C)c1ccccc1N Amb18645537 [1,1,0,0,0,0|1,0,0]=3 2505 B12R1.308 C\C=C\C(C)c1ccccc1O Amb24608614 [1,1,0,0,0,0|1,0,0]=3 2506 B12R1.308 C\C=C\C(O)c1ccccc1O Amb24378436 [1,1,0,0,0,0|2,0,0]=4 2507 B12R1.308 Cc1ccccc1C(C)CNC Amb25255160 [1,1,0,0,0,0|2,0,0]=4 2508 B12R1.308 Cc1ccccc1C(C)N=C=O Amb25189609 [1,1,0,0,0,0|1,0,1]=4 2509 B12R1.308 Cc1ccccc1C(C)NC=O Amb24464016 [1,1,0,0,0,0|1,0,0]=3 2510 B12R1.308 Cc1ccccc1C(C)SCC Amb25157280 [1,1,0,0,0,0|0,1,1]=4 2511 B12R1.308 Cc1ccccc1C(O)\C=C\C Amb25112696 [1,1,0,0,0,0|2,0,0]=4 2512 B12R1.308 Cc1ccccc1N(C)CC=O Amb18788186 [1,1,0,0,0,0|2,0,0]=4 2513 B12R1.308 Cc1ccccc1[C@@H](C)NC=O Amb24388804 [1,1,0,0,0,0|1,0,0]=3 2514 B12R1.308 Cc1ccccc1[C@H](C)NC=O Amb24448498 [1,1,0,0,0,0|1,0,0]=3 2515 B12R1.308 Cc1ccccc1[C@H](C)NCC Amb24361005 [1,1,0,0,0,0|1,0,1]=4 2516 B12R1.21 CC(=N)NCc1ccc(Cl)cc1 Amb24483598 [1,1,0,0,0,0|2,0,0]=4 2517 B12R1.21 CC(=O)C#Cc1ccc(Cl)cc1 Amb24645414 [1,1,0,0,0,0|1,0,1]=4 2518 B12R1.21 CC(=O)C#Cc1ccc(F)cc1 Amb24484221 [1,1,0,0,0,0|1,0,1]=4 2519 B12R1.21 CC(=O)CCC=1C=CC(=O)NC1 Amb24346528 [1,1,0,0,0,0|2,0,0]=4 2520 B12R1.21 CC(=O)CCN1C=CC(=O)C=C1 Amb24483600 [1,1,0,0,0,0|2,0,0]=4 2521 B12R1.21 CC(=O)CCc1ccc(Br)c[n]1 Amb25729593 [1,1,0,0,0,0|2,0,0]=4 2522 B12R1.21 CC(=O)CCc1ccc(Cl)[n]c1 Amb25725533 [1,1,0,0,0,0|2,0,0]=4 2523 B12R1.21 CC(=O)CNc1ccc(Cl)cc1 Amb24729554 [1,1,0,0,0,0|2,0,0]=4 2524 B12R1.21 CC(=O)COc1ccc(O)cc1 Amb18646453 [1,1,0,0,0,0|2,0,0]=4 2525 B12R1.21 CC(=O)COc1ccc(cc1)Br Amb17601394 [1,1,0,0,0,0|2,0,0]=4 2526 B12R1.21 CC(=O)COc1ccc(cc1)Cl Amb1094739 [1,1,0,0,0,0|2,0,0]=4 2527 B12R1.21 CC(=O)COc1ccc(cc1)N Amb17110083 [1,1,0,0,0,0|2,0,0]=4 2528 B12R1.21 CC(=O)NCC=1C=CC(=O)NC1 Amb25232374 [1,1,0,0,0,0|2,0,0]=4 2529 B12R1.21 CC(=O)NCc1ccc(Br)cc1 Amb20622638 [1,1,0,0,0,0|1,0,0]=3 2530 B12R1.21 CC(=O)NCc1ccc(cc1)O Amb10549495 [1,1,0,0,0,0|1,0,0]=3 2531 B12R1.21 CC(=O)NCc1ccc(cn1)N Amb13890645 [1,1,0,0,0,0|2,0,0]=4 2532 B12R1.21 CC(=O)NCc1ccc(nc1)Cl Amb10608428 [1,1,0,0,0,0|2,0,0]=4 2533 B12R1.21 CC(=O)NNc1ccc(N)cc1 Amb18646317 [1,1,0,0,0,0|2,0,0]=4 2534 B12R1.21 CC(=O)NNc1ccc(cc1)Br Amb1040272 [1,1,0,0,0,0|2,0,0]=4 2535 B12R1.21 CC(=O)NNc1ccc(cc1)C Amb1040273 [1,1,0,0,0,0|2,0,0]=4 2536 B12R1.21 CC(=O)NOc1ccc(N)cc1 Amb25742910 [1,1,0,0,0,0|2,0,0]=4 2537 B12R1.21 CC(=O)OCC=1C=NC(=O)CC1 Amb24425470 [1,1,0,0,0,0|1,0,1]=4 2538 B12R1.21 CC(=O)OCc1c[n]c(Cl)c[n]1 Amb25296915 [1,1,0,0,0,0|2,0,0]=4 2539 B12R1.21 CC(=O)OCc1c[n]c(N)c[n]1 Amb25808752 [1,1,0,0,0,0|2,0,0]=4 2540 B12R1.21 CC(=O)OCc1ccc(Cl)[n][n]1 Amb24596102 [1,1,0,0,0,0|2,0,0]=4 2541 B12R1.21 CC(=O)OCc1ccc(Cl)c[n]1 Amb25220252 [1,1,0,0,0,0|1,0,0]=3 2542 B12R1.21 CC(=O)OCc1ccc(I)cc1 Amb25687671 [1,1,0,0,0,0|0,0,0]=2 2543 B12R1.21 CC(=O)OCc1ccc(N)[n]c1 Amb24689359 [1,1,0,0,0,0|1,0,0]=3 2544 B12R1.21 CC(=O)OCc1ccc(N)c[n]1 Amb20248322 [1,1,0,0,0,0|1,0,0]=3 2545 B12R1.21 CC(=O)OCc1ccc(O)c[n]1 Amb18646673 [1,1,0,0,0,0|1,0,0]=3 2546 B12R1.21 CC(=O)OCc1ccc(O)cc1 Amb18646455 [1,1,0,0,0,0|0,0,0]=2 2547 B12R1.21 CC(=O)OCc1ccc(cc1)Cl Amb2421366 [1,1,0,0,0,0|0,0,0]=2 2548 B12R1.21 CC(=O)ONc1ccc(Cl)c[n]1 Amb20247510 [1,1,0,0,0,0|2,0,0]=4 2549 B12R1.21 CC(=O)ONc1ccc(O)cc1 Amb24497023 [1,1,0,0,0,0|1,0,0]=3 2550 B12R1.21 CC(=O)OOc1ccc(N)cc1 Amb22233285 [1,1,0,0,0,0|1,0,0]=3 2551 B12R1.21 CC(=O)O[Hg]c1ccc(N)cc1 Amb22351859 [1,1,0,0,0,0|1,0,0]=3 2552 B12R1.21 CC(=O)SCc1ccc(Br)cc1 Amb22338619 [1,1,0,0,0,0|0,1,0]=3 2553 B12R1.21 CC(=O)SCc1ccc(Cl)[n]c1 Amb25223594 [1,1,0,0,0,0|1,1,0]=4 2554 B12R1.21 CC(=O)SCc1ccc(N)[n]c1 Amb24388564 [1,1,0,0,0,0|1,1,0]=4 2555 B12R1.21 CC(=O)SSc1ccc(O)cc1 Amb25373390 [1,1,0,0,0,0|1,1,0]=4 2556 B12R1.21 CC(=O)\C=C\c1ccc(I)cc1 Amb25736694 [1,1,0,0,0,0|1,0,1]=4 2557 B12R1.21 CC(=O)\C=C\c1ccc(N)cc1 Amb23247750 [1,1,0,0,0,0|1,0,1]=4 2558 B12R1.21 CC(=O)\N=C/c1ccc(Cl)cc1 Amb24073008 [1,1,0,0,0,0|1,0,1]=4 2559 B12R1.21 CC(=O)\N=C\c1ccc(Cl)cc1 Amb24404018 [1,1,0,0,0,0|1,0,1]=4 2560 B12R1.21 CC(=O)\N=C\c1ccc(O)cc1 Amb25059643 [1,1,0,0,0,0|1,0,1]=4 2561 B12R1.21 CC(=S)NCc1ccc(Cl)cc1 Amb25858106 [1,1,0,0,0,0|1,1,0]=4 2562 B12R1.21 CC(=S)NCc1ccc(F)cc1 Amb25139700 [1,1,0,0,0,0|1,1,0]=4 2563 B12R1.21 CC(C)OCc1ccc(Br)cc1 Amb19301962 [1,1,0,0,0,0|1,0,1]=4 2564 B12R1.21 CC(C)OCc1ccc(Cl)cc1 Amb24514322 [1,1,0,0,0,0|1,0,1]=4 2565 B12R1.21 CC(C)OCc1ccc(I)cc1 Amb25695675 [1,1,0,0,0,0|1,0,1]=4 2566 B12R1.21 CS(=O)CCc1ccc(N)cc1 Amb18974603 [1,1,0,0,0,0|2,0,0]=4 2567 B12R1.21 CS(=O)CCc1ccc(cc1)C Amb16185126 [1,1,0,0,0,0|2,0,0]=4 2568 B12R1.21 CS(=O)NCc1ccc(Br)cc1 Amb25177255 [1,1,0,0,0,0|2,0,0]=4 2569 B12R1.21 CS(=O)NCc1ccc(N)cc1 Amb24582929 [1,1,0,0,0,0|2,0,0]=4 2570 B12R1.21 Cc1c[n]c(COC(C)=O)c[n]1 Amb25065213 [1,1,0,0,0,0|2,0,0]=4 2571 B12R1.21 Cc1ccc(CCC(C)=O)c[n]1 Amb25197877 [1,1,0,0,0,0|2,0,0]=4 2572 B12R1.21 Cc1ccc(CNC(C)=N)cc1 Amb24443445 [1,1,0,0,0,0|2,0,0]=4 2573 B12R1.21 Cc1ccc(CNC(C)=O)[n]c1 Amb25799544 [1,1,0,0,0,0|2,0,0]=4 2574 B12R1.21 Cc1ccc(CNC(C)=S)cc1 Amb25725010 [1,1,0,0,0,0|1,1,0]=4 2575 B12R1.21 Cc1ccc(COC(C)=O)[n]c1 Amb24086564 [1,1,0,0,0,0|1,0,0]=3 2576 B12R1.21 Cc1ccc(COC(C)=O)c[n]1 Amb22750507 [1,1,0,0,0,0|1,0,0]=3 2577 B12R1.21 Cc1ccc(\C=C/C(C)=O)cc1 Amb24422503 [1,1,0,0,0,0|1,0,1]=4 2578 B12R1.21 Cc1ccc(cc1)NCC(C)=O Amb25068510 [1,1,0,0,0,0|2,0,0]=4 2579 B12R1.21 Cc1ccc(cc1)NOC(C)=O Amb24073550 [1,1,0,0,0,0|1,0,0]=3 2580 B12R1.21 Cc1ccc(cc1)\N=C\C(C)=O Amb25334923 [1,1,0,0,0,0|2,0,0]=4 2581 B12R1.21 ClC(=O)CCc1ccc(cc1)C Amb17142993 [1,1,0,0,0,0|2,0,0]=4 2582 B12R1.21 ClC(=O)CCc1ccc(cc1)Cl Amb17143273 [1,1,0,0,0,0|2,0,0]=4 2583 B12R1.21 NC(=O)CCc1ccc(cc1)Br Amb17407065 [1,1,0,0,0,0|2,0,0]=4 2584 B12R1.21 NC(=O)CCc1ccc(cc1)Cl Amb17142998 [1,1,0,0,0,0|2,0,0]=4 2585 B12R1.21 NC(=O)NCc1ccc(cc1)Br Amb1139295 [1,1,0,0,0,0|2,0,0]=4 2586 B12R1.21 NC(=O)NCc1ccc(cc1)C Amb1134976 [1,1,0,0,0,0|2,0,0]=4 2587 B12R1.21 NC(=O)NCc1ccc(cc1)Cl Amb2435054 [1,1,0,0,0,0|2,0,0]=4 2588 B12R1.21 NC(=O)NCc1ccc(cc1)F Amb1128118 [1,1,0,0,0,0|2,0,0]=4 2589 B12R1.21 NC(=O)OCc1ccc(Cl)cc1 Amb25737813 [1,1,0,0,0,0|1,0,0]=3 2590 B12R1.21 O=C(Cl)CCc1ccc(F)cc1 Amb23440824 [1,1,0,0,0,0|2,0,0]=4 2591 B12R1.21 O=C(Cl)OCc1ccc(Br)cc1 Amb22059767 [1,1,0,0,0,0|1,0,0]=3 2592 B12R1.21 O=C(Cl)OCc1ccc(F)cc1 Amb24471576 [1,1,0,0,0,0|1,0,0]=3 2593 B12R1.21 OC(=O)CCc1ccc(cc1)Br Amb1220330 [1,1,0,0,0,0|2,0,0]=4 2594 B12R1.21 OC(=O)CCc1ccc(cc1)C Amb1225383 [1,1,0,0,0,0|2,0,0]=4 2595 B12R1.21 OC(=O)CCc1ccc(cc1)Cl Amb1093991 [1,1,0,0,0,0|2,0,0]=4 2596 B12R1.21 OC(=O)CCc1ccc(cc1)F Amb1214879 [1,1,0,0,0,0|2,0,0]=4 2597 B12R1.27 BrCC(=O)NCc1ccccc1 Amb2221074 [1,1,0,0,0,0|1,0,0]=3 2598 B12R1.27 BrCC(=O)NCc1ccccn1 Amb15701346 [1,1,0,0,0,0|2,0,0]=4 2599 B12R1.27 BrCC(=O)NCc1cccnc1 Amb17332390 [1,1,0,0,0,0|2,0,0]=4 2600 B12R1.27 BrCC(=O)NCc1ccncc1 Amb17328296 [1,1,0,0,0,0|2,0,0]=4 2601 B12R1.27 BrCC(=O)\C=C\c1ccccc1 Amb17596167 [1,1,0,0,0,0|1,0,1]=4 2602 B12R1.27 C#CC(=O)CCc1ccccc1 Amb24483845 [1,1,0,0,0,0|1,0,1]=4 2603 B12R1.27 C#CC(=O)NCc1ccccc1 Amb10572437 [1,1,0,0,0,0|1,0,1]=4 2604 B12R1.27 C#CC(=O)OCc1ccccc1 Amb24057136 [1,1,0,0,0,0|0,0,1]=3 2605 B12R1.27 C=C(C=O)ONc1ccccc1 Amb24676829 [1,1,0,0,0,0|1,0,1]=4 2606 B12R1.27 C=CC(=O)CCc1ccccc1 Amb10562280 [1,1,0,0,0,0|1,0,1]=4 2607 B12R1.27 C=CC(=O)NCc1ccccc1 Amb1196142 [1,1,0,0,0,0|1,0,1]=4 2608 B12R1.27 C=CC(=O)OCc1ccccc1 Amb10807780 [1,1,0,0,0,0|0,0,1]=3 2609 B12R1.27 CC(C#C)OCc1ccccc1 Amb25208112 [1,1,0,0,0,0|1,0,1]=4 2610 B12R1.27 CC(C#N)OCc1ccccc1 Amb18797967 [1,1,0,0,0,0|1,0,1]=4 2611 B12R1.27 CC(C=O)=C=Cc1ccccc1 Amb24452570 [1,1,0,0,0,0|1,0,1]=4 2612 B12R1.27 CC(C=O)OCc1ccccc1 Amb18646071 [1,1,0,0,0,0|0,0,1]=3 2613 B12R1.27 CC(C=O)ONc1ccccc1 Amb25239411 [1,1,0,0,0,0|1,0,1]=4 2614 B12R1.27 CC(CCl)OCc1ccccc1 Amb25257973 [1,1,0,0,0,0|1,0,1]=4 2615 B12R1.27 CC(CN)OCc1ccccc1 Amb18312421 [1,1,0,0,0,0|1,0,1]=4 2616 B12R1.27 CC(CO)OCc1ccccc1 Amb25667474 [1,1,0,0,0,0|0,0,2]=4 2617 B12R1.27 CCC(=N)NCc1ccccc1 Amb24388885 [1,1,0,0,0,0|2,0,0]=4 2618 B12R1.27 CCC(=O)C#Cc1ccccc1 Amb10562235 [1,1,0,0,0,0|1,0,1]=4 2619 B12R1.27 CCC(=O)NCc1ccccn1 Amb17736593 [1,1,0,0,0,0|2,0,0]=4 2620 B12R1.27 CCC(=O)NCc1ccncc1 Amb17798077 [1,1,0,0,0,0|2,0,0]=4 2621 B12R1.27 CCC(=O)O[Hg]c1ccccc1 Amb22359615 [1,1,0,0,0,0|1,0,0]=3 2622 B12R1.27 CCC(=O)\C=C/c1ccccc1 Amb25271028 [1,1,0,0,0,0|1,0,1]=4 2623 B12R1.27 CCC(=O)\C=C\c1ccccc1 Amb10565332 [1,1,0,0,0,0|1,0,1]=4 2624 B12R1.27 CCC(=O)\N=N\c1ccccc1 Amb24644165 [1,1,0,0,0,0|2,0,0]=4 2625 B12R1.27 CCC(O)OCc1ccccc1 Amb25793622 [1,1,0,0,0,0|0,0,2]=4 2626 B12R1.27 CCS(=O)NCc1ccccc1 Amb25359778 [1,1,0,0,0,0|2,0,0]=4 2627 B12R1.27 CNC(=N)NCc1ccccc1 Amb18798221 [1,1,0,0,0,0|2,0,0]=4 2628 B12R1.27 CNC(=O)C#Cc1ccccc1 Amb2106613 [1,1,0,0,0,0|1,0,1]=4 2629 B12R1.27 CNC(=O)NCc1ccccc1 Amb2132763 [1,1,0,0,0,0|1,0,0]=3 2630 B12R1.27 CNC(=O)NCc1ccccn1 Amb2132790 [1,1,0,0,0,0|2,0,0]=4 2631 B12R1.27 CNC(=O)NCc1cccnc1 Amb2132774 [1,1,0,0,0,0|2,0,0]=4 2632 B12R1.27 CNC(=O)NCc1ccncc1 Amb2132791 [1,1,0,0,0,0|2,0,0]=4 2633 B12R1.27 CNC(=O)NNc1ccccc1 Amb25751263 [1,1,0,0,0,0|2,0,0]=4 2634 B12R1.27 CNC(=O)OCc1ccc[n]c1 Amb24532586 [1,1,0,0,0,0|1,0,0]=3 2635 B12R1.27 CNC(=O)SCc1cccc[n]1 Amb25054647 [1,1,0,0,0,0|1,1,0]=4 2636 B12R1.27 CNC(=O)\N=C\c1ccccc1 Amb24497304 [1,1,0,0,0,0|1,0,1]=4 2637 B12R1.27 CNC(=O)\N=N\c1ccccc1 Amb25313077 [1,1,0,0,0,0|2,0,0]=4 2638 B12R1.27 COC(=O)CCc1ccncc1 Amb10604945 [1,1,0,0,0,0|2,0,0]=4 2639 B12R1.27 COC(=O)NCc1ccccn1 Amb17736865 [1,1,0,0,0,0|2,0,0]=4 2640 B12R1.27 COC(=O)NCc1cccnc1 Amb17790231 [1,1,0,0,0,0|2,0,0]=4 2641 B12R1.27 COC(=O)OCc1ccccc1 Amb25034726 [1,1,0,0,0,0|0,0,0]=2 2642 B12R1.27 COC(=O)\N=N\c1ccccc1 Amb25836861 [1,1,0,0,0,0|2,0,0]=4 2643 B12R1.27 CSC(=N)NCc1ccccc1 Amb25760156 [1,1,0,0,0,0|2,0,0]=4 2644 B12R1.27 CSC(=O)NCc1ccccc1 Amb24495681 [1,1,0,0,0,0|1,0,0]=3 2645 B12R1.27 C[C@@H](C=O)ONc1ccccc1 Amb25701904 [1,1,0,0,0,0|1,0,1]=4 2646 B12R1.27 C[C@@H](CCl)OCc1ccccc1 Amb25320908 [1,1,0,0,0,0|1,0,1]=4 2647 B12R1.27 C[C@H](C=O)OCc1ccccc1 Amb25326165 [1,1,0,0,0,0|0,0,1]=3 2648 B12R1.27 C[C@H](CO)OCc1ccccc1 Amb25694316 [1,1,0,0,0,0|0,0,2]=4 2649 B12R1.27 C\C(\C=O)=C/Cc1ccccc1 Amb18645371 [1,1,0,0,0,0|1,0,0]=3 2650 B12R1.27 C\C(\C=O)=C/Nc1ccccc1 Amb18645511 [1,1,0,0,0,0|2,0,0]=4 2651 B12R1.27 C\C(\C=O)=C\Cc1ccccc1 Amb24418390 [1,1,0,0,0,0|1,0,0]=3 2652 B12R1.27 C\C(\C=O)=C\Sc1ccccc1 Amb25277189 [1,1,0,0,0,0|2,0,0]=4 2653 B12R1.27 C\C(\C=O)=N/Nc1ccccc1 Amb18645673 [1,1,0,0,0,0|2,0,0]=4 2654 B12R1.27 C\C(\CCc1ccccc1)=N\O Amb24638706 [1,1,0,0,0,0|1,0,1]=4 2655 B12R1.27 C\C(\CCl)=C\Cc1ccccc1 Amb25279568 [1,1,0,0,0,0|2,0,0]=4 2656 B12R1.27 C\C(\CN)=C\Cc1ccccc1 Amb24438874 [1,1,0,0,0,0|2,0,0]=4 2657 B12R1.27 C\C(\NCc1ccccc1)=N\O Amb25083251 [1,1,0,0,0,0|1,0,1]=4 2658 B12R1.27 C\N=C(\SCc1ccccc1)/N Amb11238902 [1,1,0,0,0,0|1,1,0]=4 2659 B12R1.27 ClCC(=O)CCc1ccccc1 Amb17139043 [1,1,0,0,0,0|1,0,0]=3 2660 B12R1.27 ClCC(=O)COc1ccccc1 Amb17139095 [1,1,0,0,0,0|2,0,0]=4 2661 B12R1.27 ClCC(=O)NCc1ccccn1 Amb1651007 [1,1,0,0,0,0|2,0,0]=4 2662 B12R1.27 ClCC(=O)\C=C\c1ccccc1 Amb17594640 [1,1,0,0,0,0|1,0,1]=4 2663 B12R1.27 ClCC(Cl)OCc1ccccc1 Amb25139547 [1,1,0,0,0,0|1,0,1]=4 2664 B12R1.27 Cl\C(\CCl)=C/Cc1ccccc1 Amb25803609 [1,1,0,0,0,0|2,0,0]=4 2665 B12R1.27 Cl\C(\CCl)=N/Cc1ccccc1 Amb24540801 [1,1,0,0,0,0|2,0,0]=4 2666 B12R1.27 N#CC(=O)CCc1ccccc1 Amb25143496 [1,1,0,0,0,0|1,0,1]=4 2667 B12R1.27 N=C(CF)NCc1ccccc1 Amb24392158 [1,1,0,0,0,0|2,0,0]=4 2668 B12R1.27 N=C(CS)NCc1ccccc1 Amb24664256 [1,1,0,0,0,0|2,0,0]=4 2669 B12R1.27 NCC(=O)CCc1ccccc1 Amb18563587 [1,1,0,0,0,0|1,0,0]=3 2670 B12R1.27 NCC(=O)NCc1c[n]ccc1 Amb21959050 [1,1,0,0,0,0|2,0,0]=4 2671 B12R1.27 NCC(=O)NCc1c[n]ccc1 Amb21987915 [1,1,0,0,0,0|2,0,0]=4 2672 B12R1.27 NCC(=O)NCc1cccc[n]1 Amb21959064 [1,1,0,0,0,0|2,0,0]=4 2673 B12R1.27 NCC(=O)NCc1ccncc1 Amb13951584 [1,1,0,0,0,0|2,0,0]=4 2674 B12R1.27 NCC(=O)NNc1ccccc1 Amb18646327 [1,1,0,0,0,0|2,0,0]=4 2675 B12R1.27 NCC(=O)OCc1ccccc1 Amb1207685 [1,1,0,0,0,0|0,0,0]=2 2676 B12R1.27 NCC(=O)OCc1ccccc1 Amb1808695 [1,1,0,0,0,0|0,0,0]=2 2677 B12R1.27 NCC(=O)OCc1ccccc1 Amb2228429 [1,1,0,0,0,0|0,0,0]=2 2678 B12R1.27 NCC(=O)\C=C\c1ccccc1 Amb18908593 [1,1,0,0,0,0|1,0,1]=4 2679 B12R1.27 NC\C(\F)=C\Cc1ccccc1 Amb24743578 [1,1,0,0,0,0|2,0,0]=4 2680 B12R1.27 NNC(=O)CCc1ccccc1 Amb1130599 [1,1,0,0,0,0|2,0,0]=4 2681 B12R1.27 NNC(=O)SCc1ccccc1 Amb24423487 [1,1,0,0,0,0|1,1,0]=4 2682 B12R1.27 O=C(C=O)OCc1ccccc1 Amb18645967 [1,1,0,0,0,0|0,0,1]=3 2683 B12R1.27 O=C(CBr)CCc1ccccc1 Amb20171375 [1,1,0,0,0,0|1,0,0]=3 2684 B12R1.27 O=C(CBr)COc1ccccc1 Amb20668077 [1,1,0,0,0,0|2,0,0]=4 2685 B12R1.27 O=C(CBr)NCc1cccc[n]1 Amb22587297 [1,1,0,0,0,0|2,0,0]=4 2686 B12R1.27 O=C(CCl)NCc1ccc[n]c1 Amb19373274 [1,1,0,0,0,0|2,0,0]=4 2687 B12R1.27 O=C(CCl)NNc1ccccc1 Amb22411427 [1,1,0,0,0,0|2,0,0]=4 2688 B12R1.27 O=C(CF)C#Cc1ccccc1 Amb25373340 [1,1,0,0,0,0|1,0,1]=4 2689 B12R1.27 O=C(CF)\C=C\c1ccccc1 Amb24572849 [1,1,0,0,0,0|1,0,1]=4 2690 B12R1.27 O=C(CI)NCc1ccccc1 Amb24084424 [1,1,0,0,0,0|1,0,0]=3 2691 B12R1.27 O=C(CI)OCc1ccccc1 Amb25144488 [1,1,0,0,0,0|0,0,0]=2 2692 B12R1.27 O=C(CS)NCc1cc[n]cc1 Amb24483850 [1,1,0,0,0,0|2,0,0]=4 2693 B12R1.27 O=C(CS)NCc1cccc[n]1 Amb25669641 [1,1,0,0,0,0|2,0,0]=4 2694 B12R1.27 O=C(NCl)NCc1ccccc1 Amb22735087 [1,1,0,0,0,0|2,0,0]=4 2695 B12R1.27 O=C(NCl)OCc1ccccc1 Amb21948731 [1,1,0,0,0,0|1,0,0]=3 2696 B12R1.27 O=C[C@@H](OCc1ccccc1)C Amb17609288 [1,1,0,0,0,0|0,0,1]=3 2697 B12R1.27 O=C\C(\F)=C/Cc1ccccc1 Amb24540284 [1,1,0,0,0,0|2,0,0]=4 2698 B12R1.27 OCC(=O)C#Cc1ccccc1 Amb25094460 [1,1,0,0,0,0|1,0,1]=4 2699 B12R1.27 OCC(=O)CCc1cc[n]cc1 Amb18563675 [1,1,0,0,0,0|2,0,0]=4 2700 B12R1.27 OCC(=O)CCc1ccc[n]c1 Amb18563674 [1,1,0,0,0,0|2,0,0]=4 2701 B12R1.27 OCC(=O)CCc1cccc[n]1 Amb18563673 [1,1,0,0,0,0|2,0,0]=4 2702 B12R1.27 OCC(=O)CCc1ccccc1 Amb18563609 [1,1,0,0,0,0|1,0,0]=3 2703 B12R1.27 OCC(=O)COc1ccccc1 Amb18563713 [1,1,0,0,0,0|2,0,0]=4 2704 B12R1.27 OCC(=O)NCc1ccccc1 Amb1111331 [1,1,0,0,0,0|1,0,0]=3 2705 B12R1.27 OCC(=O)NCc1ccccn1 Amb17334667 [1,1,0,0,0,0|2,0,0]=4 2706 B12R1.27 OCC(=O)NCc1cccnc1 Amb17334668 [1,1,0,0,0,0|2,0,0]=4 2707 B12R1.27 OCC(=O)NCc1ccncc1 Amb17334669 [1,1,0,0,0,0|2,0,0]=4 2708 B12R1.27 OCC(=O)\C=C\c1ccccc1 Amb25142729 [1,1,0,0,0,0|1,0,1]=4 2709 B12R1.27 OC[C@@H](OCc1ccccc1)C Amb17609287 [1,1,0,0,0,0|0,0,2]=4 2710 B12R1.27 OC\C(=C/Cc1ccccc1)\C Amb17594048 [1,1,0,0,0,0|1,0,1]=4 2711 B12R1.27 OC\C(\F)=C\Cc1ccccc1 Amb24661184 [1,1,0,0,0,0|2,0,0]=4 2712 B12R1.27 ONC(=O)OCc1ccccc1 Amb2445312 [1,1,0,0,0,0|1,0,0]=3 2713 B12R1.27 [NH4]OP(=O)OCc1ccccc1 Amb22346178 [1,1,0,0,0,0|2,0,0]=4 2714 B12R1.43 BrC(C(=O)C)Cc1ccccc1 Amb17507835 [1,1,0,0,0,0|1,0,0]=3 2715 B12R1.43 BrC(C(=O)C)Cc1ccncc1 Amb17507815 [1,1,0,0,0,0|2,0,0]=4 2716 B12R1.43 Br[C@@H](C(=O)O)Cc1ccccc1 Amb17610062 [1,1,0,0,0,0|2,0,0]=4 2717 B12R1.43 Br[C@H](C(=O)O)Cc1ccccc1 Amb17610063 [1,1,0,0,0,0|2,0,0]=4 2718 B12R1.43 Br\C(=C/c1ccccc1)\C(=O)C Amb17596166 [1,1,0,0,0,0|1,0,1]=4 2719 B12R1.43 C=C(Cc1ccccc1)C(N)=O Amb24634331 [1,1,0,0,0,0|2,0,0]=4 2720 B12R1.43 CC(=C)C(Cl)Cc1ccccc1 Amb24635687 [1,1,0,0,0,0|2,0,0]=4 2721 B12R1.43 CC(=C)[C@@H](O)Cc1ccccc1 Amb25077949 [1,1,0,0,0,0|2,0,0]=4 2722 B12R1.43 CC(=O)C(=C)Oc1ccccc1 Amb25714243 [1,1,0,0,0,0|2,0,0]=4 2723 B12R1.43 CC(=O)C(=O)Cc1c[n]ccc1 Amb24556780 [1,1,0,0,0,0|2,0,0]=4 2724 B12R1.43 CC(=O)C(=O)Cc1cc[n]cc1 Amb24555440 [1,1,0,0,0,0|2,0,0]=4 2725 B12R1.43 CC(=O)C(=O)Cc1ccccc1 Amb23603619 [1,1,0,0,0,0|1,0,0]=3 2726 B12R1.43 CC(=O)C(C)Cc1cc[n]cc1 Amb25303664 [1,1,0,0,0,0|2,0,0]=4 2727 B12R1.43 CC(=O)C(Cc1ccccn1)Br Amb17507813 [1,1,0,0,0,0|2,0,0]=4 2728 B12R1.43 CC(=O)C(Cc1ccccn1)Cl Amb17507767 [1,1,0,0,0,0|2,0,0]=4 2729 B12R1.43 CC(=O)C(Cc1cccnc1)Br Amb17507814 [1,1,0,0,0,0|2,0,0]=4 2730 B12R1.43 CC(=O)C(Cc1cccnc1)Cl Amb17507768 [1,1,0,0,0,0|2,0,0]=4 2731 B12R1.43 CC(=O)C(O)Cc1ccccc1 Amb25340966 [1,1,0,0,0,0|1,0,0]=3 2732 B12R1.43 CC(=O)N(C)Cc1cc[n]cc1 Amb25152576 [1,1,0,0,0,0|2,0,0]=4 2733 B12R1.43 CC(=O)N(C)Nc1ccccc1 Amb22359748 [1,1,0,0,0,0|2,0,0]=4 2734 B12R1.43 CC(=O)N(O)Cc1ccccc1 Amb25297453 [1,1,0,0,0,0|1,0,0]=3 2735 B12R1.43 CC(=O)[C@@H](C)Cc1cc[n]cc1 Amb25358977 [1,1,0,0,0,0|2,0,0]=4 2736 B12R1.43 CC(=O)[C@@H](C)Cc1ccccc1 Amb24356281 [1,1,0,0,0,0|1,0,0]=3 2737 B12R1.43 CC(=O)[C@@H](C)Oc1ccccc1 Amb25833650 [1,1,0,0,0,0|2,0,0]=4 2738 B12R1.43 CC(=O)[C@@H](Cl)Cc1ccccc1 Amb24595784 [1,1,0,0,0,0|1,0,0]=3 2739 B12R1.43 CC(=O)[C@@H](O)Cc1ccccc1 Amb24722888 [1,1,0,0,0,0|1,0,0]=3 2740 B12R1.43 CC(=O)[C@H](C)Cc1cc[n]cc1 Amb24380859 [1,1,0,0,0,0|2,0,0]=4 2741 B12R1.43 CC(=O)[C@H](C)Cc1ccccc1 Amb25233687 [1,1,0,0,0,0|1,0,0]=3 2742 B12R1.43 CC(=O)\C(\O)=C\c1ccccc1 Amb24456527 [1,1,0,0,0,0|1,0,1]=4 2743 B12R1.43 CC(=S)N(C)Cc1ccccc1 Amb24073637 [1,1,0,0,0,0|1,1,0]=4 2744 B12R1.43 CC(C(=O)C)Cc1ccccc1 Amb17232407 [1,1,0,0,0,0|1,0,0]=3 2745 B12R1.43 CC(C(=O)C)Oc1ccccc1 Amb2439364 [1,1,0,0,0,0|2,0,0]=4 2746 B12R1.43 CN(C(=O)Cl)Cc1ccccc1 Amb17563090 [1,1,0,0,0,0|2,0,0]=4 2747 B12R1.43 C[C@@H](C(=O)O)Cc1ccccc1 Amb10844541 [1,1,0,0,0,0|2,0,0]=4 2748 B12R1.43 C[C@@H](Cc1ccccc1)C(N)=O Amb24651128 [1,1,0,0,0,0|2,0,0]=4 2749 B12R1.43 C[C@H](C(=O)O)Cc1ccccc1 Amb10844540 [1,1,0,0,0,0|2,0,0]=4 2750 B12R1.43 C\C(=C/c1ccccc1)\C(=O)C Amb17594004 [1,1,0,0,0,0|1,0,1]=4 2751 B12R1.43 C\C(=N/c1ccccc1)\C(C)=O Amb24537849 [1,1,0,0,0,0|2,0,0]=4 2752 B12R1.43 ClC(C(=O)C)Cc1ccccc1 Amb17204329 [1,1,0,0,0,0|1,0,0]=3 2753 B12R1.43 ClC(C(=O)C)Cc1ccncc1 Amb17507769 [1,1,0,0,0,0|2,0,0]=4 2754 B12R1.43 ClC(C(=O)Cl)Cc1ccccc1 Amb17204400 [1,1,0,0,0,0|2,0,0]=4 2755 B12R1.43 ClC(C(=O)N)Cc1ccccc1 Amb17204334 [1,1,0,0,0,0|2,0,0]=4 2756 B12R1.43 ClC(C(=O)O)Cc1ccccc1 Amb17204339 [1,1,0,0,0,0|2,0,0]=4 2757 B12R1.43 NC(=O)C(Br)Cc1ccccc1 Amb23533327 [1,1,0,0,0,0|2,0,0]=4 2758 B12R1.43 NC(=O)C(F)Cc1ccccc1 Amb24343162 [1,1,0,0,0,0|2,0,0]=4 2759 B12R1.43 NC(=O)C(N)Cc1ccccc1 Amb20240621 [1,1,0,0,0,0|2,0,0]=4 2760 B12R1.43 NC(=O)C(O)Cc1ccccc1 Amb18800896 [1,1,0,0,0,0|2,0,0]=4 2761 B12R1.43 NC(=O)[C@@H](Cl)Cc1ccccc1 Amb25034612 [1,1,0,0,0,0|2,0,0]=4 2762 B12R1.43 NC(=O)[C@H](O)Cc1ccccc1 Amb25359872 [1,1,0,0,0,0|2,0,0]=4 2763 B12R1.43 NC(C(=O)C)Cc1ccccc1 Amb1099237 [1,1,0,0,0,0|1,0,0]=3 2764 B12R1.43 NC(C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22367486 [1,1,0,0,0,0|2,0,0]=4 2765 B12R1.43 NC(Cc1ccccc1)C(=O)Cl Amb24620480 [1,1,0,0,0,0|2,0,0]=4 2766 B12R1.43 NC(Cc1ccccc1)C(=O)S Amb25760658 [1,1,0,0,0,0|2,0,0]=4 2767 B12R1.43 NC(Cc1ccccc1)C(O)=O Amb19958284 [1,1,0,0,0,0|2,0,0]=4 2768 B12R1.43 NC(Cc1ccccc1)[13C](O)=O Amb22363196 [1,1,0,0,0,0|2,0,0]=4 2769 B12R1.43 NC([13CH2]c1ccccc1)C(O)=O Amb22363309 [1,1,0,0,0,0|2,0,0]=4 2770 B12R1.43 N[13C@@H](Cc1ccccc1)C(O)=O Amb22351319 [1,1,0,0,0,0|2,0,0]=4 2771 B12R1.43 N[13CH](Cc1ccccc1)C(O)=O Amb22367538 [1,1,0,0,0,0|2,0,0]=4 2772 B12R1.43 N[14CH]([14CH2]c1ccccc1)[14C](O)=O Amb22352760 [1,1,0,0,0,0|2,0,0]=4 2773 B12R1.43 N[C@@H](C(=O)N)Cc1ccccc1 Amb16183950 [1,1,0,0,0,0|2,0,0]=4 2774 B12R1.43 N[C@@H](C[13c]1[13cH][13cH][13cH][13cH][13cH]1)C(O)=O Amb22353689 [1,1,0,0,0,0|2,0,0]=4 2775 B12R1.43 N[C@@H](Cc1ccccc1)C(O)=O Amb22351110 [1,1,0,0,0,0|2,0,0]=4 2776 B12R1.43 N[C@H](Cc1ccccc1)C(=O)Cl Amb25092703 [1,1,0,0,0,0|2,0,0]=4 2777 B12R1.43 O=C(C(=O)C)Nc1ccccc1 Amb2383839 [1,1,0,0,0,0|2,0,0]=4 2778 B12R1.43 O=C(Cl)C(Br)Cc1ccccc1 Amb21961005 [1,1,0,0,0,0|2,0,0]=4 2779 B12R1.43 OC(=O)C(Cc1ccccc1)Br Amb16210937 [1,1,0,0,0,0|2,0,0]=4 2780 B12R1.43 OC(=O)C(S)Cc1ccccc1 Amb18289035 [1,1,0,0,0,0|2,0,0]=4 2781 B12R1.43 OC(=O)[C@@H](Cl)Cc1ccccc1 Amb24707843 [1,1,0,0,0,0|2,0,0]=4 2782 B12R1.43 OC(=O)[C@@H](S)Cc1ccccc1 Amb25124079 [1,1,0,0,0,0|2,0,0]=4 2783 B12R1.43 OC(=O)[C@H](Cl)Cc1ccccc1 Amb22225171 [1,1,0,0,0,0|2,0,0]=4 2784 B12R1.43 OC(=O)[C@H](F)Cc1ccccc1 Amb25061394 [1,1,0,0,0,0|2,0,0]=4 2785 B12R1.43 [15NH2]C(Cc1ccccc1)C(O)=O Amb22338047 [1,1,0,0,0,0|2,0,0]=4 2786 B12R1.43 [O-]C(=O)C(=O)Cc1ccccc1 Amb19884048 [1,1,0,0,0,0|2,0,0]=4 2787 B12R1.125 CC(=N)NCc1ccccc1Br Amb24476278 [1,1,0,0,0,0|2,0,0]=4 2788 B12R1.125 CC(=N)NCc1ccccc1F Amb25148439 [1,1,0,0,0,0|2,0,0]=4 2789 B12R1.125 CC(=O)C#Cc1ccccc1F Amb25767750 [1,1,0,0,0,0|1,0,1]=4 2790 B12R1.125 CC(=O)C=Cc1ccccc1O Amb24065680 [1,1,0,0,0,0|1,0,1]=4 2791 B12R1.125 CC(=O)CCC1=CC=CNC1=O Amb24404877 [1,1,0,0,0,0|2,0,0]=4 2792 B12R1.125 CC(=O)CCc1[n]cccc1Br Amb25703295 [1,1,0,0,0,0|2,0,0]=4 2793 B12R1.125 CC(=O)CCc1[n]cccc1O Amb24537666 [1,1,0,0,0,0|2,0,0]=4 2794 B12R1.125 CC(=O)CCc1c[n]ccc1Cl Amb25044219 [1,1,0,0,0,0|2,0,0]=4 2795 B12R1.125 CC(=O)CCc1cc[n]cc1Cl Amb24678607 [1,1,0,0,0,0|2,0,0]=4 2796 B12R1.125 CC(=O)CCc1ccc[n]c1Cl Amb25731066 [1,1,0,0,0,0|2,0,0]=4 2797 B12R1.125 CC(=O)CCc1ccc[n]c1N Amb25687160 [1,1,0,0,0,0|2,0,0]=4 2798 B12R1.125 CC(=O)CCc1ccccc1O Amb17507153 [1,1,0,0,0,0|1,0,0]=3 2799 B12R1.125 CC(=O)CNc1ccccc1Cl Amb24552973 [1,1,0,0,0,0|2,0,0]=4 2800 B12R1.125 CC(=O)COc1ccccc1Br Amb17226707 [1,1,0,0,0,0|2,0,0]=4 2801 B12R1.125 CC(=O)COc1ccccc1Cl Amb19075143 [1,1,0,0,0,0|2,0,0]=4 2802 B12R1.125 CC(=O)COc1ccccc1I Amb25692816 [1,1,0,0,0,0|2,0,0]=4 2803 B12R1.125 CC(=O)COc1ccccc1N Amb17110085 [1,1,0,0,0,0|2,0,0]=4 2804 B12R1.125 CC(=O)COc1ccccc1O Amb18646466 [1,1,0,0,0,0|2,0,0]=4 2805 B12R1.125 CC(=O)CSc1ccccc1N Amb17305639 [1,1,0,0,0,0|2,0,0]=4 2806 B12R1.125 CC(=O)NCc1[n]cccc1F Amb25333132 [1,1,0,0,0,0|2,0,0]=4 2807 B12R1.125 CC(=O)NCc1[n]cccc1O Amb25688352 [1,1,0,0,0,0|2,0,0]=4 2808 B12R1.125 CC(=O)NCc1ccc[n]c1F Amb24458330 [1,1,0,0,0,0|2,0,0]=4 2809 B12R1.125 CC(=O)NCc1ccccc1Br Amb2134482 [1,1,0,0,0,0|1,0,0]=3 2810 B12R1.125 CC(=O)NCc1ccccc1F Amb2020110 [1,1,0,0,0,0|1,0,0]=3 2811 B12R1.125 CC(=O)NCc1ccccc1N Amb18284299 [1,1,0,0,0,0|1,0,0]=3 2812 B12R1.125 CC(=O)NCc1ccccc1O Amb18646279 [1,1,0,0,0,0|1,0,0]=3 2813 B12R1.125 CC(=O)NCc1cnccc1C Amb17778543 [1,1,0,0,0,0|2,0,0]=4 2814 B12R1.125 CC(=O)NNc1ccccc1N Amb18646313 [1,1,0,0,0,0|2,0,0]=4 2815 B12R1.125 CC(=O)OCN1C=NC=CC1=O Amb24351758 [1,1,0,0,0,0|2,0,0]=4 2816 B12R1.125 CC(=O)OCc1c[n]c[n]c1N Amb25829653 [1,1,0,0,0,0|2,0,0]=4 2817 B12R1.125 CC(=O)OCc1cc[n]cc1Br Amb25159749 [1,1,0,0,0,0|1,0,0]=3 2818 B12R1.125 CC(=O)OCc1cccc[n+]1C Amb10553787 [1,1,0,0,0,0|1,0,0]=3 2819 B12R1.125 CC(=O)OCc1ccccc1C Amb17778968 [1,1,0,0,0,0|0,0,0]=2 2820 B12R1.125 CC(=O)OCc1ccccc1F Amb25788639 [1,1,0,0,0,0|0,0,0]=2 2821 B12R1.125 CC(=O)OCc1ccccc1O Amb18646465 [1,1,0,0,0,0|0,0,0]=2 2822 B12R1.125 CC(=O)SCc1ccc[n]c1N Amb24518695 [1,1,0,0,0,0|1,1,0]=4 2823 B12R1.125 CC(=O)SCc1ccccc1F Amb22231630 [1,1,0,0,0,0|0,1,0]=3 2824 B12R1.125 CC(=O)\C=C\c1ccccc1Br Amb18068027 [1,1,0,0,0,0|1,0,1]=4 2825 B12R1.125 CC(=O)\C=C\c1ccccc1C Amb17477498 [1,1,0,0,0,0|1,0,1]=4 2826 B12R1.125 CC(=O)\C=C\c1ccccc1F Amb18563599 [1,1,0,0,0,0|1,0,1]=4 2827 B12R1.125 CC(=O)\C=C\c1ccccc1O Amb1266216 [1,1,0,0,0,0|1,0,1]=4 2828 B12R1.125 CC(=O)\N=C\c1ccccc1Cl Amb24072988 [1,1,0,0,0,0|1,0,1]=4 2829 B12R1.125 CC(C)=CCc1ccccc1N Amb18645540 [1,1,0,0,0,0|2,0,0]=4 2830 B12R1.125 CC(C)=CCc1ccccc1O Amb24357144 [1,1,0,0,0,0|2,0,0]=4 2831 B12R1.125 CC(C)OCc1ccccc1Br Amb22900130 [1,1,0,0,0,0|1,0,1]=4 2832 B12R1.125 CC(OCc1ccccc1O)C Amb10560039 [1,1,0,0,0,0|1,0,1]=4 2833 B12R1.125 CS(=O)CCc1ccccc1N Amb18299124 [1,1,0,0,0,0|2,0,0]=4 2834 B12R1.125 CS(=O)NCc1ccccc1N Amb24600929 [1,1,0,0,0,0|2,0,0]=4 2835 B12R1.125 CS(=O)NCc1ccccc1O Amb24589168 [1,1,0,0,0,0|2,0,0]=4 2836 B12R1.125 C\C(\Cl)=C\Cc1ccccc1O Amb24614705 [1,1,0,0,0,0|2,0,0]=4 2837 B12R1.125 C\C(\N)=N\Cc1ccccc1O Amb24734749 [1,1,0,0,0,0|2,0,0]=4 2838 B12R1.125 Cc1[n]cccc1CCC(C)=O Amb25859556 [1,1,0,0,0,0|2,0,0]=4 2839 B12R1.125 Cc1[n]cccc1COC(C)=O Amb22750508 [1,1,0,0,0,0|1,0,0]=3 2840 B12R1.125 Cc1ccc[n]c1CNC(C)=O Amb22584206 [1,1,0,0,0,0|2,0,0]=4 2841 B12R1.125 Cc1ccc[n]c1COC(C)=O Amb24063548 [1,1,0,0,0,0|1,0,0]=3 2842 B12R1.125 Cc1ccccc1C#CC(C)=O Amb23438225 [1,1,0,0,0,0|1,0,1]=4 2843 B12R1.125 Cc1ccccc1CCC(=O)Cl Amb19066206 [1,1,0,0,0,0|2,0,0]=4 2844 B12R1.125 Cc1ccccc1CNC(C)=N Amb25780309 [1,1,0,0,0,0|2,0,0]=4 2845 B12R1.125 Cc1ccccc1CNC(C)=O Amb24721874 [1,1,0,0,0,0|1,0,0]=3 2846 B12R1.125 Cc1ccccc1CNC(N)=O Amb18800799 [1,1,0,0,0,0|2,0,0]=4 2847 B12R1.125 Cc1ccccc1COC(N)=O Amb25152446 [1,1,0,0,0,0|1,0,0]=3 2848 B12R1.125 Cc1ccccc1CSC(C)=O Amb22231631 [1,1,0,0,0,0|0,1,0]=3 2849 B12R1.125 Cc1ccccc1NCC(C)=O Amb25062983 [1,1,0,0,0,0|2,0,0]=4 2850 B12R1.125 Cc1ccccc1SCC(C)=O Amb18796318 [1,1,0,0,0,0|2,0,0]=4 2851 B12R1.125 ClC(=O)CCc1ccccc1F Amb10838958 [1,1,0,0,0,0|2,0,0]=4 2852 B12R1.125 NC(=O)CCc1ccccc1Br Amb11468216 [1,1,0,0,0,0|2,0,0]=4 2853 B12R1.125 NC(=O)CCc1ccccc1C Amb17400134 [1,1,0,0,0,0|2,0,0]=4 2854 B12R1.125 NC(=O)CCc1ccccc1Cl Amb2142514 [1,1,0,0,0,0|2,0,0]=4 2855 B12R1.125 NC(=O)NCc1ccccc1Cl Amb2435051 [1,1,0,0,0,0|2,0,0]=4 2856 B12R1.125 NC(=O)NCc1ccccc1F Amb1141051 [1,1,0,0,0,0|2,0,0]=4 2857 B12R1.125 Nc1ccccc1CCC(O)=O Amb24118035 [1,1,0,0,0,0|2,0,0]=4 2858 B12R1.125 Nc1ccccc1CNC(N)=O Amb18957838 [1,1,0,0,0,0|2,0,0]=4 2859 B12R1.125 O=C(Cl)CCc1ccccc1Br Amb19888630 [1,1,0,0,0,0|2,0,0]=4 2860 B12R1.125 O=C(Cl)CCc1ccccc1Cl Amb25061965 [1,1,0,0,0,0|2,0,0]=4 2861 B12R1.125 O=C(Cl)OCc1ccccc1Br Amb20620406 [1,1,0,0,0,0|1,0,0]=3 2862 B12R1.125 O=C(Cl)OCc1ccccc1Cl Amb21618686 [1,1,0,0,0,0|1,0,0]=3 2863 B12R1.125 O=C(Cl)OCc1ccccc1F Amb25039104 [1,1,0,0,0,0|1,0,0]=3 2864 B12R1.125 OC(=O)CCc1ccccc1Cl Amb1209214 [1,1,0,0,0,0|2,0,0]=4 2865 B12R1.125 OC(=O)CCc1ccccc1I Amb10071543 [1,1,0,0,0,0|2,0,0]=4 2866 B12R1.125 OC(=O)CCc1ccccc1N Amb17477727 [1,1,0,0,0,0|2,0,0]=4 2867 B12R1.125 OC(=O)CCc1ccccc1O Amb1211927 [1,1,0,0,0,0|2,0,0]=4 2868 B12R1.125 OC(=O)CCc1ccccc1S Amb18648646 [1,1,0,0,0,0|2,0,0]=4 2869 B12R1.125 Oc1ccccc1CCC(=O)Cl Amb25808033 [1,1,0,0,0,0|2,0,0]=4 2870 B12R1.226 CC(=N)NCc1cccc(Cl)c1 Amb24632269 [1,1,0,0,0,0|2,0,0]=4 2871 B12R1.226 CC(=N)NCc1cccc(F)c1 Amb25799323 [1,1,0,0,0,0|2,0,0]=4 2872 B12R1.226 CC(=O)C=Cc1cccc(O)c1 Amb24094413 [1,1,0,0,0,0|1,0,1]=4 2873 B12R1.226 CC(=O)C=Cc1cccc(c1)Cl Amb10808067 [1,1,0,0,0,0|1,0,1]=4 2874 B12R1.226 CC(=O)CCc1c[n]cc(F)c1 Amb25034788 [1,1,0,0,0,0|2,0,0]=4 2875 B12R1.226 CC(=O)CCc1cccc(O)[n]1 Amb24605336 [1,1,0,0,0,0|2,0,0]=4 2876 B12R1.226 CC(=O)CCc1cccc(O)c1 Amb18646057 [1,1,0,0,0,0|1,0,0]=3 2877 B12R1.226 CC(=O)CNc1cccc(Cl)c1 Amb24626052 [1,1,0,0,0,0|2,0,0]=4 2878 B12R1.226 CC(=O)COc1cccc(Cl)c1 Amb19075144 [1,1,0,0,0,0|2,0,0]=4 2879 B12R1.226 CC(=O)COc1cccc(O)c1 Amb25053053 [1,1,0,0,0,0|2,0,0]=4 2880 B12R1.226 CC(=O)COc1cccc(c1)Br Amb17226706 [1,1,0,0,0,0|2,0,0]=4 2881 B12R1.226 CC(=O)COc1cccc(c1)N Amb17110084 [1,1,0,0,0,0|2,0,0]=4 2882 B12R1.226 CC(=O)CSc1cccc(Br)c1 Amb24612317 [1,1,0,0,0,0|2,0,0]=4 2883 B12R1.226 CC(=O)CSc1cccc(Cl)c1 Amb18331367 [1,1,0,0,0,0|2,0,0]=4 2884 B12R1.226 CC(=O)NCC1=CC(=O)NC=C1 Amb25227214 [1,1,0,0,0,0|2,0,0]=4 2885 B12R1.226 CC(=O)NCC1=CC=CC(=O)N1 Amb25256952 [1,1,0,0,0,0|2,0,0]=4 2886 B12R1.226 CC(=O)NCc1c[n]cc(Br)c1 Amb22276859 [1,1,0,0,0,0|2,0,0]=4 2887 B12R1.226 CC(=O)NCc1cc[n]c(Cl)c1 Amb24072881 [1,1,0,0,0,0|2,0,0]=4 2888 B12R1.226 CC(=O)NCc1cccc(Cl)[n]1 Amb25734187 [1,1,0,0,0,0|2,0,0]=4 2889 B12R1.226 CC(=O)NCc1cccc(I)c1 Amb25148829 [1,1,0,0,0,0|1,0,0]=3 2890 B12R1.226 CC(=O)NCc1cccc(N)c1 Amb18286659 [1,1,0,0,0,0|1,0,0]=3 2891 B12R1.226 CC(=O)NCc1cccc(O)c1 Amb18792630 [1,1,0,0,0,0|1,0,0]=3 2892 B12R1.226 CC(=O)NCc1cccc(c1)Br Amb2085743 [1,1,0,0,0,0|1,0,0]=3 2893 B12R1.226 CC(=O)NCc1cccc(c1)Cl Amb2023612 [1,1,0,0,0,0|1,0,0]=3 2894 B12R1.226 CC(=O)NCc1cccc(n1)N Amb13890642 [1,1,0,0,0,0|2,0,0]=4 2895 B12R1.226 CC(=O)NNc1cc(F)ccc1 Amb25036298 [1,1,0,0,0,0|2,0,0]=4 2896 B12R1.226 CC(=O)OCc1c[n](=O)ccc1 Amb20247038 [1,1,0,0,0,0|1,0,0]=3 2897 B12R1.226 CC(=O)OCc1cc(Br)ccn1 Amb10603159 [1,1,0,0,0,0|1,0,0]=3 2898 B12R1.226 CC(=O)OCc1cc(I)cc[n]1 Amb24063673 [1,1,0,0,0,0|1,0,0]=3 2899 B12R1.226 CC(=O)OCc1cccc(Br)c1 Amb25099120 [1,1,0,0,0,0|0,0,0]=2 2900 B12R1.226 CC(=O)OCc1cccc(Cl)[n]1 Amb25710369 [1,1,0,0,0,0|1,0,0]=3 2901 B12R1.226 CC(=O)OCc1cccc(Cl)c1 Amb25306228 [1,1,0,0,0,0|0,0,0]=2 2902 B12R1.226 CC(=O)OCc1cccc(F)c1 Amb25145061 [1,1,0,0,0,0|0,0,0]=2 2903 B12R1.226 CC(=O)OCc1cccc(N)c1 Amb22229178 [1,1,0,0,0,0|0,0,0]=2 2904 B12R1.226 CC(=O)OCc1cccc(c1)C Amb10601899 [1,1,0,0,0,0|0,0,0]=2 2905 B12R1.226 CC(=O)OCc1cccc(n1)C Amb10573711 [1,1,0,0,0,0|1,0,0]=3 2906 B12R1.226 CC(=O)SCc1cc[n]c(N)c1 Amb25793643 [1,1,0,0,0,0|1,1,0]=4 2907 B12R1.226 CC(=O)SCc1cccc(Cl)c1 Amb22231632 [1,1,0,0,0,0|0,1,0]=3 2908 B12R1.226 CC(=O)SCc1cccc(F)c1 Amb22231633 [1,1,0,0,0,0|0,1,0]=3 2909 B12R1.226 CC(=O)\C=C\c1cccc(F)c1 Amb18563600 [1,1,0,0,0,0|1,0,1]=4 2910 B12R1.226 CC(=O)\C=C\c1cccc(N)c1 Amb23247751 [1,1,0,0,0,0|1,0,1]=4 2911 B12R1.226 CC(=O)\C=C\c1cccc(c1)Br Amb10601440 [1,1,0,0,0,0|1,0,1]=4 2912 B12R1.226 CC(=O)\C=C\c1cccc(c1)C Amb17477497 [1,1,0,0,0,0|1,0,1]=4 2913 B12R1.226 CC(=O)\C=C\c1cccc(c1)O Amb17615740 [1,1,0,0,0,0|1,0,1]=4 2914 B12R1.226 CC(C)=CCc1cccc(O)c1 Amb24341888 [1,1,0,0,0,0|2,0,0]=4 2915 B12R1.226 CC(C)OCc1cccc(Br)c1 Amb22058979 [1,1,0,0,0,0|1,0,1]=4 2916 B12R1.226 CC(C)OCc1cccc(O)c1 Amb23443320 [1,1,0,0,0,0|1,0,1]=4 2917 B12R1.226 CS(=O)NCc1cccc(O)c1 Amb24582944 [1,1,0,0,0,0|2,0,0]=4 2918 B12R1.226 Cc1c[n]cc(COC(C)=O)[n]1 Amb24485579 [1,1,0,0,0,0|2,0,0]=4 2919 B12R1.226 Cc1c[n]cc(COC(C)=O)c1 Amb24448150 [1,1,0,0,0,0|1,0,0]=3 2920 B12R1.226 Cc1cc(CCC(=O)Cl)ccc1 Amb18325287 [1,1,0,0,0,0|2,0,0]=4 2921 B12R1.226 Cc1cc(CCC(C)=O)cc[n]1 Amb24677051 [1,1,0,0,0,0|2,0,0]=4 2922 B12R1.226 Cc1cc(CNC(N)=O)ccc1 Amb18798292 [1,1,0,0,0,0|2,0,0]=4 2923 B12R1.226 Cc1cc(COC(C)=O)cc[n]1 Amb24487151 [1,1,0,0,0,0|1,0,0]=3 2924 B12R1.226 Cc1cc[n]c(COC(C)=O)[n]1 Amb24183819 [1,1,0,0,0,0|2,0,0]=4 2925 B12R1.226 Cc1cc[n]c(COC(C)=O)c1 Amb22490556 [1,1,0,0,0,0|1,0,0]=3 2926 B12R1.226 Cc1cccc(CSC(C)=O)[n]1 Amb25128176 [1,1,0,0,0,0|1,1,0]=4 2927 B12R1.226 Cc1cccc(c1)NCC(C)=O Amb25831083 [1,1,0,0,0,0|2,0,0]=4 2928 B12R1.226 Cc1cccc(c1)SCC(C)=O Amb18791171 [1,1,0,0,0,0|2,0,0]=4 2929 B12R1.226 NC(=O)CCc1cccc(c1)C Amb17400135 [1,1,0,0,0,0|2,0,0]=4 2930 B12R1.226 NC(=O)CCc1cccc(c1)Cl Amb17400995 [1,1,0,0,0,0|2,0,0]=4 2931 B12R1.226 NC(=O)NCc1cccc(O)c1 Amb18792735 [1,1,0,0,0,0|2,0,0]=4 2932 B12R1.226 NC(=O)NCc1cccc(c1)Cl Amb2440664 [1,1,0,0,0,0|2,0,0]=4 2933 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22408735 [1,1,0,0,0,0|2,0,0]=4 2934 B12R1.226 Nc1cc(CCC([O-])=O)ccc1 Amb22757721 [1,1,0,0,0,0|2,0,0]=4 2935 B12R1.226 Nc1cccc(CNC(N)=O)c1 Amb18962222 [1,1,0,0,0,0|2,0,0]=4 2936 B12R1.226 O=C(Cl)CCc1cc(Cl)ccc1 Amb24403345 [1,1,0,0,0,0|2,0,0]=4 2937 B12R1.226 O=C(Cl)CCc1cccc(Br)c1 Amb25150110 [1,1,0,0,0,0|2,0,0]=4 2938 B12R1.226 O=C(Cl)CCc1cccc(F)c1 Amb25129437 [1,1,0,0,0,0|2,0,0]=4 2939 B12R1.226 O=C(Cl)OCc1cccc(Br)c1 Amb24649567 [1,1,0,0,0,0|1,0,0]=3 2940 B12R1.226 OC(=O)CCc1cccc(c1)Br Amb1209216 [1,1,0,0,0,0|2,0,0]=4 2941 B12R1.226 OC(=O)CCc1cccc(c1)C Amb1106242 [1,1,0,0,0,0|2,0,0]=4 2942 B12R1.226 OC(=O)CCc1cccc(c1)Cl Amb1672952 [1,1,0,0,0,0|2,0,0]=4 2943 B12R1.226 OC(=O)CCc1cccc(c1)F Amb1091868 [1,1,0,0,0,0|2,0,0]=4 2944 B12R1.226 OC(=O)CCc1cccc(c1)I Amb16232982 [1,1,0,0,0,0|2,0,0]=4 2945 B12R1.226 Oc1cc(CCC(=O)Cl)ccc1 Amb25356247 [1,1,0,0,0,0|2,0,0]=4 2946 B12R1.891 CS(=O)(=O)CCc1ccccc1 Amb24454272 [1,1,0,0,0,0|2,0,0]=4 2947 B12R1.891 CS(=O)(=O)NCc1ccccc1 Amb2435156 [1,1,0,0,0,0|2,0,0]=4 2948 B12R1.891 CS(=O)(=O)OCc1c[n]ccc1 Amb24472514 [1,1,0,0,0,0|2,0,0]=4 2949 B12R1.891 CS(=O)(=O)OCc1cc[n]cc1 Amb24524731 [1,1,0,0,0,0|2,0,0]=4 2950 B12R1.891 CS(=O)(=O)OCc1cccc[n]1 Amb25322928 [1,1,0,0,0,0|2,0,0]=4 2951 B12R1.891 CS(=O)(=O)SCc1ccccc1 Amb10071891 [1,1,0,0,0,0|1,1,0]=4 2952 B12R1.891 [O-]S(=O)(=O)OCc1ccccc1 Amb24694356 [1,1,0,0,0,0|2,0,0]=4 2953 B12R1.20 BrC(c1ccc(cc1)F)C(=O)C Amb17142689 [0,1,0,0,1,0|1,0,0]=3 2954 B12R1.20 CC(=C)C(N)c1ccc(Br)cc1 Amb24355767 [0,1,0,0,1,0|2,0,0]=4 2955 B12R1.20 CC(=C)C(N)c1ccc(Cl)cc1 Amb25035155 [0,1,0,0,1,0|2,0,0]=4 2956 B12R1.20 CC(=C)C(N)c1ccc(F)cc1 Amb24365829 [0,1,0,0,1,0|2,0,0]=4 2957 B12R1.20 CC(=C)C(N)c1ccc(I)cc1 Amb25823888 [0,1,0,0,1,0|2,0,0]=4 2958 B12R1.20 CC(=O)C(Br)c1ccc(N)cc1 Amb25364338 [0,1,0,0,1,0|1,0,0]=3 2959 B12R1.20 CC(=O)C(Br)c1ccc(O)cc1 Amb20620488 [0,1,0,0,1,0|1,0,0]=3 2960 B12R1.20 CC(=O)C(Br)c1ccc(S)cc1 Amb25351848 [0,1,0,0,1,0|1,0,0]=3 2961 B12R1.20 CC(=O)C(C)c1ccc(Br)cc1 Amb25043063 [0,1,0,0,1,0|0,0,0]=2 2962 B12R1.20 CC(=O)C(C)c1ccc(F)cc1 Amb25802289 [0,1,0,0,1,0|0,0,0]=2 2963 B12R1.20 CC(=O)C(N)c1ccc(Br)c[n]1 Amb25716232 [0,1,0,0,1,0|2,0,0]=4 2964 B12R1.20 CC(=O)C(N)c1ccc(Cl)c[n]1 Amb24349800 [0,1,0,0,1,0|2,0,0]=4 2965 B12R1.20 CC(=O)C(N)c1ccc(Cl)cc1 Amb24376685 [0,1,0,0,1,0|1,0,0]=3 2966 B12R1.20 CC(=O)C(N)c1ccc(F)[n]c1 Amb24487166 [0,1,0,0,1,0|2,0,0]=4 2967 B12R1.20 CC(=O)C(N)c1ccc(F)c[n]1 Amb24428783 [0,1,0,0,1,0|2,0,0]=4 2968 B12R1.20 CC(=O)C(N)c1ccc(I)[n]c1 Amb24427622 [0,1,0,0,1,0|2,0,0]=4 2969 B12R1.20 CC(=O)C(N)c1ccc(I)c[n]1 Amb24360228 [0,1,0,0,1,0|2,0,0]=4 2970 B12R1.20 CC(=O)C(N)c1ccc(I)cc1 Amb24483646 [0,1,0,0,1,0|1,0,0]=3 2971 B12R1.20 CC(=O)C(N)c1ccc(N)c[n]1 Amb25836837 [0,1,0,0,1,0|2,0,0]=4 2972 B12R1.20 CC(=O)C(N)c1ccc(N)cc1 Amb24487126 [0,1,0,0,1,0|1,0,0]=3 2973 B12R1.20 CC(=O)C(N)c1ccc(O)[n]c1 Amb24560279 [0,1,0,0,1,0|2,0,0]=4 2974 B12R1.20 CC(=O)C(N)c1ccc(O)c[n]1 Amb25076757 [0,1,0,0,1,0|2,0,0]=4 2975 B12R1.20 CC(=O)C(O)c1ccc(Br)cc1 Amb25816507 [0,1,0,0,1,0|1,0,0]=3 2976 B12R1.20 CC(=O)C(O)c1ccc(F)cc1 Amb24700376 [0,1,0,0,1,0|1,0,0]=3 2977 B12R1.20 CC(=O)C(O)c1ccc(O)cc1 Amb18646451 [0,1,0,0,1,0|1,0,0]=3 2978 B12R1.20 CC(=O)C(c1ccc(cc1)C)Br Amb17142262 [0,1,0,0,1,0|1,0,0]=3 2979 B12R1.20 CC(=O)C(c1ccc(cc1)C)Cl Amb17139039 [0,1,0,0,1,0|1,0,0]=3 2980 B12R1.20 CC(=O)N(C)c1ccc(Br)c[n]1 Amb24557089 [0,1,0,0,1,0|2,0,0]=4 2981 B12R1.20 CC(=O)N(C)c1ccc(Cl)[n]c1 Amb25255688 [0,1,0,0,1,0|2,0,0]=4 2982 B12R1.20 CC(=O)N(C)c1ccc(Cl)c[n]1 Amb25036537 [0,1,0,0,1,0|2,0,0]=4 2983 B12R1.20 CC(=O)N(N)c1ccc(Br)cc1 Amb18070169 [0,1,0,0,1,0|2,0,0]=4 2984 B12R1.20 CC(=O)N(N)c1ccc(Cl)cc1 Amb18564312 [0,1,0,0,1,0|2,0,0]=4 2985 B12R1.20 CC(=O)N(N)c1ccc(F)cc1 Amb18563834 [0,1,0,0,1,0|2,0,0]=4 2986 B12R1.20 CC(=O)N(O)c1ccc(O)cc1 Amb24567688 [0,1,0,0,1,0|2,0,0]=4 2987 B12R1.20 CC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25852918 [0,1,0,0,1,0|1,0,0]=3 2988 B12R1.20 CC(=O)[C@H](C)c1ccc(Br)cc1 Amb25848276 [0,1,0,0,1,0|0,0,0]=2 2989 B12R1.20 CC(=O)[C@H](O)c1ccc(Cl)cc1 Amb25371989 [0,1,0,0,1,0|1,0,0]=3 2990 B12R1.20 CC(=O)[C@H](O)c1ccc(O)cc1 Amb25807613 [0,1,0,0,1,0|1,0,0]=3 2991 B12R1.20 CC(C(=O)Cl)c1ccc(Br)cc1 Amb24483822 [0,1,0,0,1,0|1,0,0]=3 2992 B12R1.20 CC(C(C)Br)c1ccc(Br)cc1 Amb24362041 [0,1,0,0,1,0|1,0,1]=4 2993 B12R1.20 CC(C(C)Br)c1ccc(I)cc1 Amb25159817 [0,1,0,0,1,0|1,0,1]=4 2994 B12R1.20 CC(C(C)N)c1ccc(Br)cc1 Amb18161837 [0,1,0,0,1,0|1,0,1]=4 2995 B12R1.20 CC(C(C)N)c1ccc(Cl)cc1 Amb18823024 [0,1,0,0,1,0|1,0,1]=4 2996 B12R1.20 CC(C(C)N)c1ccc(F)cc1 Amb18646792 [0,1,0,0,1,0|1,0,1]=4 2997 B12R1.20 CC(C(C)N)c1ccc(I)cc1 Amb25045736 [0,1,0,0,1,0|1,0,1]=4 2998 B12R1.20 CC(C(C)O)c1ccc(I)cc1 Amb24353088 [0,1,0,0,1,0|0,0,2]=4 2999 B12R1.20 CC(C(N)=N)c1ccc(Br)cc1 Amb25799351 [0,1,0,0,1,0|2,0,0]=4 3000 B12R1.20 CC(C(N)=O)c1ccc(O)cc1 Amb24364677 [0,1,0,0,1,0|1,0,0]=3 3001 B12R1.20 CC(C(N)=S)c1ccc(Br)cc1 Amb24570080 [0,1,0,0,1,0|1,1,0]=4 3002 B12R1.20 CC(C(O)=O)N1C=CC(=O)C=C1 Amb18534254 [0,1,0,0,1,0|2,0,0]=4 3003 B12R1.20 CC(C(O)=O)c1ccc(C)cc1 Amb17678847 [0,1,0,0,1,0|1,0,0]=3 3004 B12R1.20 CC(C(O)=O)c1ccc(Cl)[n]c1 Amb19944615 [0,1,0,0,1,0|2,0,0]=4 3005 B12R1.20 CC(C(O)=O)c1ccc(I)cc1 Amb20619418 [0,1,0,0,1,0|1,0,0]=3 3006 B12R1.20 CC(C(O)=O)c1ccc(N)cc1 Amb24113246 [0,1,0,0,1,0|1,0,0]=3 3007 B12R1.20 CC(c1ccc(N)cc1)C(N)=O Amb25806999 [0,1,0,0,1,0|1,0,0]=3 3008 B12R1.20 CC(c1ccc(cc1)Br)C(=O)O Amb17087424 [0,1,0,0,1,0|1,0,0]=3 3009 B12R1.20 CC(c1ccc(cc1)N)C(=O)O Amb2438888 [0,1,0,0,1,0|1,0,0]=3 3010 B12R1.20 CC(c1ccc(cc1)N)N(C)C Amb17090400 [0,1,0,0,1,0|2,0,0]=4 3011 B12R1.20 CN(C(=O)Cl)c1ccc(F)cc1 Amb25718037 [0,1,0,0,1,0|2,0,0]=4 3012 B12R1.20 CN(C(C)=O)[n]1ccc(=S)cc1 Amb24096752 [0,1,0,0,1,0|2,0,0]=4 3013 B12R1.20 CN(C(N)=O)c1ccc(F)cc1 Amb18793023 [0,1,0,0,1,0|2,0,0]=4 3014 B12R1.20 CN(C)C(C)c1ccc(Br)cc1 Amb21955701 [0,1,0,0,1,0|2,0,0]=4 3015 B12R1.20 CN(C)C(C)c1ccc(Cl)cc1 Amb24747924 [0,1,0,0,1,0|2,0,0]=4 3016 B12R1.20 CN(C)C(C)c1ccc(O)cc1 Amb25223024 [0,1,0,0,1,0|2,0,0]=4 3017 B12R1.20 CN(C)[C@@H](C)c1ccc(O)cc1 Amb24715954 [0,1,0,0,1,0|2,0,0]=4 3018 B12R1.20 CN(c1cc[n+](cc1)[O-])C(=O)C Amb10553011 [0,1,0,0,1,0|2,0,0]=4 3019 B12R1.20 CN(c1ccc(O)cc1)S(C)=O Amb25177213 [0,1,0,0,1,0|2,0,0]=4 3020 B12R1.20 CN(c1ccc(cc1)O)C(=O)C Amb2575449 [0,1,0,0,1,0|1,0,0]=3 3021 B12R1.20 C[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb24182093 [0,1,0,0,1,0|1,0,0]=3 3022 B12R1.20 C[C@@H](c1ccc(N)cc1)C(N)=O Amb25141393 [0,1,0,0,1,0|1,0,0]=3 3023 B12R1.20 C[C@@H](c1ccc(O)cc1)C(O)=O Amb21855850 [0,1,0,0,1,0|1,0,0]=3 3024 B12R1.20 C[C@H](C(N)=O)c1ccc(Cl)cc1 Amb24723034 [0,1,0,0,1,0|1,0,0]=3 3025 B12R1.20 C[C@H](C(N)=O)c1ccc(F)cc1 Amb24401577 [0,1,0,0,1,0|1,0,0]=3 3026 B12R1.20 C[C@H](C(O)=O)c1ccc(Cl)cc1 Amb24740781 [0,1,0,0,1,0|1,0,0]=3 3027 B12R1.20 C[C@H](C(O)=O)c1ccc(N)cc1 Amb25708326 [0,1,0,0,1,0|1,0,0]=3 3028 B12R1.20 C[C@H](c1ccc(N)cc1)C(N)=O Amb24665804 [0,1,0,0,1,0|1,0,0]=3 3029 B12R1.20 C[C@H](c1ccc(cc1)F)C(=O)O Amb10843989 [0,1,0,0,1,0|1,0,0]=3 3030 B12R1.20 Cc1ccc(c[n]1)C(C)C(O)=O Amb18828385 [0,1,0,0,1,0|2,0,0]=4 3031 B12R1.20 Cc1ccc(cc1)C(=O)C(=O)C Amb17400105 [0,1,0,0,1,0|1,0,1]=4 3032 B12R1.20 Cc1ccc(cc1)C(C)C(=O)Cl Amb24425440 [0,1,0,0,1,0|1,0,0]=3 3033 B12R1.20 Cc1ccc(cc1)C(C)C(C)N Amb18829123 [0,1,0,0,1,0|1,0,1]=4 3034 B12R1.20 Cc1ccc(cc1)C(C)C(N)=N Amb25081542 [0,1,0,0,1,0|2,0,0]=4 3035 B12R1.20 Cc1ccc(cc1)C(C)C(N)=O Amb25288853 [0,1,0,0,1,0|1,0,0]=3 3036 B12R1.20 Cc1ccc(cc1)C(C)N(C)C Amb25271218 [0,1,0,0,1,0|2,0,0]=4 3037 B12R1.20 Cc1ccc(cc1)C(C)[N+]([O-])=O Amb24064769 [0,1,0,0,1,0|2,0,0]=4 3038 B12R1.20 Cc1ccc(cc1)C(Cl)C(N)=O Amb19074654 [0,1,0,0,1,0|2,0,0]=4 3039 B12R1.20 Cc1ccc(cc1)C(F)C(O)=O Amb25320951 [0,1,0,0,1,0|2,0,0]=4 3040 B12R1.20 Cc1ccc(cc1)C(N)C(C)=C Amb25375128 [0,1,0,0,1,0|2,0,0]=4 3041 B12R1.20 Cc1ccc(cc1)C(O)C(C)=C Amb25098914 [0,1,0,0,1,0|2,0,0]=4 3042 B12R1.20 Cc1ccc(cc1)C(O)C(N)=O Amb18800898 [0,1,0,0,1,0|2,0,0]=4 3043 B12R1.20 Cc1ccc(cc1)N(C)C(C)=N Amb25148508 [0,1,0,0,1,0|2,0,0]=4 3044 B12R1.20 Cc1ccc(cc1)N(C)C(C)=O Amb25141388 [0,1,0,0,1,0|1,0,0]=3 3045 B12R1.20 Cc1ccc(cc1)N(C)C(C)=S Amb24096749 [0,1,0,0,1,0|1,1,0]=4 3046 B12R1.20 Cc1ccc(cc1)N(C)C(N)=O Amb18788283 [0,1,0,0,1,0|2,0,0]=4 3047 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb18563638 [0,1,0,0,1,0|2,0,0]=4 3048 B12R1.20 Cc1ccc(cc1)N(N)C(C)=O Amb24072440 [0,1,0,0,1,0|2,0,0]=4 3049 B12R1.20 Cc1ccc(cc1)[C@@H](C)C(O)=O Amb22736712 [0,1,0,0,1,0|1,0,0]=3 3050 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(N)=O Amb24341621 [0,1,0,0,1,0|2,0,0]=4 3051 B12R1.20 Cc1ccc(cc1)[C@@H](N)C(O)=O Amb22747999 [0,1,0,0,1,0|2,0,0]=4 3052 B12R1.20 Cc1ccc(cc1)[C@H](C)C(O)=O Amb22736713 [0,1,0,0,1,0|1,0,0]=3 3053 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@@H](C)O Amb25343914 [0,1,0,0,1,0|0,0,2]=4 3054 B12R1.20 Cc1ccc(cc1)[C@H](C)[C@H](C)O Amb24412147 [0,1,0,0,1,0|0,0,2]=4 3055 B12R1.20 Cc1ccc(cc1)[C@H](O)C(C)=O Amb25320143 [0,1,0,0,1,0|1,0,0]=3 3056 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)C Amb17477759 [0,1,0,0,1,0|1,0,0]=3 3057 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)N Amb1199712 [0,1,0,0,1,0|2,0,0]=4 3058 B12R1.20 ClC(c1ccc(cc1)Br)C(=O)O Amb17261128 [0,1,0,0,1,0|2,0,0]=4 3059 B12R1.20 ClC(c1ccc(cc1)C)C(=O)Cl Amb17506249 [0,1,0,0,1,0|2,0,0]=4 3060 B12R1.20 ClC(c1ccc(cc1)C)C(=O)O Amb17234143 [0,1,0,0,1,0|2,0,0]=4 3061 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)C Amb17477762 [0,1,0,0,1,0|1,0,0]=3 3062 B12R1.20 ClC(c1ccc(cc1)Cl)C(=O)O Amb17238287 [0,1,0,0,1,0|2,0,0]=4 3063 B12R1.20 ClC(c1ccc(cc1)F)C(=O)C Amb17139154 [0,1,0,0,1,0|1,0,0]=3 3064 B12R1.20 ClC(c1ccc(cc1)F)C(=O)Cl Amb17098059 [0,1,0,0,1,0|2,0,0]=4 3065 B12R1.20 ClC(c1ccc(cc1)F)C(=O)O Amb17234610 [0,1,0,0,1,0|2,0,0]=4 3066 B12R1.20 NC(=O)C(Br)c1ccc(Br)cc1 Amb23510123 [0,1,0,0,1,0|2,0,0]=4 3067 B12R1.20 NC(=O)C(Cl)c1ccc(F)cc1 Amb18329809 [0,1,0,0,1,0|2,0,0]=4 3068 B12R1.20 NC(=O)C(Cl)c1ccc(I)cc1 Amb24373016 [0,1,0,0,1,0|2,0,0]=4 3069 B12R1.20 NC(=O)C(N)c1ccc(Br)cc1 Amb22478994 [0,1,0,0,1,0|2,0,0]=4 3070 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb19400288 [0,1,0,0,1,0|2,0,0]=4 3071 B12R1.20 NC(=O)C(N)c1ccc(Cl)cc1 Amb22433459 [0,1,0,0,1,0|2,0,0]=4 3072 B12R1.20 NC(=O)C(N)c1ccc(F)cc1 Amb22469878 [0,1,0,0,1,0|2,0,0]=4 3073 B12R1.20 NC(=O)C(O)c1ccc(Br)cc1 Amb24100617 [0,1,0,0,1,0|2,0,0]=4 3074 B12R1.20 NC(=O)C(O)c1ccc(Cl)cc1 Amb19075669 [0,1,0,0,1,0|2,0,0]=4 3075 B12R1.20 NC(=O)C(O)c1ccc(F)cc1 Amb18806073 [0,1,0,0,1,0|2,0,0]=4 3076 B12R1.20 NC(=O)C(O)c1ccc(I)cc1 Amb25700495 [0,1,0,0,1,0|2,0,0]=4 3077 B12R1.20 NC(=O)C(O)c1ccc(O)cc1 Amb18805580 [0,1,0,0,1,0|2,0,0]=4 3078 B12R1.20 NC(=O)[C@@H](N)c1ccc(Cl)cc1 Amb25152633 [0,1,0,0,1,0|2,0,0]=4 3079 B12R1.20 NC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb25346222 [0,1,0,0,1,0|2,0,0]=4 3080 B12R1.20 NC(=O)[C@H](N)c1ccc(Cl)cc1 Amb25724996 [0,1,0,0,1,0|2,0,0]=4 3081 B12R1.20 NC(=O)[C@H](O)c1ccc(Cl)cc1 Amb24398035 [0,1,0,0,1,0|2,0,0]=4 3082 B12R1.20 NC(C(=O)Cl)c1ccc(O)cc1 Amb25100939 [0,1,0,0,1,0|2,0,0]=4 3083 B12R1.20 NC(C(O)=O)c1ccc(I)cc1 Amb22899108 [0,1,0,0,1,0|2,0,0]=4 3084 B12R1.20 NC(C(O)=O)c1ccc(S)cc1 Amb24504681 [0,1,0,0,1,0|2,0,0]=4 3085 B12R1.20 NC(c1ccc(cc1)Br)C(=O)N Amb13951626 [0,1,0,0,1,0|2,0,0]=4 3086 B12R1.20 NC(c1ccc(cc1)Br)C(=O)O Amb1837854 [0,1,0,0,1,0|2,0,0]=4 3087 B12R1.20 NC(c1ccc(cc1)C)C(=O)N Amb17334619 [0,1,0,0,1,0|2,0,0]=4 3088 B12R1.20 NC(c1ccc(cc1)C)C(=O)O Amb2234620 [0,1,0,0,1,0|2,0,0]=4 3089 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)N Amb17335727 [0,1,0,0,1,0|2,0,0]=4 3090 B12R1.20 NC(c1ccc(cc1)Cl)C(=O)O Amb1837642 [0,1,0,0,1,0|2,0,0]=4 3091 B12R1.20 NC(c1ccc(cc1)F)C(=O)N Amb17334711 [0,1,0,0,1,0|2,0,0]=4 3092 B12R1.20 NC(c1ccc(cc1)I)C(=O)O Amb2234604 [0,1,0,0,1,0|2,0,0]=4 3093 B12R1.20 NC(c1ccc(cc1)O)C(=O)N Amb17334665 [0,1,0,0,1,0|2,0,0]=4 3094 B12R1.20 N[C@@H](C(=O)Cl)c1ccc(O)cc1 Amb24595943 [0,1,0,0,1,0|2,0,0]=4 3095 B12R1.20 N[C@@H](C(O)=O)c1ccc(Br)cc1 Amb22745984 [0,1,0,0,1,0|2,0,0]=4 3096 B12R1.20 N[C@@H](C(O)=O)c1ccc(Cl)cc1 Amb19889601 [0,1,0,0,1,0|2,0,0]=4 3097 B12R1.20 N[C@@H](C(O)=O)c1ccc(F)cc1 Amb19889896 [0,1,0,0,1,0|2,0,0]=4 3098 B12R1.20 N[C@@H](C(O)=O)c1ccc(I)cc1 Amb22745451 [0,1,0,0,1,0|2,0,0]=4 3099 B12R1.20 N[C@@H](c1ccc(cc1)C)C(=O)O Amb17621414 [0,1,0,0,1,0|2,0,0]=4 3100 B12R1.20 N[C@H](C(=O)Cl)c1ccc(O)cc1 Amb25141079 [0,1,0,0,1,0|2,0,0]=4 3101 B12R1.20 N[C@H](C(O)=O)c1ccc(F)cc1 Amb19889897 [0,1,0,0,1,0|2,0,0]=4 3102 B12R1.20 N[C@H](C(O)=O)c1ccc(I)cc1 Amb24653870 [0,1,0,0,1,0|2,0,0]=4 3103 B12R1.20 N[C@H](c1ccc(cc1)O)C(=O)N Amb15741205 [0,1,0,0,1,0|2,0,0]=4 3104 B12R1.20 Nc1ccc(cc1)C(F)C(O)=O Amb25376043 [0,1,0,0,1,0|2,0,0]=4 3105 B12R1.20 Nc1ccc(cc1)C(N)C(O)=O Amb18646484 [0,1,0,0,1,0|2,0,0]=4 3106 B12R1.20 Nc1ccc(cc1)C(O)C(N)=O Amb24100608 [0,1,0,0,1,0|2,0,0]=4 3107 B12R1.20 Nc1ccc(cc1)C(O)C(O)=O Amb20668152 [0,1,0,0,1,0|2,0,0]=4 3108 B12R1.20 Nc1ccc(cc1)C(S)C(O)=O Amb25299470 [0,1,0,0,1,0|2,0,0]=4 3109 B12R1.20 Nc1ccc(cc1)[C@@H](N)C(O)=O Amb22745344 [0,1,0,0,1,0|2,0,0]=4 3110 B12R1.20 Nc1ccc(cc1)[C@H](N)C(O)=O Amb24568498 [0,1,0,0,1,0|2,0,0]=4 3111 B12R1.20 O=C(Br)C(Br)c1ccc(Br)cc1 Amb23536400 [0,1,0,0,1,0|2,0,0]=4 3112 B12R1.20 O=C(c1ccc(cc1)F)C(=O)C Amb17400192 [0,1,0,0,1,0|1,0,1]=4 3113 B12R1.20 OC(=O)C(Br)c1ccc(Br)cc1 Amb23510124 [0,1,0,0,1,0|2,0,0]=4 3114 B12R1.20 OC(=O)C(Br)c1ccc(Cl)cc1 Amb18665883 [0,1,0,0,1,0|2,0,0]=4 3115 B12R1.20 OC(=O)C(Br)c1ccc(F)cc1 Amb22337461 [0,1,0,0,1,0|2,0,0]=4 3116 B12R1.20 OC(=O)C(F)c1ccc(Cl)cc1 Amb24355948 [0,1,0,0,1,0|2,0,0]=4 3117 B12R1.20 OC(=O)C(O)c1ccc(I)cc1 Amb25798219 [0,1,0,0,1,0|2,0,0]=4 3118 B12R1.20 OC(=O)C(S)c1ccc(Cl)cc1 Amb24668947 [0,1,0,0,1,0|2,0,0]=4 3119 B12R1.20 OC(=O)[C@@H](F)c1ccc(Br)cc1 Amb25112439 [0,1,0,0,1,0|2,0,0]=4 3120 B12R1.20 OC(=O)[C@@H](O)c1ccc(Br)cc1 Amb22737259 [0,1,0,0,1,0|2,0,0]=4 3121 B12R1.20 OC(=O)[C@@H](O)c1ccc(Cl)cc1 Amb22388650 [0,1,0,0,1,0|2,0,0]=4 3122 B12R1.20 OC(=O)[C@@H](O)c1ccc(F)cc1 Amb25138794 [0,1,0,0,1,0|2,0,0]=4 3123 B12R1.20 OC(=O)[C@@H](S)c1ccc(Cl)cc1 Amb24497033 [0,1,0,0,1,0|2,0,0]=4 3124 B12R1.20 OC(=O)[C@@H](c1ccc(cc1)O)C Amb10843991 [0,1,0,0,1,0|1,0,0]=3 3125 B12R1.20 OC(=O)[C@H](F)c1ccc(Br)cc1 Amb25117435 [0,1,0,0,1,0|2,0,0]=4 3126 B12R1.20 OC(=O)[C@H](O)c1ccc(Br)cc1 Amb22737260 [0,1,0,0,1,0|2,0,0]=4 3127 B12R1.20 OC(=O)[C@H](O)c1ccc(F)cc1 Amb24059762 [0,1,0,0,1,0|2,0,0]=4 3128 B12R1.20 OC(c1ccc(cc1)F)C(=O)O Amb1218322 [0,1,0,0,1,0|2,0,0]=4 3129 B12R1.20 O[C@H](c1ccc(cc1)C)C(=O)O Amb10808019 [0,1,0,0,1,0|2,0,0]=4 3130 B12R1.20 Oc1ccc(cc1)[C@@H](O)C(O)=O Amb22745764 [0,1,0,0,1,0|2,0,0]=4 3131 B12R1.20 [NH3+]C(C(=O)Cl)c1ccc(O)cc1 Amb24104191 [0,1,0,0,1,0|2,0,0]=4 3132 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb21964739 [0,1,0,0,1,0|2,0,0]=4 3133 B12R1.20 [O-]C(=O)C(O)c1ccc(O)cc1 Amb22899121 [0,1,0,0,1,0|2,0,0]=4 3134 B12R1.124 CC(=C)C(O)c1ccccc1Cl Amb25333923 [0,1,0,0,1,0|2,0,0]=4 3135 B12R1.124 CC(=C)C(O)c1ccccc1F Amb25136591 [0,1,0,0,1,0|2,0,0]=4 3136 B12R1.124 CC(=C)C(O)c1ccccc1O Amb24497319 [0,1,0,0,1,0|2,0,0]=4 3137 B12R1.124 CC(=O)C(=C)c1ccccc1O Amb24408394 [0,1,0,0,1,0|0,0,2]=4 3138 B12R1.124 CC(=O)C(=O)c1ccccc1Br Amb17406919 [0,1,0,0,1,0|1,0,1]=4 3139 B12R1.124 CC(=O)C(=O)c1ccccc1C Amb17400103 [0,1,0,0,1,0|1,0,1]=4 3140 B12R1.124 CC(=O)C(=O)c1ccccc1Cl Amb17400961 [0,1,0,0,1,0|1,0,1]=4 3141 B12R1.124 CC(=O)C(=O)c1ccccc1F Amb17400191 [0,1,0,0,1,0|1,0,1]=4 3142 B12R1.124 CC(=O)C(=O)c1ccccc1O Amb18645956 [0,1,0,0,1,0|1,0,1]=4 3143 B12R1.124 CC(=O)C(Br)c1ccccc1Br Amb24664641 [0,1,0,0,1,0|1,0,0]=3 3144 B12R1.124 CC(=O)C(C)c1ccccc1Br Amb25686339 [0,1,0,0,1,0|0,0,0]=2 3145 B12R1.124 CC(=O)C(C)c1ccccc1Cl Amb22753501 [0,1,0,0,1,0|0,0,0]=2 3146 B12R1.124 CC(=O)C(Cl)c1ccccc1N Amb25253259 [0,1,0,0,1,0|1,0,0]=3 3147 B12R1.124 CC(=O)C(N)c1[n]cccc1N Amb25189598 [0,1,0,0,1,0|2,0,0]=4 3148 B12R1.124 CC(=O)C(N)c1c[n]ccc1Cl Amb24715705 [0,1,0,0,1,0|2,0,0]=4 3149 B12R1.124 CC(=O)C(N)c1cc[n]cc1Br Amb25805508 [0,1,0,0,1,0|2,0,0]=4 3150 B12R1.124 CC(=O)C(N)c1ccc[n]c1Cl Amb25292250 [0,1,0,0,1,0|2,0,0]=4 3151 B12R1.124 CC(=O)C(N)c1ccc[n]c1S Amb25328674 [0,1,0,0,1,0|2,0,0]=4 3152 B12R1.124 CC(=O)C(N)c1ccccc1Cl Amb25265226 [0,1,0,0,1,0|1,0,0]=3 3153 B12R1.124 CC(=O)C(N)c1ccccc1S Amb24487128 [0,1,0,0,1,0|1,0,0]=3 3154 B12R1.124 CC(=O)C(O)c1ccccc1Cl Amb25248975 [0,1,0,0,1,0|1,0,0]=3 3155 B12R1.124 CC(=O)C(c1ccccc1C)Cl Amb17477626 [0,1,0,0,1,0|1,0,0]=3 3156 B12R1.124 CC(=O)C(c1ccccc1Cl)Cl Amb17477761 [0,1,0,0,1,0|1,0,0]=3 3157 B12R1.124 CC(=O)C(c1ccccc1F)Br Amb17142690 [0,1,0,0,1,0|1,0,0]=3 3158 B12R1.124 CC(=O)C(c1ccccc1F)Cl Amb17139155 [0,1,0,0,1,0|1,0,0]=3 3159 B12R1.124 CC(=O)N(C)c1[n]cccc1Br Amb25078870 [0,1,0,0,1,0|2,0,0]=4 3160 B12R1.124 CC(=O)N(C)c1[n]cccc1F Amb25043592 [0,1,0,0,1,0|2,0,0]=4 3161 B12R1.124 CC(=O)N(C)c1cc[n]cc1N Amb18278939 [0,1,0,0,1,0|2,0,0]=4 3162 B12R1.124 CC(=O)N(C)c1ccc[n]c1Cl Amb23024680 [0,1,0,0,1,0|2,0,0]=4 3163 B12R1.124 CC(=O)N(C)c1ccccc1Br Amb24462353 [0,1,0,0,1,0|1,0,0]=3 3164 B12R1.124 CC(=O)N(C)c1ccccc1F Amb25151063 [0,1,0,0,1,0|1,0,0]=3 3165 B12R1.124 CC(=O)N(C)c1ccccc1O Amb18646273 [0,1,0,0,1,0|1,0,0]=3 3166 B12R1.124 CC(=O)N(N)c1ccccc1Br Amb18571906 [0,1,0,0,1,0|2,0,0]=4 3167 B12R1.124 CC(=O)N(N)c1ccccc1Cl Amb18564310 [0,1,0,0,1,0|2,0,0]=4 3168 B12R1.124 CC(=O)N(N)c1ccccc1F Amb18563833 [0,1,0,0,1,0|2,0,0]=4 3169 B12R1.124 CC(=O)N(c1ccccc1N)C Amb2444993 [0,1,0,0,1,0|1,0,0]=3 3170 B12R1.124 CC(=O)[C@@H](O)c1ccccc1F Amb25306551 [0,1,0,0,1,0|1,0,0]=3 3171 B12R1.124 CC(C(=O)Cl)c1ccccc1Br Amb24605624 [0,1,0,0,1,0|1,0,0]=3 3172 B12R1.124 CC(C(=O)Cl)c1ccccc1Cl Amb24699169 [0,1,0,0,1,0|1,0,0]=3 3173 B12R1.124 CC(C(C)N)c1ccccc1Br Amb18161843 [0,1,0,0,1,0|1,0,1]=4 3174 B12R1.124 CC(C(C)N)c1ccccc1Cl Amb18191712 [0,1,0,0,1,0|1,0,1]=4 3175 B12R1.124 CC(C(C)N)c1ccccc1F Amb18199473 [0,1,0,0,1,0|1,0,1]=4 3176 B12R1.124 CC(C(C)O)c1ccccc1Br Amb25725772 [0,1,0,0,1,0|0,0,2]=4 3177 B12R1.124 CC(C(C)O)c1ccccc1Cl Amb25787409 [0,1,0,0,1,0|0,0,2]=4 3178 B12R1.124 CC(C(C)O)c1ccccc1O Amb24357145 [0,1,0,0,1,0|0,0,2]=4 3179 B12R1.124 CC(C(N)=O)c1ccccc1F Amb25285412 [0,1,0,0,1,0|1,0,0]=3 3180 B12R1.124 CC(C(O)=O)N1C=CC=CC1=O Amb18040083 [0,1,0,0,1,0|2,0,0]=4 3181 B12R1.124 CC(C(O)=O)c1[n]cccc1Br Amb25751488 [0,1,0,0,1,0|2,0,0]=4 3182 B12R1.124 CC(C(O)=O)c1[n]cccc1Cl Amb18822248 [0,1,0,0,1,0|2,0,0]=4 3183 B12R1.124 CC(C(O)=O)c1[n]cccc1F Amb25824753 [0,1,0,0,1,0|2,0,0]=4 3184 B12R1.124 CC(C(O)=O)c1cc[n]cc1Cl Amb25850310 [0,1,0,0,1,0|2,0,0]=4 3185 B12R1.124 CC(C(O)=O)c1cc[n]cc1F Amb25682826 [0,1,0,0,1,0|2,0,0]=4 3186 B12R1.124 CC(C)=C(C)c1ccccc1O Amb25767128 [0,1,0,0,1,0|1,0,1]=4 3187 B12R1.124 CC(Cl)C(C)c1ccccc1F Amb24474326 [0,1,0,0,1,0|1,0,1]=4 3188 B12R1.124 CC(c1ccccc1Br)[N+]([O-])=O Amb18753221 [0,1,0,0,1,0|2,0,0]=4 3189 B12R1.124 CC(c1ccccc1O)C(O)=O Amb22228079 [0,1,0,0,1,0|1,0,0]=3 3190 B12R1.124 CN(C(C)=O)[n]1ccccc1=S Amb24096743 [0,1,0,0,1,0|2,0,0]=4 3191 B12R1.124 CN(C(N)=O)c1ccccc1F Amb18788752 [0,1,0,0,1,0|2,0,0]=4 3192 B12R1.124 CN(C(N)=O)c1ccccc1O Amb18646492 [0,1,0,0,1,0|2,0,0]=4 3193 B12R1.124 CN(C(N)=O)c1ccccc1S Amb25095886 [0,1,0,0,1,0|2,0,0]=4 3194 B12R1.124 CN(C)C(C)c1ccccc1Br Amb25154604 [0,1,0,0,1,0|2,0,0]=4 3195 B12R1.124 CN(C)C(C)c1ccccc1S Amb24694175 [0,1,0,0,1,0|2,0,0]=4 3196 B12R1.124 CN(C)[C@@H](C)c1ccccc1O Amb25094366 [0,1,0,0,1,0|2,0,0]=4 3197 B12R1.124 CN(c1ccccc1N)C(N)=O Amb18279536 [0,1,0,0,1,0|2,0,0]=4 3198 B12R1.124 CN(c1ccccc1N)S(C)=O Amb24551837 [0,1,0,0,1,0|2,0,0]=4 3199 B12R1.124 CS(=O)C(C)c1ccccc1Cl Amb25188412 [0,1,0,0,1,0|1,0,0]=3 3200 B12R1.124 C[C@@H](O)[C@@H](C)c1ccccc1N Amb24695229 [0,1,0,0,1,0|0,0,2]=4 3201 B12R1.124 C[C@H](C(O)=O)c1ccccc1Cl Amb25222036 [0,1,0,0,1,0|1,0,0]=3 3202 B12R1.124 C[C@H](O)[C@@H](C)c1ccccc1N Amb24636832 [0,1,0,0,1,0|0,0,2]=4 3203 B12R1.124 Cc1c[n]ccc1C(N)C(C)=O Amb25128027 [0,1,0,0,1,0|2,0,0]=4 3204 B12R1.124 Cc1cc[n]cc1C(C)C(O)=O Amb25759366 [0,1,0,0,1,0|2,0,0]=4 3205 B12R1.124 Cc1ccc[n]c1C(C)C(O)=O Amb25710871 [0,1,0,0,1,0|2,0,0]=4 3206 B12R1.124 Cc1ccc[n]c1C(N)C(C)=O Amb24428767 [0,1,0,0,1,0|2,0,0]=4 3207 B12R1.124 Cc1ccccc1C(Br)C(O)=O Amb25136873 [0,1,0,0,1,0|2,0,0]=4 3208 B12R1.124 Cc1ccccc1C(C)C(=O)Cl Amb25152464 [0,1,0,0,1,0|1,0,0]=3 3209 B12R1.124 Cc1ccccc1C(C)C(C)=O Amb25204377 [0,1,0,0,1,0|0,0,0]=2 3210 B12R1.124 Cc1ccccc1C(C)C(C)N Amb24619318 [0,1,0,0,1,0|1,0,1]=4 3211 B12R1.124 Cc1ccccc1C(Cl)C(N)=O Amb19074653 [0,1,0,0,1,0|2,0,0]=4 3212 B12R1.124 Cc1ccccc1C(Cl)C(O)=O Amb18564301 [0,1,0,0,1,0|2,0,0]=4 3213 B12R1.124 Cc1ccccc1C(N)C(C)=O Amb25131697 [0,1,0,0,1,0|1,0,0]=3 3214 B12R1.124 Cc1ccccc1C(O)C(C)=O Amb25712931 [0,1,0,0,1,0|1,0,0]=3 3215 B12R1.124 Cc1ccccc1C(O)C(N)=O Amb18800897 [0,1,0,0,1,0|2,0,0]=4 3216 B12R1.124 Cc1ccccc1N(C)C(=O)Cl Amb25034673 [0,1,0,0,1,0|2,0,0]=4 3217 B12R1.124 Cc1ccccc1N(C)C(C)=O Amb24085648 [0,1,0,0,1,0|1,0,0]=3 3218 B12R1.124 Cc1ccccc1N(C)C(N)=O Amb18788281 [0,1,0,0,1,0|2,0,0]=4 3219 B12R1.124 Cc1ccccc1N(N)C(C)=O Amb18563636 [0,1,0,0,1,0|2,0,0]=4 3220 B12R1.124 Cc1ccccc1[C@@H](C)C(O)=O Amb24426211 [0,1,0,0,1,0|1,0,0]=3 3221 B12R1.124 Cc1ccccc1[C@@H](N)C(O)=O Amb17933183 [0,1,0,0,1,0|2,0,0]=4 3222 B12R1.124 Cc1ccccc1[C@@H](O)C(=O)Cl Amb24608093 [0,1,0,0,1,0|2,0,0]=4 3223 B12R1.124 Cc1ccccc1[C@@H](O)C(C)=O Amb24722864 [0,1,0,0,1,0|1,0,0]=3 3224 B12R1.124 Cc1ccccc1[C@H](C)C(O)=O Amb25798862 [0,1,0,0,1,0|1,0,0]=3 3225 B12R1.124 Cc1ccccc1[C@H](N)C(N)=O Amb24483792 [0,1,0,0,1,0|2,0,0]=4 3226 B12R1.124 NC(=O)C(Br)c1ccccc1Cl Amb25089052 [0,1,0,0,1,0|2,0,0]=4 3227 B12R1.124 NC(=O)C(Cl)c1ccccc1F Amb18329810 [0,1,0,0,1,0|2,0,0]=4 3228 B12R1.124 NC(=O)C(N)c1ccccc1Br Amb18282827 [0,1,0,0,1,0|2,0,0]=4 3229 B12R1.124 NC(=O)C(N)c1ccccc1F Amb19374457 [0,1,0,0,1,0|2,0,0]=4 3230 B12R1.124 NC(=O)C(N)c1ccccc1O Amb24391892 [0,1,0,0,1,0|2,0,0]=4 3231 B12R1.124 NC(=O)C(O)c1ccccc1Br Amb24123019 [0,1,0,0,1,0|2,0,0]=4 3232 B12R1.124 NC(=O)C(O)c1ccccc1Cl Amb19075671 [0,1,0,0,1,0|2,0,0]=4 3233 B12R1.124 NC(=O)C(O)c1ccccc1F Amb18806074 [0,1,0,0,1,0|2,0,0]=4 3234 B12R1.124 NC(=O)C(c1ccccc1C)N Amb17334617 [0,1,0,0,1,0|2,0,0]=4 3235 B12R1.124 NC(=O)C(c1ccccc1Cl)N Amb17335725 [0,1,0,0,1,0|2,0,0]=4 3236 B12R1.124 NC(=O)C(c1ccccc1F)N Amb17334710 [0,1,0,0,1,0|2,0,0]=4 3237 B12R1.124 NC(=O)[C@@H](N)c1ccccc1Cl Amb24483835 [0,1,0,0,1,0|2,0,0]=4 3238 B12R1.124 NC(=O)[C@@H](O)c1ccccc1Cl Amb22799808 [0,1,0,0,1,0|2,0,0]=4 3239 B12R1.124 NC(=O)[C@H](N)c1ccccc1O Amb25056722 [0,1,0,0,1,0|2,0,0]=4 3240 B12R1.124 NC(=O)[C@H](O)c1ccccc1Cl Amb24355348 [0,1,0,0,1,0|2,0,0]=4 3241 B12R1.124 NC(C(O)=O)c1ccccc1F Amb24331712 [0,1,0,0,1,0|2,0,0]=4 3242 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb23440362 [0,1,0,0,1,0|2,0,0]=4 3243 B12R1.124 N[C@@H](C(O)=O)c1ccccc1Br Amb25270086 [0,1,0,0,1,0|2,0,0]=4 3244 B12R1.124 N[C@@H](C(O)=O)c1ccccc1F Amb22747759 [0,1,0,0,1,0|2,0,0]=4 3245 B12R1.124 N[C@@H](C(O)=O)c1ccccc1I Amb25055265 [0,1,0,0,1,0|2,0,0]=4 3246 B12R1.124 N[C@@H](C(O)=O)c1ccccc1S Amb24649945 [0,1,0,0,1,0|2,0,0]=4 3247 B12R1.124 N[C@@H](c1ccccc1O)C(O)=O Amb22748113 [0,1,0,0,1,0|2,0,0]=4 3248 B12R1.124 N[C@H](C(O)=O)c1ccccc1I Amb24637866 [0,1,0,0,1,0|2,0,0]=4 3249 B12R1.124 N[C@H](c1ccccc1O)C(O)=O Amb25134608 [0,1,0,0,1,0|2,0,0]=4 3250 B12R1.124 Nc1ccccc1C(O)C(O)=O Amb18646669 [0,1,0,0,1,0|2,0,0]=4 3251 B12R1.124 Nc1ccccc1C(O)C([O-])=O Amb21963741 [0,1,0,0,1,0|2,0,0]=4 3252 B12R1.124 Nc1ccccc1[C@@H](N)C(O)=O Amb25700852 [0,1,0,0,1,0|2,0,0]=4 3253 B12R1.124 Nc1ccccc1[C@H](O)C(O)=O Amb24373910 [0,1,0,0,1,0|2,0,0]=4 3254 B12R1.124 O=C(Cl)C(Br)c1ccccc1Cl Amb24641573 [0,1,0,0,1,0|2,0,0]=4 3255 B12R1.124 OC(=O)C(Cl)c1ccccc1Br Amb24060809 [0,1,0,0,1,0|2,0,0]=4 3256 B12R1.124 OC(=O)C(Cl)c1ccccc1Cl Amb18066587 [0,1,0,0,1,0|2,0,0]=4 3257 B12R1.124 OC(=O)C(Cl)c1ccccc1F Amb18564556 [0,1,0,0,1,0|2,0,0]=4 3258 B12R1.124 OC(=O)C(O)c1ccccc1I Amb25117434 [0,1,0,0,1,0|2,0,0]=4 3259 B12R1.124 OC(=O)C(c1ccccc1Br)C Amb10844025 [0,1,0,0,1,0|1,0,0]=3 3260 B12R1.124 OC(=O)C(c1ccccc1Br)N Amb2234623 [0,1,0,0,1,0|2,0,0]=4 3261 B12R1.124 OC(=O)C(c1ccccc1C)N Amb1837192 [0,1,0,0,1,0|2,0,0]=4 3262 B12R1.124 OC(=O)C(c1ccccc1Cl)N Amb1841983 [0,1,0,0,1,0|2,0,0]=4 3263 B12R1.124 OC(=O)C(c1ccccc1F)C Amb10843985 [0,1,0,0,1,0|1,0,0]=3 3264 B12R1.124 OC(=O)C(c1ccccc1F)N Amb1837738 [0,1,0,0,1,0|2,0,0]=4 3265 B12R1.124 OC(=O)[C@@H](O)c1ccccc1F Amb22745223 [0,1,0,0,1,0|2,0,0]=4 3266 B12R1.124 OC(=O)[C@H](O)c1ccccc1F Amb24428765 [0,1,0,0,1,0|2,0,0]=4 3267 B12R1.124 [O-]C(=O)C(O)c1ccccc1F Amb22455226 [0,1,0,0,1,0|2,0,0]=4 3268 B12R1.225 Brc1cccc(c1)C(=O)C(=O)C Amb17406920 [0,1,0,0,1,0|1,0,1]=4 3269 B12R1.225 CC(=C)C(N)c1cccc(Cl)c1 Amb25150098 [0,1,0,0,1,0|2,0,0]=4 3270 B12R1.225 CC(=C)C(N)c1cccc(F)c1 Amb25241405 [0,1,0,0,1,0|2,0,0]=4 3271 B12R1.225 CC(=C)C(N)c1cccc(I)c1 Amb24354516 [0,1,0,0,1,0|2,0,0]=4 3272 B12R1.225 CC(=C)C(O)c1cccc(I)c1 Amb24660150 [0,1,0,0,1,0|2,0,0]=4 3273 B12R1.225 CC(=N)N(C)c1cccc(F)c1 Amb24343123 [0,1,0,0,1,0|2,0,0]=4 3274 B12R1.225 CC(=O)C(Br)c1cc(Br)[n]cc1 Amb25717635 [0,1,0,0,1,0|2,0,0]=4 3275 B12R1.225 CC(=O)C(Br)c1cccc(F)c1 Amb24537119 [0,1,0,0,1,0|1,0,0]=3 3276 B12R1.225 CC(=O)C(Br)c1cccc(O)c1 Amb25253266 [0,1,0,0,1,0|1,0,0]=3 3277 B12R1.225 CC(=O)C(C)c1cccc(Br)c1 Amb22753504 [0,1,0,0,1,0|0,0,0]=2 3278 B12R1.225 CC(=O)C(C)c1cccc(Cl)c1 Amb22753502 [0,1,0,0,1,0|0,0,0]=2 3279 B12R1.225 CC(=O)C(C)c1cccc(F)c1 Amb24430167 [0,1,0,0,1,0|0,0,0]=2 3280 B12R1.225 CC(=O)C(C)c1cccc(I)c1 Amb22753511 [0,1,0,0,1,0|0,0,0]=2 3281 B12R1.225 CC(=O)C(C)c1cccc(O)c1 Amb24537925 [0,1,0,0,1,0|0,0,0]=2 3282 B12R1.225 CC(=O)C(Cl)c1cccc(F)c1 Amb24541089 [0,1,0,0,1,0|1,0,0]=3 3283 B12R1.225 CC(=O)C(N)c1c[n]cc(Br)c1 Amb25375793 [0,1,0,0,1,0|2,0,0]=4 3284 B12R1.225 CC(=O)C(N)c1cc(Br)cc[n]1 Amb25111783 [0,1,0,0,1,0|2,0,0]=4 3285 B12R1.225 CC(=O)C(N)c1cc(N)ccc1 Amb24504677 [0,1,0,0,1,0|1,0,0]=3 3286 B12R1.225 CC(=O)C(N)c1cc[n]c(O)c1 Amb24460340 [0,1,0,0,1,0|2,0,0]=4 3287 B12R1.225 CC(=O)C(N)c1cccc(Cl)[n]1 Amb25259198 [0,1,0,0,1,0|2,0,0]=4 3288 B12R1.225 CC(=O)C(N)c1cccc(F)[n]1 Amb25843808 [0,1,0,0,1,0|2,0,0]=4 3289 B12R1.225 CC(=O)C(N)c1cccc(F)c1 Amb25076722 [0,1,0,0,1,0|1,0,0]=3 3290 B12R1.225 CC(=O)C(N)c1cccc(N)[n]1 Amb25709600 [0,1,0,0,1,0|2,0,0]=4 3291 B12R1.225 CC(=O)C(O)c1cccc(F)c1 Amb24706962 [0,1,0,0,1,0|1,0,0]=3 3292 B12R1.225 CC(=O)C(c1cccc(c1)Br)Cl Amb17477760 [0,1,0,0,1,0|1,0,0]=3 3293 B12R1.225 CC(=O)C(c1cccc(c1)C)Cl Amb17477625 [0,1,0,0,1,0|1,0,0]=3 3294 B12R1.225 CC(=O)C(c1cccc(c1)Cl)Cl Amb17477763 [0,1,0,0,1,0|1,0,0]=3 3295 B12R1.225 CC(=O)C(c1cccc(c1)Cl)O Amb17611032 [0,1,0,0,1,0|1,0,0]=3 3296 B12R1.225 CC(=O)C(c1cccc(c1)O)O Amb17594122 [0,1,0,0,1,0|1,0,0]=3 3297 B12R1.225 CC(=O)N(C)c1cc[n]c(Cl)c1 Amb24096486 [0,1,0,0,1,0|2,0,0]=4 3298 B12R1.225 CC(=O)N(C)c1cccc(Br)[n]1 Amb19959594 [0,1,0,0,1,0|2,0,0]=4 3299 B12R1.225 CC(=O)N(C)c1cccc(F)c1 Amb24607920 [0,1,0,0,1,0|1,0,0]=3 3300 B12R1.225 CC(=O)N(C)c1cccc(O)c1 Amb24432229 [0,1,0,0,1,0|1,0,0]=3 3301 B12R1.225 CC(=O)N(N)c1cccc(Br)c1 Amb18070415 [0,1,0,0,1,0|2,0,0]=4 3302 B12R1.225 CC(=O)N(N)c1cccc(Cl)c1 Amb18564311 [0,1,0,0,1,0|2,0,0]=4 3303 B12R1.225 CC(=O)N(N)c1cccc(F)c1 Amb18563835 [0,1,0,0,1,0|2,0,0]=4 3304 B12R1.225 CC(=O)[C@H](O)c1cc(O)ccc1 Amb25855760 [0,1,0,0,1,0|1,0,0]=3 3305 B12R1.225 CC(=O)[C@H](O)c1cccc(Cl)c1 Amb25832686 [0,1,0,0,1,0|1,0,0]=3 3306 B12R1.225 CC(Br)C(C)c1cccc(Cl)c1 Amb25071912 [0,1,0,0,1,0|1,0,1]=4 3307 B12R1.225 CC(C(=O)Cl)c1cccc(Br)c1 Amb25150116 [0,1,0,0,1,0|1,0,0]=3 3308 B12R1.225 CC(C(=O)Cl)c1cccc(F)c1 Amb25125145 [0,1,0,0,1,0|1,0,0]=3 3309 B12R1.225 CC(C(C)N)c1cc(Br)ccc1 Amb18161825 [0,1,0,0,1,0|1,0,1]=4 3310 B12R1.225 CC(C(C)N)c1cc(F)ccc1 Amb18199472 [0,1,0,0,1,0|1,0,1]=4 3311 B12R1.225 CC(C(C)N)c1cc(I)ccc1 Amb24581687 [0,1,0,0,1,0|1,0,1]=4 3312 B12R1.225 CC(C(C)O)c1cc(Cl)ccc1 Amb24363903 [0,1,0,0,1,0|0,0,2]=4 3313 B12R1.225 CC(C(C)O)c1cc(O)ccc1 Amb25674463 [0,1,0,0,1,0|0,0,2]=4 3314 B12R1.225 CC(C(N)=O)c1cccc(Br)c1 Amb25333205 [0,1,0,0,1,0|1,0,0]=3 3315 B12R1.225 CC(C(N)=O)c1cccc(F)c1 Amb25760785 [0,1,0,0,1,0|1,0,0]=3 3316 B12R1.225 CC(C(N)=O)c1cccc(O)c1 Amb24743243 [0,1,0,0,1,0|1,0,0]=3 3317 B12R1.225 CC(C(O)=O)c1c[n]cc(F)c1 Amb18961443 [0,1,0,0,1,0|2,0,0]=4 3318 B12R1.225 CC(C(O)=O)c1cc[n]c(Cl)c1 Amb25322122 [0,1,0,0,1,0|2,0,0]=4 3319 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb22265668 [0,1,0,0,1,0|1,0,0]=3 3320 B12R1.225 CC(C(O)=O)c1cccc(N)c1 Amb24061864 [0,1,0,0,1,0|1,0,0]=3 3321 B12R1.225 CC(C)C(C)c1cccc(Br)c1 Amb25091718 [0,1,0,0,1,0|1,0,1]=4 3322 B12R1.225 CC(c1cc(O)ccc1)C(O)=O Amb18646445 [0,1,0,0,1,0|1,0,0]=3 3323 B12R1.225 CN(C(=O)Cl)c1cccc(F)c1 Amb25735378 [0,1,0,0,1,0|2,0,0]=4 3324 B12R1.225 CN(C(N)=O)c1cccc(F)c1 Amb18788753 [0,1,0,0,1,0|2,0,0]=4 3325 B12R1.225 CN(C(N)=O)c1cccc(O)c1 Amb24356761 [0,1,0,0,1,0|2,0,0]=4 3326 B12R1.225 CN(C(c1cccc(c1)N)C)C Amb17090316 [0,1,0,0,1,0|2,0,0]=4 3327 B12R1.225 CN(C)C(C)c1cccc(Br)c1 Amb25257843 [0,1,0,0,1,0|2,0,0]=4 3328 B12R1.225 CN(C)C(C)c1cccc(F)c1 Amb25792131 [0,1,0,0,1,0|2,0,0]=4 3329 B12R1.225 CN(c1cc(N)ccc1)C(N)=O Amb18944888 [0,1,0,0,1,0|2,0,0]=4 3330 B12R1.225 CN(c1cccc(O)c1)S(C)=O Amb25177212 [0,1,0,0,1,0|2,0,0]=4 3331 B12R1.225 C[C@@H](C(O)=O)c1cccc(F)c1 Amb25108167 [0,1,0,0,1,0|1,0,0]=3 3332 B12R1.225 C[C@@H](C(O)=O)c1cccc(N)c1 Amb24182071 [0,1,0,0,1,0|1,0,0]=3 3333 B12R1.225 C[C@@H]([C@H](C)N)c1cc(O)ccc1 Amb25804222 [0,1,0,0,1,0|1,0,1]=4 3334 B12R1.225 C[C@H](C(N)=O)c1cccc(Cl)c1 Amb25730493 [0,1,0,0,1,0|1,0,0]=3 3335 B12R1.225 C[C@H](C(O)=O)c1cccc(Cl)c1 Amb25124032 [0,1,0,0,1,0|1,0,0]=3 3336 B12R1.225 C[C@H]([C@@H](C)O)c1cc(Cl)ccc1 Amb25803016 [0,1,0,0,1,0|0,0,2]=4 3337 B12R1.225 C[C@H](c1cc(O)ccc1)C(O)=O Amb24677825 [0,1,0,0,1,0|1,0,0]=3 3338 B12R1.225 Cc1c[n]cc(c1)C(N)C(C)=O Amb25189486 [0,1,0,0,1,0|2,0,0]=4 3339 B12R1.225 Cc1cc(cc[n]1)C(C)C(O)=O Amb24584555 [0,1,0,0,1,0|2,0,0]=4 3340 B12R1.225 Cc1cc(ccc1)C(Br)C(O)=O Amb25136874 [0,1,0,0,1,0|2,0,0]=4 3341 B12R1.225 Cc1cc(ccc1)C(C)C(=O)Cl Amb25152463 [0,1,0,0,1,0|1,0,0]=3 3342 B12R1.225 Cc1cc(ccc1)C(Cl)C(N)=O Amb19074652 [0,1,0,0,1,0|2,0,0]=4 3343 B12R1.225 Cc1cc(ccc1)C(Cl)C(O)=O Amb18564302 [0,1,0,0,1,0|2,0,0]=4 3344 B12R1.225 Cc1cc(ccc1)C(F)C(N)=O Amb25117936 [0,1,0,0,1,0|2,0,0]=4 3345 B12R1.225 Cc1cc(ccc1)C(O)C(=O)Cl Amb24095714 [0,1,0,0,1,0|2,0,0]=4 3346 B12R1.225 Cc1cc(ccc1)C(O)C(N)=O Amb18800895 [0,1,0,0,1,0|2,0,0]=4 3347 B12R1.225 Cc1cc(ccc1)N(C)C(N)=O Amb18788282 [0,1,0,0,1,0|2,0,0]=4 3348 B12R1.225 Cc1cc(ccc1)[C@@H](C)C(O)=O Amb25065324 [0,1,0,0,1,0|1,0,0]=3 3349 B12R1.225 Cc1cc(ccc1)[C@@H](F)C(N)=O Amb24399357 [0,1,0,0,1,0|2,0,0]=4 3350 B12R1.225 Cc1cc(ccc1)[C@@H](N)C(O)=O Amb24182070 [0,1,0,0,1,0|2,0,0]=4 3351 B12R1.225 Cc1cc(ccc1)[C@H]([NH3+])C([O-])=O Amb24068288 [0,1,0,0,1,0|2,0,0]=4 3352 B12R1.225 Cc1cc[n]c(c1)N(C)C(C)=O Amb24096748 [0,1,0,0,1,0|2,0,0]=4 3353 B12R1.225 Cc1cccc(c1)C(=O)C(=O)C Amb17400104 [0,1,0,0,1,0|1,0,1]=4 3354 B12R1.225 Cc1cccc(c1)C(C)C(C)Cl Amb25316621 [0,1,0,0,1,0|1,0,1]=4 3355 B12R1.225 Cc1cccc(c1)C(O)C(C)=O Amb25801127 [0,1,0,0,1,0|1,0,0]=3 3356 B12R1.225 Cc1cccc(c1)N(C)C(C)=O Amb24413264 [0,1,0,0,1,0|1,0,0]=3 3357 B12R1.225 Cc1cccc(c1)N(N)C(C)=O Amb18563637 [0,1,0,0,1,0|2,0,0]=4 3358 B12R1.225 Cc1cccc(c1)[C@@H](C)C(C)=O Amb25707020 [0,1,0,0,1,0|0,0,0]=2 3359 B12R1.225 Cc1cccc(c1)[C@@H](C)[C@@H](C)O Amb25357646 [0,1,0,0,1,0|0,0,2]=4 3360 B12R1.225 Cc1cccc(c1)[C@H](C)C(C)=O Amb25143362 [0,1,0,0,1,0|0,0,0]=2 3361 B12R1.225 Clc1cccc(c1)C(=O)C(=O)C Amb17400962 [0,1,0,0,1,0|1,0,1]=4 3362 B12R1.225 Fc1cccc(c1)C(=O)C(=O)C Amb17400193 [0,1,0,0,1,0|1,0,1]=4 3363 B12R1.225 NC(=O)C(Cl)c1cc(Cl)ccc1 Amb25089760 [0,1,0,0,1,0|2,0,0]=4 3364 B12R1.225 NC(=O)C(Cl)c1cccc(Br)c1 Amb22059075 [0,1,0,0,1,0|2,0,0]=4 3365 B12R1.225 NC(=O)C(Cl)c1cccc(F)c1 Amb18329808 [0,1,0,0,1,0|2,0,0]=4 3366 B12R1.225 NC(=O)C(N)c1cccc(Cl)c1 Amb22487627 [0,1,0,0,1,0|2,0,0]=4 3367 B12R1.225 NC(=O)C(N)c1cccc(F)c1 Amb18949669 [0,1,0,0,1,0|2,0,0]=4 3368 B12R1.225 NC(=O)C(O)c1cc(O)ccc1 Amb18805579 [0,1,0,0,1,0|2,0,0]=4 3369 B12R1.225 NC(=O)C(O)c1cccc(Br)c1 Amb24123026 [0,1,0,0,1,0|2,0,0]=4 3370 B12R1.225 NC(=O)C(O)c1cccc(Cl)c1 Amb19075670 [0,1,0,0,1,0|2,0,0]=4 3371 B12R1.225 NC(=O)C(O)c1cccc(F)c1 Amb18806072 [0,1,0,0,1,0|2,0,0]=4 3372 B12R1.225 NC(=O)C(O)c1cccc(I)c1 Amb24554086 [0,1,0,0,1,0|2,0,0]=4 3373 B12R1.225 NC(=O)C(c1cccc(c1)Br)N Amb13951644 [0,1,0,0,1,0|2,0,0]=4 3374 B12R1.225 NC(=O)C(c1cccc(c1)C)N Amb17334618 [0,1,0,0,1,0|2,0,0]=4 3375 B12R1.225 NC(=O)C(c1cccc(c1)Cl)N Amb17335726 [0,1,0,0,1,0|2,0,0]=4 3376 B12R1.225 NC(=O)C(c1cccc(c1)O)N Amb17334666 [0,1,0,0,1,0|2,0,0]=4 3377 B12R1.225 NC(=O)[C@H](O)c1cccc(Cl)c1 Amb24443861 [0,1,0,0,1,0|2,0,0]=4 3378 B12R1.225 NC(C(=O)Cl)c1cc(Cl)ccc1 Amb25764846 [0,1,0,0,1,0|2,0,0]=4 3379 B12R1.225 NC(c1cc(O)ccc1)C(O)=O Amb21959949 [0,1,0,0,1,0|2,0,0]=4 3380 B12R1.225 N[C@@H](C(O)=O)c1cccc(Br)c1 Amb25122869 [0,1,0,0,1,0|2,0,0]=4 3381 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb22899025 [0,1,0,0,1,0|2,0,0]=4 3382 B12R1.225 N[C@@H](C(O)=O)c1cccc(Cl)c1 Amb23399639 [0,1,0,0,1,0|2,0,0]=4 3383 B12R1.225 N[C@@H](C(O)=O)c1cccc(I)c1 Amb24342192 [0,1,0,0,1,0|2,0,0]=4 3384 B12R1.225 N[C@@H](C(O)=O)c1cccc(S)c1 Amb25361957 [0,1,0,0,1,0|2,0,0]=4 3385 B12R1.225 N[C@@H](c1cc(O)ccc1)C(O)=O Amb25294728 [0,1,0,0,1,0|2,0,0]=4 3386 B12R1.225 N[C@H](C(O)=O)c1cccc(Br)c1 Amb25150059 [0,1,0,0,1,0|2,0,0]=4 3387 B12R1.225 N[C@H](C(O)=O)c1cccc(Cl)c1 Amb19889600 [0,1,0,0,1,0|2,0,0]=4 3388 B12R1.225 Nc1cc(ccc1)C(N)C(O)=O Amb18646483 [0,1,0,0,1,0|2,0,0]=4 3389 B12R1.225 Nc1cc(ccc1)C(O)C(O)=O Amb18646668 [0,1,0,0,1,0|2,0,0]=4 3390 B12R1.225 Nc1cccc(c1)N(C(=O)C)C Amb10975760 [0,1,0,0,1,0|1,0,0]=3 3391 B12R1.225 O=C(Cl)C(F)c1cc(F)ccc1 Amb25689085 [0,1,0,0,1,0|2,0,0]=4 3392 B12R1.225 OC(=O)C(Br)c1cc(Br)ccc1 Amb25053820 [0,1,0,0,1,0|2,0,0]=4 3393 B12R1.225 OC(=O)C(Br)c1cccc(Cl)c1 Amb25302971 [0,1,0,0,1,0|2,0,0]=4 3394 B12R1.225 OC(=O)C(Cl)c1cc(Cl)ccc1 Amb18066588 [0,1,0,0,1,0|2,0,0]=4 3395 B12R1.225 OC(=O)C(Cl)c1cccc(Br)c1 Amb18582806 [0,1,0,0,1,0|2,0,0]=4 3396 B12R1.225 OC(=O)C(O)c1cccc(I)c1 Amb25223767 [0,1,0,0,1,0|2,0,0]=4 3397 B12R1.225 OC(=O)C(c1cccc(c1)Br)C Amb10602488 [0,1,0,0,1,0|1,0,0]=3 3398 B12R1.225 OC(=O)C(c1cccc(c1)Br)N Amb2431609 [0,1,0,0,1,0|2,0,0]=4 3399 B12R1.225 OC(=O)C(c1cccc(c1)C)C Amb17232469 [0,1,0,0,1,0|1,0,0]=3 3400 B12R1.225 OC(=O)C(c1cccc(c1)C)N Amb1840070 [0,1,0,0,1,0|2,0,0]=4 3401 B12R1.225 OC(=O)C(c1cccc(c1)Cl)N Amb1840776 [0,1,0,0,1,0|2,0,0]=4 3402 B12R1.225 OC(=O)C(c1cccc(c1)F)C Amb17232662 [0,1,0,0,1,0|1,0,0]=3 3403 B12R1.225 OC(=O)C(c1cccc(c1)F)N Amb2431604 [0,1,0,0,1,0|2,0,0]=4 3404 B12R1.225 OC(=O)[C@@H](O)c1cccc(Cl)c1 Amb22388644 [0,1,0,0,1,0|2,0,0]=4 3405 B12R1.225 OC(=O)[C@@H](O)c1cccc(F)c1 Amb24429173 [0,1,0,0,1,0|2,0,0]=4 3406 B12R1.225 OC(=O)[C@H](O)c1cccc(Br)c1 Amb24604441 [0,1,0,0,1,0|2,0,0]=4 3407 B12R1.225 OC(=O)[C@H](O)c1cccc(Cl)c1 Amb22351582 [0,1,0,0,1,0|2,0,0]=4 3408 B12R1.225 OC(C(=O)Cl)c1cccc(F)c1 Amb24068439 [0,1,0,0,1,0|2,0,0]=4 3409 B12R1.225 Oc1cccc(c1)C(S)C(O)=O Amb25295477 [0,1,0,0,1,0|2,0,0]=4 3410 B12R1.225 Oc1cccc(c1)[C@@H](O)C(O)=O Amb25036246 [0,1,0,0,1,0|2,0,0]=4 3411 B12R1.253 CC(=C)C(C)(N)c1ccccc1 Amb18645556 [0,1,0,0,1,0|1,0,0]=3 3412 B12R1.253 CC(=O)C(C)(N)c1ccccc1 Amb24738601 [0,1,0,0,1,0|0,0,0]=2 3413 B12R1.253 CC(=O)C(F)(F)c1ccc[n]c1 Amb25770743 [0,1,0,0,1,0|2,0,0]=4 3414 B12R1.253 CC(=O)C(F)(F)c1cccc[n]1 Amb24414131 [0,1,0,0,1,0|2,0,0]=4 3415 B12R1.253 CC(=O)C(F)(F)c1ccccc1 Amb24105402 [0,1,0,0,1,0|1,0,0]=3 3416 B12R1.253 CC(=O)C(c1cccnc1)(O)C Amb1084728 [0,1,0,0,1,0|1,0,0]=3 3417 B12R1.253 CC(Br)(C(O)=O)c1ccccc1 Amb18135055 [0,1,0,0,1,0|1,0,0]=3 3418 B12R1.253 CC(C)(C(N)=S)c1ccccc1 Amb18791064 [0,1,0,0,1,0|1,1,0]=4 3419 B12R1.253 CC(C)(C(O)=O)c1cc[n]cc1 Amb18828397 [0,1,0,0,1,0|2,0,0]=4 3420 B12R1.253 CC(C)(C(O)=O)c1ccc[n]c1 Amb18285914 [0,1,0,0,1,0|2,0,0]=4 3421 B12R1.253 CC(C)(C(O)=O)c1cccc[n]1 Amb19930001 [0,1,0,0,1,0|2,0,0]=4 3422 B12R1.253 CC(C)(C(O)=O)c1ccccc1 Amb17773441 [0,1,0,0,1,0|1,0,0]=3 3423 B12R1.253 CC(C)(C([O-])=O)c1cccc[n]1 Amb19944551 [0,1,0,0,1,0|2,0,0]=4 3424 B12R1.253 CC(C)(C([O-])=O)c1ccncc1 Amb17748502 [0,1,0,0,1,0|2,0,0]=4 3425 B12R1.253 CC(C)[C@@](C)(N)c1ccccc1 Amb19889809 [0,1,0,0,1,0|1,0,1]=4 3426 B12R1.253 CC(Cl)(C(O)=O)c1ccccc1 Amb18649035 [0,1,0,0,1,0|1,0,0]=3 3427 B12R1.253 CC(F)(C(N)=O)c1cccc[n]1 Amb22547024 [0,1,0,0,1,0|2,0,0]=4 3428 B12R1.253 CC(F)(C(N)=O)c1ccccc1 Amb22547011 [0,1,0,0,1,0|1,0,0]=3 3429 B12R1.253 CC(F)(C(O)=O)c1ccccc1 Amb22547630 [0,1,0,0,1,0|1,0,0]=3 3430 B12R1.253 CC(F)C(C)(N)c1ccccc1 Amb24381495 [0,1,0,0,1,0|1,0,1]=4 3431 B12R1.253 CC(N)(c1c[n]ccc1)C(N)=O Amb18281146 [0,1,0,0,1,0|2,0,0]=4 3432 B12R1.253 CC(N)(c1cc[n]cc1)C(N)=O Amb18949666 [0,1,0,0,1,0|2,0,0]=4 3433 B12R1.253 CC(N)(c1cccc[n]1)C(N)=O Amb18949664 [0,1,0,0,1,0|2,0,0]=4 3434 B12R1.253 CC(N)C(C)(F)c1ccccc1 Amb25152439 [0,1,0,0,1,0|1,0,1]=4 3435 B12R1.253 CC(N)C(C)(O)c1ccccc1 Amb22460632 [0,1,0,0,1,0|1,0,1]=4 3436 B12R1.253 CC(O)(C(N)=O)c1cc[n]cc1 Amb18801016 [0,1,0,0,1,0|2,0,0]=4 3437 B12R1.253 CC(O)(C(N)=O)c1ccc[n]c1 Amb18801015 [0,1,0,0,1,0|2,0,0]=4 3438 B12R1.253 CC(O)(C(N)=O)c1cccc[n]1 Amb18801014 [0,1,0,0,1,0|2,0,0]=4 3439 B12R1.253 CC(O)(c1c[n]ccc1)C(O)=O Amb18951996 [0,1,0,0,1,0|2,0,0]=4 3440 B12R1.253 CC(O)(c1cc[n]cc1)C(O)=O Amb18952010 [0,1,0,0,1,0|2,0,0]=4 3441 B12R1.253 CC(O)(c1cccc[n]1)C(O)=O Amb18952001 [0,1,0,0,1,0|2,0,0]=4 3442 B12R1.253 CC(O)(c1cccc[sH]1)C(O)=O Amb22547022 [0,1,0,0,1,0|2,0,0]=4 3443 B12R1.253 CC(O)(c1ccccc1)C(O)=O Amb22347941 [0,1,0,0,1,0|1,0,0]=3 3444 B12R1.253 CC(O)C(C)(C)c1ccccc1 Amb18177805 [0,1,0,0,1,0|0,0,2]=4 3445 B12R1.253 CC(O)C(C)(N)c1ccccc1 Amb24678253 [0,1,0,0,1,0|0,0,2]=4 3446 B12R1.253 CN(C)C(C)(C)c1ccccc1 Amb25052796 [0,1,0,0,1,0|2,0,0]=4 3447 B12R1.253 CS(=O)C(C)(C)c1ccccc1 Amb24388215 [0,1,0,0,1,0|1,0,0]=3 3448 B12R1.253 C[C@@H](F)[C@](C)(N)c1ccccc1 Amb25152323 [0,1,0,0,1,0|1,0,1]=4 3449 B12R1.253 C[C@@H](N)C(C)(C)c1ccccc1 Amb25751364 [0,1,0,0,1,0|1,0,1]=4 3450 B12R1.253 C[C@@H](N)C(C)(F)c1ccccc1 Amb25090887 [0,1,0,0,1,0|1,0,1]=4 3451 B12R1.253 C[C@@H](N)[C@@](C)(F)c1ccccc1 Amb25106861 [0,1,0,0,1,0|1,0,1]=4 3452 B12R1.253 C[C@@H](N)[C@@](C)(N)c1ccccc1 Amb25212905 [0,1,0,0,1,0|1,0,1]=4 3453 B12R1.253 C[C@@H](N)[C@@](C)(O)c1ccccc1 Amb25068831 [0,1,0,0,1,0|1,0,1]=4 3454 B12R1.253 C[C@@H](N)[C@](C)(O)c1ccccc1 Amb25360926 [0,1,0,0,1,0|1,0,1]=4 3455 B12R1.253 C[C@@H](O)C(C)(C)c1ccccc1 Amb24459428 [0,1,0,0,1,0|0,0,2]=4 3456 B12R1.253 C[C@@H](O)[C@@](C)(O)c1ccccc1 Amb24421586 [0,1,0,0,1,0|0,0,2]=4 3457 B12R1.253 C[C@@H](O)[C@](C)(F)c1ccccc1 Amb25234752 [0,1,0,0,1,0|0,0,2]=4 3458 B12R1.253 C[C@@H](O)[C@](C)(O)c1ccccc1 Amb25098651 [0,1,0,0,1,0|0,0,2]=4 3459 B12R1.253 C[C@@](F)(C(O)=O)c1ccccc1 Amb25279569 [0,1,0,0,1,0|1,0,0]=3 3460 B12R1.253 C[C@@](N)(C(O)=O)c1ccc[n]c1 Amb24716336 [0,1,0,0,1,0|2,0,0]=4 3461 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22225774 [0,1,0,0,1,0|1,0,0]=3 3462 B12R1.253 C[C@@](N)(C(O)=O)c1ccccc1 Amb22747027 [0,1,0,0,1,0|1,0,0]=3 3463 B12R1.253 C[C@@](N)(c1ccccc1)C(N)=O Amb24341528 [0,1,0,0,1,0|1,0,0]=3 3464 B12R1.253 C[C@@](O)(C(N)=N)c1ccccc1 Amb25061216 [0,1,0,0,1,0|2,0,0]=4 3465 B12R1.253 C[C@@](O)(C(N)=O)c1ccccc1 Amb24595768 [0,1,0,0,1,0|1,0,0]=3 3466 B12R1.253 C[C@H](N)[C@@](C)(N)c1ccccc1 Amb24468395 [0,1,0,0,1,0|1,0,1]=4 3467 B12R1.253 C[C@H](N)[C@](C)(F)c1ccccc1 Amb25320985 [0,1,0,0,1,0|1,0,1]=4 3468 B12R1.253 C[C@H](O)C(C)(C)c1ccccc1 Amb24461815 [0,1,0,0,1,0|0,0,2]=4 3469 B12R1.253 C[C@H](O)[C@@](C)(F)c1ccccc1 Amb25356375 [0,1,0,0,1,0|0,0,2]=4 3470 B12R1.253 C[C@](F)(C(O)=O)c1ccccc1 Amb25100972 [0,1,0,0,1,0|1,0,0]=3 3471 B12R1.253 C[C@](N)(C(O)=O)c1cc[n]cc1 Amb24341761 [0,1,0,0,1,0|2,0,0]=4 3472 B12R1.253 C[C@](N)(C(O)=O)c1cccc[n]1 Amb24562027 [0,1,0,0,1,0|2,0,0]=4 3473 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb19929597 [0,1,0,0,1,0|1,0,0]=3 3474 B12R1.253 C[C@](N)(C(O)=O)c1ccccc1 Amb25692685 [0,1,0,0,1,0|1,0,0]=3 3475 B12R1.253 C[C@](N)(c1ccccc1)C(N)=O Amb25374916 [0,1,0,0,1,0|1,0,0]=3 3476 B12R1.253 C[C@](O)(c1ccccc1)C(O)=O Amb22226510 [0,1,0,0,1,0|1,0,0]=3 3477 B12R1.253 C[Si](C)(C(N)=O)c1ccccc1 Amb24497249 [0,1,0,0,1,0|1,1,0]=4 3478 B12R1.253 NC(=O)C(c1ccccc1)(F)F Amb1104586 [0,1,0,0,1,0|2,0,0]=4 3479 B12R1.253 NC(=O)C(c1ccccc1)(N)C Amb13952027 [0,1,0,0,1,0|1,0,0]=3 3480 B12R1.253 NC(O)(c1ccccc1)C(O)=O Amb24092513 [0,1,0,0,1,0|2,0,0]=4 3481 B12R1.253 O=C(F)C(F)(F)c1ccccc1 Amb25108603 [0,1,0,0,1,0|2,0,0]=4 3482 B12R1.253 OC(=O)C(Cl)(Br)c1ccccc1 Amb25679634 [0,1,0,0,1,0|2,0,0]=4 3483 B12R1.253 OC(=O)C(Cl)(Cl)c1ccccc1 Amb25674448 [0,1,0,0,1,0|2,0,0]=4 3484 B12R1.253 OC(=O)C(F)(Cl)c1ccccc1 Amb24532752 [0,1,0,0,1,0|2,0,0]=4 3485 B12R1.253 OC(=O)C(O)(O)c1ccccc1 Amb25684790 [0,1,0,0,1,0|2,0,0]=4 3486 B12R1.253 OC(=O)C(c1ccccc1)(F)F Amb1197472 [0,1,0,0,1,0|2,0,0]=4 3487 B12R1.253 OC(=O)C(c1ccccc1)(N)C Amb10711147 [0,1,0,0,1,0|1,0,0]=3 3488 B12R1.253 [2H]C([2H])(C(O)=O)c1ccccc1 Amb22353301 [0,1,0,0,1,0|2,0,0]=4 3489 B12R1.478 BrCC(c1ccccc1)C(C)C Amb17247625 [0,1,0,0,1,0|1,0,1]=4 3490 B12R1.478 C=CC(C(N)=O)c1ccccc1 Amb25361995 [0,1,0,0,1,0|1,0,1]=4 3491 B12R1.478 C=CC(C(O)=O)c1ccccc1 Amb18645652 [0,1,0,0,1,0|1,0,1]=4 3492 B12R1.478 C=NC(C(O)=O)c1ccccc1 Amb24068840 [0,1,0,0,1,0|1,0,1]=4 3493 B12R1.478 CC(=C)C(NC)c1c[n]ccc1 Amb25091471 [0,1,0,0,1,0|2,0,0]=4 3494 B12R1.478 CC(=C)C(NN)c1ccccc1 Amb24438127 [0,1,0,0,1,0|2,0,0]=4 3495 B12R1.478 CC(=C)[C@@H](CO)c1ccccc1 Amb25157975 [0,1,0,0,1,0|1,0,0]=3 3496 B12R1.478 CC(=O)C(/c1ccccc1)=C\N Amb17777807 [0,1,0,0,1,0|0,0,2]=4 3497 B12R1.478 CC(=O)C(=C=O)c1ccccc1 Amb25730145 [0,1,0,0,1,0|0,0,2]=4 3498 B12R1.478 CC(=O)C(=[N+]=[N-])c1ccccc1 Amb17593995 [0,1,0,0,1,0|1,0,1]=4 3499 B12R1.478 CC(=O)C(C=C)c1ccccc1 Amb24736196 [0,1,0,0,1,0|0,0,1]=3 3500 B12R1.478 CC(=O)C(C=N)c1ccccc1 Amb21952033 [0,1,0,0,1,0|0,0,1]=3 3501 B12R1.478 CC(=O)C(C=O)c1ccccc1 Amb18126328 [0,1,0,0,1,0|0,0,1]=3 3502 B12R1.478 CC(=O)C(CC)c1c[n]ccc1 Amb24448949 [0,1,0,0,1,0|1,0,0]=3 3503 B12R1.478 CC(=O)C(CC)c1cc[n]cc1 Amb25354421 [0,1,0,0,1,0|1,0,0]=3 3504 B12R1.478 CC(=O)C(CCl)c1ccccc1 Amb24565751 [0,1,0,0,1,0|0,0,0]=2 3505 B12R1.478 CC(=O)C(CN)c1ccccc1 Amb25148601 [0,1,0,0,1,0|0,0,0]=2 3506 B12R1.478 CC(=O)C(CO)c1ccccc1 Amb21962499 [0,1,0,0,1,0|0,0,0]=2 3507 B12R1.478 CC(=O)C(N=O)c1ccccc1 Amb25322912 [0,1,0,0,1,0|1,0,0]=3 3508 B12R1.478 CC(=O)C(OC)c1c[n]ccc1 Amb25115527 [0,1,0,0,1,0|1,0,0]=3 3509 B12R1.478 CC(=O)N(C=C)c1ccccc1 Amb24563080 [0,1,0,0,1,0|1,0,1]=4 3510 B12R1.478 CC(=O)N(CC)c1c[n]ccc1 Amb25069485 [0,1,0,0,1,0|2,0,0]=4 3511 B12R1.478 CC(=O)\C(=C\C)\c1ccccc1 Amb24378467 [0,1,0,0,1,0|0,0,1]=3 3512 B12R1.478 CC(=O)\C(=C\N)\c1ccccc1 Amb25238332 [0,1,0,0,1,0|0,0,2]=4 3513 B12R1.478 CC(=O)\C(=N\O)\c1ccccc1 Amb24700799 [0,1,0,0,1,0|1,0,1]=4 3514 B12R1.478 CC(=S)N(CC)c1ccccc1 Amb24096611 [0,1,0,0,1,0|1,1,0]=4 3515 B12R1.478 CC(C)=C(NC)c1ccccc1 Amb24443878 [0,1,0,0,1,0|1,0,1]=4 3516 B12R1.478 CC(C)C(CC)c1ccccc1 Amb25281082 [0,1,0,0,1,0|1,0,1]=4 3517 B12R1.478 CC(C)C(OC)c1ccccc1 Amb23568503 [0,1,0,0,1,0|1,0,1]=4 3518 B12R1.478 CC(C)[C@@H](CCl)c1ccccc1 Amb24426185 [0,1,0,0,1,0|1,0,1]=4 3519 B12R1.478 CC(C)[C@@H](CN)c1ccccc1 Amb25072543 [0,1,0,0,1,0|1,0,1]=4 3520 B12R1.478 CC(C)[C@H](CO)c1ccccc1 Amb25333656 [0,1,0,0,1,0|1,0,1]=4 3521 B12R1.478 CC(N)C(CC)c1ccccc1 Amb25667182 [0,1,0,0,1,0|1,0,1]=4 3522 B12R1.478 CC(N)C(CO)c1ccccc1 Amb25159957 [0,1,0,0,1,0|1,0,1]=4 3523 B12R1.478 CC(N)C(OC)c1ccccc1 Amb18980113 [0,1,0,0,1,0|1,0,1]=4 3524 B12R1.478 CC(N)C(SC)c1ccccc1 Amb18980114 [0,1,0,0,1,0|1,0,1]=4 3525 B12R1.478 CC(O)C(NC)c1ccccc1 Amb18646387 [0,1,0,0,1,0|0,0,2]=4 3526 B12R1.478 CC(O)C(OC)c1ccccc1 Amb25700350 [0,1,0,0,1,0|0,0,2]=4 3527 B12R1.478 CC(O)C(SC)c1ccccc1 Amb25796298 [0,1,0,0,1,0|0,0,2]=4 3528 B12R1.478 CCC(C(N)=N)c1ccccc1 Amb24726150 [0,1,0,0,1,0|2,0,0]=4 3529 B12R1.478 CCC(C(O)=O)c1ccc[n]c1 Amb18999434 [0,1,0,0,1,0|2,0,0]=4 3530 B12R1.478 CCC(C(O)=O)c1cccc[n]1 Amb25116759 [0,1,0,0,1,0|2,0,0]=4 3531 B12R1.478 CCC(c1ccccc1)[N+]([O-])=O Amb24730815 [0,1,0,0,1,0|2,0,0]=4 3532 B12R1.478 CCN(c1ccccc1)C(=O)Cl Amb17563104 [0,1,0,0,1,0|2,0,0]=4 3533 B12R1.478 CCN(c1ccccc1)C(=O)N Amb1138727 [0,1,0,0,1,0|2,0,0]=4 3534 B12R1.478 CC[C@@H](C(=O)Cl)c1ccccc1 Amb25207875 [0,1,0,0,1,0|1,0,0]=3 3535 B12R1.478 CC[C@@H](C(N)=O)c1ccccc1 Amb25034606 [0,1,0,0,1,0|1,0,0]=3 3536 B12R1.478 CC[C@@H](c1ccccc1)N(C)C Amb24385295 [0,1,0,0,1,0|2,0,0]=4 3537 B12R1.478 CN(C)[C@@H](CN)c1ccccc1 Amb24649763 [0,1,0,0,1,0|2,0,0]=4 3538 B12R1.478 CN(C)[C@@H](CO)c1ccccc1 Amb25859368 [0,1,0,0,1,0|2,0,0]=4 3539 B12R1.478 CN(C)[C@H](CCl)c1ccccc1 Amb25053864 [0,1,0,0,1,0|2,0,0]=4 3540 B12R1.478 CN(N)C(CO)c1ccccc1 Amb25357517 [0,1,0,0,1,0|2,0,0]=4 3541 B12R1.478 CNC(C(O)=O)c1cc[n]cc1 Amb23555580 [0,1,0,0,1,0|2,0,0]=4 3542 B12R1.478 CNC(C(O)=O)c1cccc[n]1 Amb25159848 [0,1,0,0,1,0|2,0,0]=4 3543 B12R1.478 CNC(C(O)=O)c1ccccc1 Amb19346335 [0,1,0,0,1,0|1,0,0]=3 3544 B12R1.478 CNC(c1ccccc1)C(=O)N Amb17334616 [0,1,0,0,1,0|1,0,0]=3 3545 B12R1.478 CNC(c1ccccn1)C(=O)N Amb17334638 [0,1,0,0,1,0|2,0,0]=4 3546 B12R1.478 CNC(c1cccnc1)C(=O)N Amb17334639 [0,1,0,0,1,0|2,0,0]=4 3547 B12R1.478 CNC(c1ccncc1)C(=O)N Amb17334640 [0,1,0,0,1,0|2,0,0]=4 3548 B12R1.478 CN[C@@H](c1ccccc1)C(=O)O Amb16183859 [0,1,0,0,1,0|1,0,0]=3 3549 B12R1.478 CN[C@H](c1ccccc1)C(=O)O Amb16183947 [0,1,0,0,1,0|1,0,0]=3 3550 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb23440840 [0,1,0,0,1,0|1,0,0]=3 3551 B12R1.478 COC(C([O-])=O)c1ccccc1 Amb24325342 [0,1,0,0,1,0|1,0,0]=3 3552 B12R1.478 COC(c1ccccc1)C(=O)C Amb10562726 [0,1,0,0,1,0|0,0,0]=2 3553 B12R1.478 COC(c1ccccc1)C(=O)N Amb10769824 [0,1,0,0,1,0|1,0,0]=3 3554 B12R1.478 COC(c1ccccc1)C(=O)O Amb2099459 [0,1,0,0,1,0|1,0,0]=3 3555 B12R1.478 CO[C@@H](C(N)=O)c1ccccc1 Amb25363386 [0,1,0,0,1,0|1,0,0]=3 3556 B12R1.478 CS(=O)[C@@H](CO)c1ccccc1 Amb25831961 [0,1,0,0,1,0|1,0,0]=3 3557 B12R1.478 CSC(C(N)=O)c1ccccc1 Amb25066103 [0,1,0,0,1,0|1,0,0]=3 3558 B12R1.478 CSC(C(O)=O)c1ccccc1 Amb18971615 [0,1,0,0,1,0|1,0,0]=3 3559 B12R1.478 C[C@@H](Cl)[C@@H](OC)c1ccccc1 Amb24390884 [0,1,0,0,1,0|1,0,1]=4 3560 B12R1.478 C[C@@H](O)[C@@H](CC)c1ccccc1 Amb25347649 [0,1,0,0,1,0|0,0,2]=4 3561 B12R1.478 C[C@@H](O)[C@@H](CN)c1ccccc1 Amb24627923 [0,1,0,0,1,0|0,0,2]=4 3562 B12R1.478 C[C@@H](O)[C@@H](SC)c1ccccc1 Amb25332276 [0,1,0,0,1,0|0,0,2]=4 3563 B12R1.478 C[C@H](Cl)[C@@H](OC)c1ccccc1 Amb24726335 [0,1,0,0,1,0|1,0,1]=4 3564 B12R1.478 C[C@H](N)C(OC)c1ccccc1 Amb25106860 [0,1,0,0,1,0|1,0,1]=4 3565 B12R1.478 C[C@H](N)[C@@H](OC)c1ccccc1 Amb25309446 [0,1,0,0,1,0|1,0,1]=4 3566 B12R1.478 C[C@H](N)[C@H](CN)c1ccccc1 Amb25132197 [0,1,0,0,1,0|1,0,1]=4 3567 B12R1.478 C[C@H](N)[C@H](OC)c1ccccc1 Amb24594937 [0,1,0,0,1,0|1,0,1]=4 3568 B12R1.478 C[C@H](O)[C@@H](CO)c1ccccc1 Amb25179958 [0,1,0,0,1,0|0,0,2]=4 3569 B12R1.478 C[C@H](O)[C@@H](OC)c1ccccc1 Amb24403890 [0,1,0,0,1,0|0,0,2]=4 3570 B12R1.478 C[C@H](O)[C@H](CC)c1ccccc1 Amb24497690 [0,1,0,0,1,0|0,0,2]=4 3571 B12R1.478 C[C@H](O)[C@H](NC)c1ccccc1 Amb24341991 [0,1,0,0,1,0|0,0,2]=4 3572 B12R1.478 C\N=C(\C(O)=O)/c1ccccc1 Amb24652432 [0,1,0,0,1,0|1,0,1]=4 3573 B12R1.478 ClCC(c1ccccc1)C(C)C Amb17233967 [0,1,0,0,1,0|1,0,1]=4 3574 B12R1.478 ClCC(c1ccccc1)N(C)C Amb17234042 [0,1,0,0,1,0|2,0,0]=4 3575 B12R1.478 N#CC(c1ccccc1)C(=O)C Amb2504502 [0,1,0,0,1,0|0,0,1]=3 3576 B12R1.478 N#CC(c1ccccc1)C(=O)O Amb1783147 [0,1,0,0,1,0|1,0,1]=4 3577 B12R1.478 NC(=N)C(CO)c1ccccc1 Amb25061991 [0,1,0,0,1,0|2,0,0]=4 3578 B12R1.478 NC(=O)C(C#N)c1ccccc1 Amb18787947 [0,1,0,0,1,0|1,0,1]=4 3579 B12R1.478 NC(=O)C(CN)c1cccc[n]1 Amb23571970 [0,1,0,0,1,0|2,0,0]=4 3580 B12R1.478 NC(=O)C(CN)c1ccccc1 Amb18999177 [0,1,0,0,1,0|1,0,0]=3 3581 B12R1.478 NC(=O)C(CO)c1ccccc1 Amb22233190 [0,1,0,0,1,0|1,0,0]=3 3582 B12R1.478 NC(=O)C(NO)c1ccccc1 Amb24373087 [0,1,0,0,1,0|2,0,0]=4 3583 B12R1.478 NCC(c1ccccc1)N(C)C Amb1216534 [0,1,0,0,1,0|2,0,0]=4 3584 B12R1.478 NCC(c1ccccn1)C(=O)O Amb17400194 [0,1,0,0,1,0|2,0,0]=4 3585 B12R1.478 NCC(c1ccncc1)C(=O)O Amb17400195 [0,1,0,0,1,0|2,0,0]=4 3586 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22756742 [0,1,0,0,1,0|1,0,0]=3 3587 B12R1.478 NC[C@@H](C(O)=O)c1ccccc1 Amb22757442 [0,1,0,0,1,0|1,0,0]=3 3588 B12R1.478 NC[C@H](C(O)=O)c1ccccc1 Amb24674068 [0,1,0,0,1,0|1,0,0]=3 3589 B12R1.478 NNC(c1ccccc1)C(=O)O Amb17400196 [0,1,0,0,1,0|2,0,0]=4 3590 B12R1.478 NN[C@@H](C(O)=O)c1ccccc1 Amb24562213 [0,1,0,0,1,0|2,0,0]=4 3591 B12R1.478 NN[C@H](C(O)=O)c1ccccc1 Amb25132135 [0,1,0,0,1,0|2,0,0]=4 3592 B12R1.478 O=C(Cl)C(CCl)c1ccccc1 Amb25159574 [0,1,0,0,1,0|1,0,0]=3 3593 B12R1.478 OC(=O)C(CBr)c1ccccc1 Amb24097514 [0,1,0,0,1,0|1,0,0]=3 3594 B12R1.478 OC(=O)C(CCl)c1ccccc1 Amb24099910 [0,1,0,0,1,0|1,0,0]=3 3595 B12R1.478 OC(=O)C(CF)c1ccccc1 Amb25201999 [0,1,0,0,1,0|1,0,0]=3 3596 B12R1.478 OC(=O)C(CS)c1ccccc1 Amb18303086 [0,1,0,0,1,0|1,0,0]=3 3597 B12R1.478 OC(=O)[C@@H](CF)c1ccccc1 Amb24470137 [0,1,0,0,1,0|1,0,0]=3 3598 B12R1.478 OC(=O)[C@@H](CO)c1ccccc1 Amb25109240 [0,1,0,0,1,0|1,0,0]=3 3599 B12R1.478 OC(=O)[C@H](NO)c1ccccc1 Amb25700967 [0,1,0,0,1,0|2,0,0]=4 3600 B12R1.478 OCC(c1ccccc1)N(C)C Amb17232542 [0,1,0,0,1,0|2,0,0]=4 3601 B12R1.478 [C-]#[N+]C(C(O)=O)c1ccccc1 Amb25290234 [0,1,0,0,1,0|1,0,1]=4 3602 B12R1.478 [C@H](C)(O)C(CC)c1ccccc1 Amb17678947 [0,1,0,0,1,0|0,0,2]=4 3603 B12R1.478 [NH3+]CC(C(O)=O)c1ccccc1 Amb22546483 [0,1,0,0,1,0|1,0,0]=3 3604 B12R1.478 [O-]\C=C(\c1ccccc1)/C(=O)C Amb10553866 [0,1,0,0,1,0|0,0,2]=4 3605 B12R1.564 CC(C(N)(C)C)c1ccccc1 Amb17594058 [0,1,0,0,1,0|1,0,1]=4 3606 B12R1.564 CC(P(=O)(O)O)c1ccccc1 Amb10975962 [0,1,0,0,1,0|2,0,0]=4 3607 B12R1.564 CC(c1c[n]ccc1)S(C)(=O)=O Amb24380360 [0,1,0,0,1,0|2,0,0]=4 3608 B12R1.564 CC(c1ccccc1)C(C)(C)C Amb24579473 [0,1,0,0,1,0|1,0,1]=4 3609 B12R1.564 CC(c1ccccc1)C(C)(C)N Amb22057442 [0,1,0,0,1,0|1,0,1]=4 3610 B12R1.564 CC(c1ccccc1)S(=O)(=O)Cl Amb22752088 [0,1,0,0,1,0|2,0,0]=4 3611 B12R1.564 CC(c1ccccc1)S(=O)(=O)F Amb24761366 [0,1,0,0,1,0|2,0,0]=4 3612 B12R1.564 CC(c1ccccc1)S(N)(=O)=O Amb19075244 [0,1,0,0,1,0|2,0,0]=4 3613 B12R1.564 CC(c1ccccc1)[N+](C)(C)C Amb22359327 [0,1,0,0,1,0|2,0,0]=4 3614 B12R1.564 CC(c1ccccc1)[N+](C)(C)C Amb22360591 [0,1,0,0,1,0|2,0,0]=4 3615 B12R1.564 CP(O)(=O)C(N)c1ccccc1 Amb25772757 [0,1,0,0,1,0|2,0,0]=4 3616 B12R1.564 C[C@H](c1ccccc1)C(C)(C)N Amb24678916 [0,1,0,0,1,0|1,0,1]=4 3617 B12R1.15 BrCC(=O)NC(c1ccco1)C Amb17330601 [0,1,0,0,1,0|2,0,0]=4 3618 B12R1.15 BrCC(=O)NC(c1cccs1)C Amb17327134 [0,1,0,0,1,0|2,0,0]=4 3619 B12R1.15 CC(NC(=O)CC)c1cc[s]c1 Amb25789237 [0,1,0,0,1,0|2,0,0]=4 3620 B12R1.15 CC(NC(=O)CC)c1ccc[nH]1 Amb25852674 [0,1,0,0,1,0|2,0,0]=4 3621 B12R1.15 CC(NC(=O)CI)c1ccc[s]1 Amb25067293 [0,1,0,0,1,0|2,0,0]=4 3622 B12R1.15 CC(NC(=O)CN)c1cc[nH]c1 Amb18893569 [0,1,0,0,1,0|2,0,0]=4 3623 B12R1.15 CC(NC(=O)CN)c1cc[s]c1 Amb18301610 [0,1,0,0,1,0|2,0,0]=4 3624 B12R1.15 CC(NC(=O)CO)c1cc[s]c1 Amb24525687 [0,1,0,0,1,0|2,0,0]=4 3625 B12R1.15 CC(NC(=O)CS)c1ccc[s]1 Amb25111480 [0,1,0,0,1,0|2,0,0]=4 3626 B12R1.15 CCC(=O)NC(c1ccco1)C Amb10677147 [0,1,0,0,1,0|2,0,0]=4 3627 B12R1.15 CCC(=O)NC(c1cccs1)C Amb1773608 [0,1,0,0,1,0|2,0,0]=4 3628 B12R1.15 CCC(=O)N[C@@H](C)c1ccco1 Amb25374863 [0,1,0,0,1,0|2,0,0]=4 3629 B12R1.15 CCC(=O)N[C@H](C)c1ccc[s]1 Amb24442284 [0,1,0,0,1,0|2,0,0]=4 3630 B12R1.15 CCC(=O)N[C@H](C)c1ccco1 Amb25701234 [0,1,0,0,1,0|2,0,0]=4 3631 B12R1.15 CNC(=O)CC(C)[n]1cccc1 Amb24705300 [0,1,0,0,1,0|2,0,0]=4 3632 B12R1.15 CNC(=O)CC(c1cccs1)C Amb17234025 [0,1,0,0,1,0|2,0,0]=4 3633 B12R1.15 CNC(=O)NC(C)c1cc[s]c1 Amb25096172 [0,1,0,0,1,0|2,0,0]=4 3634 B12R1.15 CNC(=O)NC(C)c1ccco1 Amb25092656 [0,1,0,0,1,0|2,0,0]=4 3635 B12R1.15 CNC(=O)NC(C)c1ccoc1 Amb25712690 [0,1,0,0,1,0|2,0,0]=4 3636 B12R1.15 COC(=O)CC(c1cccs1)C Amb17234093 [0,1,0,0,1,0|2,0,0]=4 3637 B12R1.15 COC(=O)NC(C)c1ccoc1 Amb25270874 [0,1,0,0,1,0|2,0,0]=4 3638 B12R1.15 COC(=O)N[C@@H](C)c1ccc[s]1 Amb24749509 [0,1,0,0,1,0|2,0,0]=4 3639 B12R1.15 COC(=O)N[C@H](C)c1ccc[s]1 Amb25358451 [0,1,0,0,1,0|2,0,0]=4 3640 B12R1.15 C[C@@H](NC(=O)CCl)c1ccc[s]1 Amb24739295 [0,1,0,0,1,0|2,0,0]=4 3641 B12R1.15 C[C@@H](NC(=O)CO)c1ccc[s]1 Amb25300190 [0,1,0,0,1,0|2,0,0]=4 3642 B12R1.15 C[C@H](NC(=O)CBr)c1ccc[s]1 Amb24390665 [0,1,0,0,1,0|2,0,0]=4 3643 B12R1.15 C[C@H](NC(=O)CCl)c1ccc[s]1 Amb25701223 [0,1,0,0,1,0|2,0,0]=4 3644 B12R1.15 C[C@H](NC(=O)CN)c1ccco1 Amb25360505 [0,1,0,0,1,0|2,0,0]=4 3645 B12R1.15 C[C@H](NC(=O)CO)c1ccc[s]1 Amb25099311 [0,1,0,0,1,0|2,0,0]=4 3646 B12R1.15 ClCC(=O)NC(c1ccco1)C Amb1158018 [0,1,0,0,1,0|2,0,0]=4 3647 B12R1.15 ClCC(=O)NC(c1cccs1)C Amb2304588 [0,1,0,0,1,0|2,0,0]=4 3648 B12R1.103 CC(=O)N[C@H](C)c1ccc(Br)[s]1 Amb25742053 [0,1,0,0,1,0|2,0,0]=4 3649 B12R1.103 CC(=O)N[C@H](C)c1ccc(Cl)[s]1 Amb24752013 [0,1,0,0,1,0|2,0,0]=4 3650 B12R1.103 CC(=O)O[C@@H](C)c1ccc(Cl)[s]1 Amb25182860 [0,1,0,0,1,0|1,0,0]=3 3651 B12R1.103 CC(=O)O[C@H](C)c1c[n][n](C)c1 Amb25160191 [0,1,0,0,1,0|2,0,0]=4 3652 B12R1.103 CC(=O)O[C@H](C)c1ccc(Cl)[s]1 Amb25256995 [0,1,0,0,1,0|1,0,0]=3 3653 B12R1.103 Cc1[n]c(c[s]1)[C@H](C)OC(C)=O Amb24459191 [0,1,0,0,1,0|2,0,0]=4 3654 B12R1.103 Cc1c[s]c([n]1)C(C)OC(C)=O Amb25816584 [0,1,0,0,1,0|2,0,0]=4 3655 B12R1.103 Cc1cc([n]o1)C(C)OC(C)=O Amb25816583 [0,1,0,0,1,0|2,0,0]=4 3656 B12R1.103 Cc1cc([n]o1)[C@H](C)OC(C)=O Amb24449384 [0,1,0,0,1,0|2,0,0]=4 3657 B12R1.103 Cc1cc[n]([n]1)C(C)OC(C)=O Amb25034616 [0,1,0,0,1,0|2,0,0]=4 3658 B12R1.103 Cc1ccc([s]1)C(C)CC(C)=O Amb24386670 [0,1,0,0,1,0|2,0,0]=4 3659 B12R1.103 Cc1ccc(o1)C(C)CC(C)=O Amb25843709 [0,1,0,0,1,0|2,0,0]=4 3660 B12R1.120 CC(=O)N(C)C(C)c1ccc[s]1 Amb24370268 [0,1,0,0,1,0|2,0,0]=4 3661 B12R1.144 CC(=O)CC(C)c1c[s]cc1Br Amb25200915 [0,1,0,0,1,0|2,0,0]=4 3662 B12R1.144 CC(=O)OC(C)c1cc[n][n]1C Amb25182790 [0,1,0,0,1,0|2,0,0]=4 3663 B12R1.144 CC(=O)O\C(\C)=C/1\C=CCC1=O Amb25262782 [0,1,0,0,1,0|0,0,2]=4 3664 B12R1.144 Cc1[s]ccc1C(C)CC(C)=O Amb24470912 [0,1,0,0,1,0|2,0,0]=4 3665 B12R1.476 CC(=O)NC(CO)c1cc[s]c1 Amb25796837 [0,1,0,0,1,0|2,0,0]=4 3666 B12R1.476 CC(=O)N[C@@H](CC)c1ccco1 Amb25840906 [0,1,0,0,1,0|2,0,0]=4 3667 B12R1.476 CC(=O)N[C@H](CC)c1ccc[s]1 Amb25770514 [0,1,0,0,1,0|2,0,0]=4 3668 B12R1.476 CC(=O)OC(C=C)c1ccco1 Amb20248369 [0,1,0,0,1,0|1,0,1]=4 3669 B12R1.476 CC(=O)O[C@H](C#N)c1ccoc1 Amb25740099 [0,1,0,0,1,0|1,0,1]=4 3670 B12R1.476 CCC(c1cccs1)NC(=O)C Amb1805885 [0,1,0,0,1,0|2,0,0]=4 3671 B14R1.149 CC(=O)CCC(c1cccc(c1)Br)Cl Amb17421439 [0,1,0,0,0,1|2,0,0]=4 3672 B14R1.149 CC(=O)CCC(c1cccc(c1)C)Cl Amb17404055 [0,1,0,0,0,1|2,0,0]=4 3673 B14R1.149 CC(=O)CCC(c1cccc(c1)Cl)Cl Amb17407559 [0,1,0,0,0,1|2,0,0]=4 3674 B14R1.149 CC(=O)NCC(O)c1cc(O)ccc1 Amb25683434 [0,1,0,0,0,1|2,0,0]=4 3675 B14R1.149 CC(=O)N\N=C(\C)/c1cccc(N)c1 Amb25081613 [0,1,0,0,0,1|1,0,1]=4 3676 B14R1.149 CC(=O)O\N=C(\N)/c1cccc(Cl)c1 Amb25703636 [0,1,0,0,0,1|1,0,1]=4 3677 B14R1.160 CC(=O)CCC(c1ccccc1C)Cl Amb17404054 [0,1,0,0,0,1|2,0,0]=4 3678 B14R1.160 CC(=O)CCC(c1ccccc1Cl)Cl Amb17407558 [0,1,0,0,0,1|2,0,0]=4 3679 B14R1.160 CC(=O)CCC(c1ccccc1F)Cl Amb17404371 [0,1,0,0,0,1|2,0,0]=4 3680 B14R1.160 CC(=O)ONC(=O)c1ccccc1O Amb17607640 [0,1,0,0,0,1|1,0,1]=4 3681 B14R1.160 CC(=O)O\N=C(\C)/c1ccccc1O Amb24564905 [0,1,0,0,0,1|0,0,1]=3 3682 B14R1.160 CC(=O)O\N=C(\N)/c1ccccc1C Amb25257429 [0,1,0,0,0,1|1,0,1]=4 3683 B14R1.160 CC(=O)O\N=C(\c1ccccc1O)/C Amb17615035 [0,1,0,0,0,1|0,0,1]=3 3684 B14R1.160 Cc1ccccc1N(C)CNC(C)=O Amb25036000 [0,1,0,0,0,1|2,0,0]=4 3685 B14R1.160 NC(=O)OCC(c1ccccc1Cl)O Amb17610616 [0,1,0,0,0,1|2,0,0]=4 3686 B14R1.160 NC(=O)OC[C@@H](O)c1ccccc1Cl Amb19131130 [0,1,0,0,0,1|2,0,0]=4 3687 B14R1.160 OC(=O)CCC(c1ccccc1Br)C Amb17597110 [0,1,0,0,0,1|2,0,0]=4 3688 B14R1.163 BrCC(=O)NCC(c1ccccc1)O Amb17332028 [0,1,0,0,0,1|2,0,0]=4 3689 B14R1.163 CNC(=O)CCC(c1ccccc1)O Amb17336618 [0,1,0,0,0,1|2,0,0]=4 3690 B14R1.163 CNC(=O)CSC(C)c1ccccc1 Amb21620817 [0,1,0,0,0,1|0,1,0]=3 3691 B14R1.163 CNC(=O)NCC(C)c1ccccc1 Amb25143591 [0,1,0,0,0,1|1,0,0]=3 3692 B14R1.163 CNC(=O)NCC(N)c1ccccc1 Amb25048042 [0,1,0,0,0,1|2,0,0]=4 3693 B14R1.163 CNC(=O)NCC(O)c1ccccc1 Amb24181770 [0,1,0,0,0,1|2,0,0]=4 3694 B14R1.163 CNC(=O)O\N=C(/c1ccccn1)\C Amb2234267 [0,1,0,0,0,1|1,0,1]=4 3695 B14R1.163 CNC(=S)NCC(C)c1ccccc1 Amb24380520 [0,1,0,0,0,1|1,1,0]=4 3696 B14R1.163 COC(=O)C#CC(C)c1ccccc1 Amb24461465 [0,1,0,0,0,1|1,0,0]=3 3697 B14R1.163 COC(=O)C#CC(O)c1ccccc1 Amb25796421 [0,1,0,0,0,1|2,0,0]=4 3698 B14R1.163 COC(=O)C#C[C@H](O)c1ccccc1 Amb25079187 [0,1,0,0,0,1|2,0,0]=4 3699 B14R1.163 COC(=O)CCC(N)c1ccccc1 Amb19373309 [0,1,0,0,0,1|2,0,0]=4 3700 B14R1.163 COC(=O)CCC(c1ccccc1)N Amb10610596 [0,1,0,0,0,1|2,0,0]=4 3701 B14R1.163 C\C(=N\NC(=O)CO)\c1ccccc1 Amb25813680 [0,1,0,0,0,1|1,0,1]=4 3702 B14R1.163 ClCC(=O)NCC(c1ccccc1)C Amb1657748 [0,1,0,0,0,1|1,0,0]=3 3703 B14R1.163 ClCC(=O)NCC(c1ccccc1)O Amb17326215 [0,1,0,0,0,1|2,0,0]=4 3704 B14R1.163 N\C(=N\OC(=O)CCl)\c1ccccc1 Amb24121345 [0,1,0,0,0,1|1,0,1]=4 3705 B14R1.163 OCC(=O)NCC(c1ccccc1)C Amb1110526 [0,1,0,0,0,1|1,0,0]=3 3706 B14R1.415 CC(=C)C(=O)NC(C)c1ccccc1 Amb17934132 [0,1,0,0,0,1|2,0,0]=4 3707 B14R1.415 CC(=C)C(=O)N[C@@H](C)c1ccccc1 Amb17934133 [0,1,0,0,0,1|2,0,0]=4 3708 B14R1.415 CC(=C)C(=O)N[C@H](C)c1ccccc1 Amb25800393 [0,1,0,0,0,1|2,0,0]=4 3709 B14R1.415 CC(=C)C(=S)NC(C)c1ccccc1 Amb24427362 [0,1,0,0,0,1|2,0,0]=4 3710 B14R1.415 CC(=O)C(=O)N[C@@H](C)c1ccccc1 Amb24452606 [0,1,0,0,0,1|1,0,0]=3 3711 B14R1.415 CC(=O)C(=O)N[C@H](C)c1ccccc1 Amb25371972 [0,1,0,0,0,1|1,0,0]=3 3712 B14R1.415 CC(C[C@@H](N)C(O)=O)c1ccccc1 Amb17933184 [0,1,0,0,0,1|2,0,0]=4 3713 B14R1.415 CC(NC(C)c1ccccc1)C(O)=O Amb24271459 [0,1,0,0,0,1|2,0,0]=4 3714 B14R1.415 CC(\C=C(/Cl)\C(O)=O)c1ccccc1 Amb25827178 [0,1,0,0,0,1|2,0,0]=4 3715 B14R1.415 CC(\C=C(\Cl)/C(O)=O)c1ccccc1 Amb24630828 [0,1,0,0,0,1|2,0,0]=4 3716 B14R1.415 CC(c1ccccc1)NC(=O)C(=O)C Amb17401498 [0,1,0,0,0,1|1,0,0]=3 3717 B14R1.415 CC(c1ccccc1)SC(C(=O)O)C Amb17501620 [0,1,0,0,0,1|1,1,0]=4 3718 B14R1.415 C[C@@H](NC(=O)C(O)=O)c1ccccc1 Amb25765711 [0,1,0,0,0,1|2,0,0]=4 3719 B14R1.415 C[C@H](NC(=O)C(O)=O)c1ccccc1 Amb25200975 [0,1,0,0,0,1|2,0,0]=4 3720 B14R1.415 C\C(=C/C(C)c1ccccc1)\C(O)=O Amb24652552 [0,1,0,0,0,1|2,0,0]=4 3721 B14R1.415 C\C(=N\C(C)c1ccccc1)\C(N)=O Amb25814779 [0,1,0,0,0,1|2,0,0]=4 3722 B14R1.417 CC(=O)NC(=N)N(C)c1ccccc1 Amb25825162 [0,1,0,0,0,1|2,0,0]=4 3723 B14R1.417 CC(=O)NC(=S)N(C)c1ccccc1 Amb25857450 [0,1,0,0,0,1|2,0,0]=4 3724 B14R1.417 CC(=O)NC(C)C(C)c1ccccc1 Amb25086516 [0,1,0,0,0,1|1,0,0]=3 3725 B14R1.417 CC(=O)N[C@@H](C)[C@@H](C)c1ccccc1 Amb25725960 [0,1,0,0,0,1|1,0,0]=3 3726 B14R1.417 CC(=O)N[C@@H](C)[C@@H](O)c1ccccc1 Amb24418068 [0,1,0,0,0,1|2,0,0]=4 3727 B14R1.417 CC(=O)N[C@@H](C)[C@H](S)c1ccccc1 Amb25165741 [0,1,0,0,0,1|2,0,0]=4 3728 B14R1.417 CC(C)=CC(N)C(C)c1ccccc1 Amb25840651 [0,1,0,0,0,1|2,0,0]=4 3729 B14R1.417 CC(c1ccccc1)C(=O)NC(N)=O Amb25359818 [0,1,0,0,0,1|2,0,0]=4 3730 B14R1.417 CC(c1ccccc1)N(CC(=O)O)C Amb17336640 [0,1,0,0,0,1|2,0,0]=4 3731 B14R1.417 C\C(=C/C(O)=O)\C(C)c1ccccc1 Amb25074635 [0,1,0,0,0,1|2,0,0]=4 3732 B14R1.417 OC(c1ccccc1)C(NC(=O)C)C Amb17595062 [0,1,0,0,0,1|2,0,0]=4 3733 B14R1.540 N#CC(c1ccccc1)CCC(=O)C Amb17594857 [0,1,0,0,0,1|1,0,1]=4 3734 B14R1.678 CC(=O)CCC(c1ccc(cc1)C)Cl Amb17404056 [0,1,0,0,0,1|2,0,0]=4 3735 B14R1.678 CC(=O)NCC(C)c1ccc(N)cc1 Amb18651285 [0,1,0,0,0,1|1,0,0]=3 3736 B14R1.678 CC(=O)NCC(c1ccc(cc1)C)O Amb17336586 [0,1,0,0,0,1|2,0,0]=4 3737 B14R1.678 CC(=O)NC[C@@H](O)c1ccc(Cl)cc1 Amb24521436 [0,1,0,0,0,1|2,0,0]=4 3738 B14R1.678 CC(=O)OCC(=O)c1ccc(O)cc1 Amb20248329 [0,1,0,0,0,1|1,0,1]=4 3739 B14R1.678 CC(=O)ONC(=N)c1ccc(O)cc1 Amb25773419 [0,1,0,0,0,1|1,0,1]=4 3740 B14R1.678 CC(C)COC(C)c1ccc(Br)cc1 Amb23443736 [0,1,0,0,0,1|1,0,1]=4 3741 B14R1.678 CC(C)COC(C)c1ccc(S)cc1 Amb23568737 [0,1,0,0,0,1|1,0,1]=4 3742 B14R1.678 CC(CCC(O)=O)c1ccc(C)cc1 Amb17778099 [0,1,0,0,0,1|2,0,0]=4 3743 B14R1.678 CC(CCC([O-])=O)c1ccc(C)cc1 Amb17778100 [0,1,0,0,0,1|2,0,0]=4 3744 B14R1.678 C\C(=N\NC(C)=O)\c1ccc(F)cc1 Amb25263231 [0,1,0,0,0,1|1,0,1]=4 3745 B14R1.678 Cc1ccc(cc1)C(C)CCC([O-])=O Amb21947924 [0,1,0,0,0,1|2,0,0]=4 3746 B14R1.678 Cc1ccc(cc1)C(C)CNC(N)=O Amb24738573 [0,1,0,0,0,1|2,0,0]=4 3747 B14R1.678 Cc1ccc(cc1)N(C)CNC(C)=O Amb25075652 [0,1,0,0,0,1|2,0,0]=4 3748 B14R1.678 Cc1ccc(cc1)\C(\N)=N\OC(C)=O Amb24423882 [0,1,0,0,0,1|1,0,1]=4 3749 B14R1.678 ClC(c1ccc(cc1)Br)CCC(=O)C Amb17421440 [0,1,0,0,0,1|2,0,0]=4 3750 B14R1.678 ClC(c1ccc(cc1)Cl)CCC(=O)C Amb17407560 [0,1,0,0,0,1|2,0,0]=4 3751 B14R1.678 ClC(c1ccc(cc1)F)CCC(=O)C Amb17404372 [0,1,0,0,0,1|2,0,0]=4 3752 B14R1.678 N\C(=N/OC(=O)C)\c1ccc(cc1)Br Amb1842997 [0,1,0,0,0,1|1,0,1]=4 3753 B14R1.678 O=C(c1ccc(cc1)Br)OCC(=O)C Amb1229467 [0,1,0,0,0,1|1,0,1]=4 3754 B14R1.678 OC(c1ccc(cc1)Br)CNC(=O)C Amb17356398 [0,1,0,0,0,1|2,0,0]=4 3755 B14R1.678 OC(c1ccc(cc1)F)CNC(=O)C Amb17337157 [0,1,0,0,0,1|2,0,0]=4 3756 B14R1.813 CC(=O)C#C[Si](C)(C)c1ccccc1 Amb24367172 [0,1,0,0,0,1|1,1,0]=4 3757 B14R1.813 CC(=O)NCC(C)(O)c1ccccc1 Amb21941959 [0,1,0,0,0,1|1,0,0]=3 3758 B14R1.813 CC(=O)OCC(C)(C)c1ccccc1 Amb22264614 [0,1,0,0,0,1|0,0,0]=2 3759 B14R1.813 CC(=O)OCC(F)(F)c1ccccc1 Amb22325299 [0,1,0,0,0,1|1,0,0]=3 3760 B14R1.813 CC(C)(C#CC(O)=O)c1ccccc1 Amb24526000 [0,1,0,0,0,1|2,0,0]=4 3761 B14R1.813 CC(C)(OCC(O)=O)c1ccccc1 Amb22754806 [0,1,0,0,0,1|1,0,0]=3 3762 B14R1.813 CC(C)(\C=C\C(O)=O)c1ccccc1 Amb18650580 [0,1,0,0,0,1|2,0,0]=4 3763 B14R1.813 CC(C)(\N=N\C(N)=O)c1ccccc1 Amb24710028 [0,1,0,0,0,1|2,0,0]=4 3764 B14R1.813 OC(=O)CCC(c1ccccc1)(O)C Amb17336815 [0,1,0,0,0,1|2,0,0]=4 3765 B14R1.3098 CC(COS(C)(=O)=O)c1ccccc1 Amb25730022 [0,1,0,0,0,1|1,0,0]=3 3766 B14R1.3098 CC(OCC(C)(C)N)c1ccccc1 Amb18111896 [0,1,0,0,0,1|1,0,1]=4 3767 B14R1.3098 CC(c1ccccc1)CNS(=O)(=O)C Amb11251264 [0,1,0,0,0,1|2,0,0]=4 3768 B14R1.3098 CS(=O)(=O)OCC(N)c1ccccc1 Amb24694535 [0,1,0,0,0,1|2,0,0]=4 3769 B14R1.337 CC(=O)NC(C)Cc1ccccc1Cl Amb24570130 [0,1,0,0,0,1|1,0,0]=3 3770 B14R1.337 CC(CC(N)=O)Nc1ccccc1I Amb25166423 [0,1,0,0,0,1|2,0,0]=4 3771 B14R1.337 CC(CC(O)=O)Nc1ccccc1N Amb25858120 [0,1,0,0,0,1|2,0,0]=4 3772 B14R1.337 CC(Cc1ccccc1C)CC(=O)O Amb17235384 [0,1,0,0,0,1|2,0,0]=4 3773 B14R1.337 CC(Cc1ccccc1Cl)CC(=O)O Amb17241244 [0,1,0,0,0,1|2,0,0]=4 3774 B14R1.337 CC(Cc1ccccc1F)CC(=O)O Amb17236372 [0,1,0,0,0,1|2,0,0]=4 3775 B14R1.337 CC(Nc1ccccc1Br)CC(=O)N Amb17265545 [0,1,0,0,0,1|2,0,0]=4 3776 B14R1.337 CC(Nc1ccccc1C)CC(=O)N Amb17235457 [0,1,0,0,0,1|2,0,0]=4 3777 B14R1.337 CC(Nc1ccccc1Cl)CC(=O)N Amb17241283 [0,1,0,0,0,1|2,0,0]=4 3778 B14R1.337 CC(Nc1ccccc1F)CC(=O)N Amb17236392 [0,1,0,0,0,1|2,0,0]=4 3779 B14R1.337 C\C(=C\C(C)=O)\Nc1ccccc1Cl Amb24640369 [0,1,0,0,0,1|1,0,1]=4 3780 B14R1.337 C\C(=C\C(C)=O)\Nc1ccccc1F Amb24680320 [0,1,0,0,0,1|1,0,1]=4 3781 B14R1.337 C\C(=C\c1ccccc1Cl)\NC(C)=O Amb25817853 [0,1,0,0,0,1|1,0,1]=4 3782 B14R1.337 C\C(\CC(C)=O)=N/c1ccccc1N Amb25760808 [0,1,0,0,0,1|1,0,1]=4 3783 B14R1.337 Cc1ccccc1CC(C)NC(C)=O Amb25833113 [0,1,0,0,0,1|1,0,0]=3 3784 B14R1.337 Cc1ccccc1C[C@H](C)NC(C)=O Amb25091141 [0,1,0,0,0,1|1,0,0]=3 3785 B14R1.337 NC(=O)CC(Oc1ccccc1Br)C Amb17266152 [0,1,0,0,0,1|2,0,0]=4 3786 B14R1.337 NC(=O)CC(Oc1ccccc1C)C Amb17235637 [0,1,0,0,0,1|2,0,0]=4 3787 B14R1.337 NC(=O)CC(Oc1ccccc1Cl)C Amb17241548 [0,1,0,0,0,1|2,0,0]=4 3788 B14R1.337 NC(=O)CC(Oc1ccccc1F)C Amb17236550 [0,1,0,0,0,1|2,0,0]=4 3789 B14R1.425 CC(=C)C(O)C(C)Nc1ccccc1 Amb24740975 [0,1,0,0,0,1|2,0,0]=4 3790 B14R1.425 CC(=O)C(=C)C(C)Nc1ccccc1 Amb25737943 [0,1,0,0,0,1|1,0,0]=3 3791 B14R1.425 CC(=O)C(C)N(C)Cc1ccccc1 Amb19078620 [0,1,0,0,0,1|2,0,0]=4 3792 B14R1.425 CC(=O)N(C)C(C)Cc1c[n]ccc1 Amb22055795 [0,1,0,0,0,1|2,0,0]=4 3793 B14R1.425 CC(Cc1ccccc1)N(N)C(N)=O Amb22446446 [0,1,0,0,0,1|2,0,0]=4 3794 B14R1.425 CN(C(=O)C(=O)C)Cc1ccccc1 Amb17401499 [0,1,0,0,0,1|2,0,0]=4 3795 B14R1.425 C\C(=C/c1ccccc1)\C(O)C(C)=O Amb24642449 [0,1,0,0,0,1|1,0,1]=4 3796 B14R1.425 C\C(=C/c1ccccc1)\[C@@H](O)C(C)=O Amb24613507 [0,1,0,0,0,1|1,0,1]=4 3797 B14R1.425 C\C(\C(C)=O)=C(/C)\Nc1ccccc1 Amb25783785 [0,1,0,0,0,1|1,0,1]=4 3798 B14R1.425 C\C(\Nc1ccccc1)=C(/Cl)\C(C)=O Amb24435380 [0,1,0,0,0,1|1,0,1]=4 3799 B14R1.549 CC(=O)CC(C#N)Nc1ccccc1 Amb25096428 [0,1,0,0,0,1|1,0,1]=4 3800 B14R1.549 CC(=O)CN(Cc1ccccc1)CC Amb19078590 [0,1,0,0,0,1|2,0,0]=4 3801 B14R1.549 CC(=O)NC(Cc1ccccc1)C#N Amb24539287 [0,1,0,0,0,1|1,0,1]=4 3802 B14R1.549 CC(=O)NC(Cc1ccccc1)C=C Amb24096354 [0,1,0,0,0,1|1,0,1]=4 3803 B14R1.549 CC(=O)N\C(=N\c1ccccc1)\SC Amb25036819 [0,1,0,0,0,1|1,0,1]=4 3804 B14R1.549 CC(=O)N\C(\CC)=C/c1ccccc1 Amb24592568 [0,1,0,0,0,1|1,0,1]=4 3805 B14R1.549 CC(=O)N\C(\CO)=C\c1ccccc1 Amb25178108 [0,1,0,0,0,1|1,0,1]=4 3806 B14R1.549 CC(=O)\C=C(/NC)\Sc1ccccc1 Amb24347171 [0,1,0,0,0,1|1,0,1]=4 3807 B14R1.549 CC(=O)\C=C(/Nc1ccccc1)\SC Amb25758779 [0,1,0,0,0,1|1,0,1]=4 3808 B14R1.549 CC(=O)\C=C(\CC)/Nc1ccccc1 Amb25798302 [0,1,0,0,0,1|1,0,1]=4 3809 B14R1.549 ClC[C@H](Cc1ccccc1)NC(=O)C Amb17103592 [0,1,0,0,0,1|1,0,0]=3 3810 B14R1.549 OC[C@H](Cc1ccccc1)NC(=O)C Amb17102648 [0,1,0,0,0,1|1,0,0]=3 3811 B14R1.698 CC(=Nc1ccc(cc1)Cl)CC(=O)C Amb16227198 [0,1,0,0,0,1|1,0,1]=4 3812 B14R1.698 CC(=O)NC(C)Cc1ccc(F)cc1 Amb24721876 [0,1,0,0,0,1|1,0,0]=3 3813 B14R1.698 CC(=O)NC(C)Cc1ccc(O)cc1 Amb25123953 [0,1,0,0,0,1|1,0,0]=3 3814 B14R1.698 CC(=O)N[C@@H](C)Cc1ccc(O)cc1 Amb24345555 [0,1,0,0,0,1|1,0,0]=3 3815 B14R1.698 CC(CC(N)=O)Nc1ccc(N)cc1 Amb24342859 [0,1,0,0,0,1|2,0,0]=4 3816 B14R1.698 CC(CC(O)=O)Nc1ccc(Cl)cc1 Amb22455831 [0,1,0,0,0,1|2,0,0]=4 3817 B14R1.698 CC(CC(O)=O)Nc1ccc(O)cc1 Amb24373101 [0,1,0,0,0,1|2,0,0]=4 3818 B14R1.698 CC(Cc1ccc(Cl)cc1)NC(N)=O Amb22461493 [0,1,0,0,0,1|2,0,0]=4 3819 B14R1.698 CC(Cc1ccc(Cl)cc1)OC(O)=O Amb24063646 [0,1,0,0,0,1|1,0,0]=3 3820 B14R1.698 CC(Cc1ccc(F)cc1)NC(N)=O Amb19053109 [0,1,0,0,0,1|2,0,0]=4 3821 B14R1.698 CC(Cc1ccc(cc1)Br)CC(=O)O Amb17265523 [0,1,0,0,0,1|2,0,0]=4 3822 B14R1.698 CC(Cc1ccc(cc1)Br)NC(=O)C Amb10652716 [0,1,0,0,0,1|1,0,0]=3 3823 B14R1.698 CC(Cc1ccc(cc1)F)CC(=O)O Amb17236375 [0,1,0,0,0,1|2,0,0]=4 3824 B14R1.698 CC(Cc1ccc(cc1)O)CC(=O)O Amb17336807 [0,1,0,0,0,1|2,0,0]=4 3825 B14R1.698 CC(Nc1ccc(cc1)Br)CC(=O)N Amb17265544 [0,1,0,0,0,1|2,0,0]=4 3826 B14R1.698 CC(Nc1ccc(cc1)C)CC(=O)N Amb17235459 [0,1,0,0,0,1|2,0,0]=4 3827 B14R1.698 CC(Nc1ccc(cc1)Cl)CC(=O)N Amb17241285 [0,1,0,0,0,1|2,0,0]=4 3828 B14R1.698 CC(Nc1ccc(cc1)F)CC(=O)N Amb17236393 [0,1,0,0,0,1|2,0,0]=4 3829 B14R1.698 CC(Oc1ccc(cc1)Br)CC(=O)N Amb17266156 [0,1,0,0,0,1|2,0,0]=4 3830 B14R1.698 CC(Oc1ccc(cc1)C)CC(=O)N Amb17235641 [0,1,0,0,0,1|2,0,0]=4 3831 B14R1.698 CC(Oc1ccc(cc1)Cl)CC(=O)N Amb17241553 [0,1,0,0,0,1|2,0,0]=4 3832 B14R1.698 CC(Oc1ccc(cc1)F)CC(=O)N Amb17236556 [0,1,0,0,0,1|2,0,0]=4 3833 B14R1.698 C\C(=C/c1ccc(Cl)cc1)\NC(C)=O Amb24513270 [0,1,0,0,0,1|1,0,1]=4 3834 B14R1.698 C\C(=C\C(=O)C)\Nc1ccc(cc1)Br Amb2384259 [0,1,0,0,0,1|1,0,1]=4 3835 B14R1.698 C\C(=C\C(=O)C)\Nc1ccc(cc1)C Amb2384257 [0,1,0,0,0,1|1,0,1]=4 3836 B14R1.698 C\C(=C\C(=O)C)\Nc1ccc(cc1)Cl Amb2384258 [0,1,0,0,0,1|1,0,1]=4 3837 B14R1.698 C\C(=C\C(=O)C)\Nc1ccc(cc1)F Amb2386560 [0,1,0,0,0,1|1,0,1]=4 3838 B14R1.698 C\C(=C\C(C)=O)\Nc1ccc(O)cc1 Amb24725939 [0,1,0,0,0,1|1,0,1]=4 3839 B14R1.698 C\C(\CC(C)=O)=N/c1ccc(Cl)cc1 Amb25165021 [0,1,0,0,0,1|1,0,1]=4 3840 B14R1.698 C\C(\CC(C)=O)=N/c1ccc(N)cc1 Amb25835250 [0,1,0,0,0,1|1,0,1]=4 3841 B14R1.698 C\C(\CC(C)=O)=N/c1ccc(O)cc1 Amb25093696 [0,1,0,0,0,1|1,0,1]=4 3842 B14R1.698 C\C(\Cc1ccc(Br)cc1)=C\C(C)=O Amb24409214 [0,1,0,0,0,1|1,0,1]=4 3843 B14R1.698 Cc1ccc(cc1)\N=C(/C)\CC(C)=O Amb25233136 [0,1,0,0,0,1|1,0,1]=4 3844 B14R1.743 BrCC(=O)NC(Cc1ccccc1)C Amb17333679 [0,1,0,0,0,1|1,0,0]=3 3845 B14R1.743 BrCC(=O)NC(Cc1ccccn1)C Amb17329729 [0,1,0,0,0,1|2,0,0]=4 3846 B14R1.743 BrCC(=O)NC(Cc1cccnc1)C Amb17327664 [0,1,0,0,0,1|2,0,0]=4 3847 B14R1.743 BrCC(=O)NC(Cc1ccncc1)C Amb17325591 [0,1,0,0,0,1|2,0,0]=4 3848 B14R1.743 CC(Cc1ccccc1)NC(=O)CN Amb19036468 [0,1,0,0,0,1|1,0,0]=3 3849 B14R1.743 CC(Cc1ccccc1)NC(=O)NN Amb19042175 [0,1,0,0,0,1|2,0,0]=4 3850 B14R1.743 CC(\C=C(\C)/C=O)=Cc1ccccc1 Amb24759133 [0,1,0,0,0,1|1,0,1]=4 3851 B14R1.743 CCC(=O)CN(C)Cc1ccccc1 Amb19078626 [0,1,0,0,0,1|2,0,0]=4 3852 B14R1.743 CNC(=N)NC(C)Cc1ccccc1 Amb19041369 [0,1,0,0,0,1|2,0,0]=4 3853 B14R1.743 CNC(=O)CC(C)Nc1cccc[n]1 Amb24337804 [0,1,0,0,0,1|2,0,0]=4 3854 B14R1.743 CNC(=O)CC(C)Nc1ccccc1 Amb25283916 [0,1,0,0,0,1|1,0,0]=3 3855 B14R1.743 CNC(=O)CN(C)Cc1ccccc1 Amb19967610 [0,1,0,0,0,1|2,0,0]=4 3856 B14R1.743 CNC(=O)NC(C)Cc1ccccc1 Amb25277231 [0,1,0,0,0,1|1,0,0]=3 3857 B14R1.743 CNC(=S)NC(C)Cc1ccccc1 Amb25678616 [0,1,0,0,0,1|1,1,0]=4 3858 B14R1.743 COC(=O)CC(Br)Cc1ccccc1 Amb18111203 [0,1,0,0,0,1|2,0,0]=4 3859 B14R1.743 COC(=O)CC(Cl)Cc1ccccc1 Amb18111202 [0,1,0,0,0,1|2,0,0]=4 3860 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb18110742 [0,1,0,0,0,1|2,0,0]=4 3861 B14R1.743 COC(=O)CC(N)Cc1ccccc1 Amb21964184 [0,1,0,0,0,1|2,0,0]=4 3862 B14R1.743 COC(=O)\C=C(/Nc1ccccc1)\C Amb2386652 [0,1,0,0,0,1|1,0,1]=4 3863 B14R1.743 C\C(=C\C(=O)CC)\Nc1ccccc1 Amb24447082 [0,1,0,0,0,1|1,0,1]=4 3864 B14R1.743 C\C(\C=C(/C)\C=O)=C/c1ccccc1 Amb25783755 [0,1,0,0,0,1|1,0,1]=4 3865 B14R1.743 C\C(\C=C(\C)/C=O)=C/c1ccccc1 Amb25834402 [0,1,0,0,0,1|1,0,1]=4 3866 B14R1.1485 CC(=O)CC(Nc1ccccc1)(C)C Amb10608598 [0,1,0,0,0,1|1,0,0]=3 3867 B14R1.1485 CC(=O)CC(Oc1ccccc1)(C)C Amb17235419 [0,1,0,0,0,1|1,0,0]=3 3868 B14R1.1485 CC(=O)NC(C)(C)Cc1c[n]ccc1 Amb24453293 [0,1,0,0,0,1|2,0,0]=4 3869 B14R1.1485 CC(=O)NC(C)(C)Cc1ccccc1 Amb19517626 [0,1,0,0,0,1|1,0,0]=3 3870 B14R1.1485 CC(C)(CC(O)=O)Sc1ccccc1 Amb22456988 [0,1,0,0,0,1|2,0,0]=4 3871 B14R1.1485 CC(C)(Cc1ccccc1)NC(N)=O Amb25858099 [0,1,0,0,0,1|2,0,0]=4 3872 B14R1.1485 CC(C)(Cc1ccccc1)OC(N)=O Amb24084628 [0,1,0,0,0,1|1,0,0]=3 3873 B14R1.1485 OC(=O)CC(Cc1ccccc1)(C)C Amb17336451 [0,1,0,0,0,1|2,0,0]=4 3874 B14R1.1485 OC(=O)CC(Oc1ccccc1)(C)C Amb17235912 [0,1,0,0,0,1|2,0,0]=4 3875 B14R1.5978 CC(=O)NC(C)Cc1cccc(Cl)c1 Amb24510947 [0,1,0,0,0,1|1,0,0]=3 3876 B14R1.5978 CC(=O)NC(C)Cc1cccc(O)c1 Amb24506362 [0,1,0,0,0,1|1,0,0]=3 3877 B14R1.5978 CC(=O)N[C@@H](C)Cc1cccc(O)c1 Amb25166006 [0,1,0,0,0,1|1,0,0]=3 3878 B14R1.5978 CC(=O)N[C@@H](C)Cc1cccc(S)c1 Amb24404829 [0,1,0,0,0,1|1,0,0]=3 3879 B14R1.5978 CC(CC(N)=O)Nc1cccc(I)c1 Amb25285466 [0,1,0,0,0,1|2,0,0]=4 3880 B14R1.5978 CC(CC(O)=O)Oc1cc(O)ccc1 Amb18813360 [0,1,0,0,0,1|2,0,0]=4 3881 B14R1.5978 CC(Cc1cccc(Cl)c1)NC(N)=O Amb24753672 [0,1,0,0,0,1|2,0,0]=4 3882 B14R1.5978 CC(Cc1cccc(F)c1)CC(O)=O Amb19149363 [0,1,0,0,0,1|2,0,0]=4 3883 B14R1.5978 CC(Cc1cccc(F)c1)NC(N)=O Amb25375940 [0,1,0,0,0,1|2,0,0]=4 3884 B14R1.5978 CC(Cc1cccc(c1)Br)CC(=O)O Amb17265519 [0,1,0,0,0,1|2,0,0]=4 3885 B14R1.5978 CC(Cc1cccc(c1)Br)NC(=O)C Amb12283588 [0,1,0,0,0,1|1,0,0]=3 3886 B14R1.5978 CC(Cc1cccc(c1)Cl)CC(=O)O Amb17241247 [0,1,0,0,0,1|2,0,0]=4 3887 B14R1.5978 CC(Cc1cccc(c1)O)CC(=O)O Amb17336809 [0,1,0,0,0,1|2,0,0]=4 3888 B14R1.5978 CC(Nc1cccc(c1)Br)CC(=O)N Amb17265546 [0,1,0,0,0,1|2,0,0]=4 3889 B14R1.5978 CC(Nc1cccc(c1)C)CC(=O)N Amb17235458 [0,1,0,0,0,1|2,0,0]=4 3890 B14R1.5978 CC(Nc1cccc(c1)Cl)CC(=O)N Amb17241284 [0,1,0,0,0,1|2,0,0]=4 3891 B14R1.5978 CC(Nc1cccc(c1)F)CC(=O)N Amb17236394 [0,1,0,0,0,1|2,0,0]=4 3892 B14R1.5978 C\C(=C/C(=O)C)\Nc1cccc(c1)O Amb16203011 [0,1,0,0,0,1|1,0,1]=4 3893 B14R1.5978 C\C(=C/c1cccc(F)c1)\NC(C)=O Amb24753913 [0,1,0,0,0,1|1,0,1]=4 3894 B14R1.5978 C\C(=C\C(=O)C)\Nc1cccc(c1)C Amb2386562 [0,1,0,0,0,1|1,0,1]=4 3895 B14R1.5978 C\C(=C\C(=O)C)\Nc1cccc(c1)Cl Amb2386563 [0,1,0,0,0,1|1,0,1]=4 3896 B14R1.5978 C\C(=C\C(=O)C)\Nc1cccc(c1)F Amb2384262 [0,1,0,0,0,1|1,0,1]=4 3897 B14R1.5978 C\C(=C\C(=O)C)\Nc1cccc(c1)O Amb2384264 [0,1,0,0,0,1|1,0,1]=4 3898 B14R1.5978 C\C(\Cc1cccc(F)c1)=C\C(C)=O Amb24638510 [0,1,0,0,0,1|1,0,1]=4 3899 B14R1.5978 Cc1cccc(CC(C)NC(C)=O)c1 Amb24393394 [0,1,0,0,0,1|1,0,0]=3 3900 B14R1.5978 Cc1cccc(C[C@H](C)NC(C)=O)c1 Amb25102710 [0,1,0,0,0,1|1,0,0]=3 3901 B14R1.5978 NC(=O)CC(Oc1cccc(c1)Br)C Amb17266154 [0,1,0,0,0,1|2,0,0]=4 3902 B14R1.5978 NC(=O)CC(Oc1cccc(c1)C)C Amb17235639 [0,1,0,0,0,1|2,0,0]=4 3903 B14R1.5978 NC(=O)CC(Oc1cccc(c1)Cl)C Amb17241550 [0,1,0,0,0,1|2,0,0]=4 3904 B14R1.5978 NC(=O)CC(Oc1cccc(c1)F)C Amb17236553 [0,1,0,0,0,1|2,0,0]=4 3905 B14R1.10 BrCC(=O)NC(c1ccc(cc1)C)C Amb17327918 [0,2,0,0,0,0|1,0,0]=3 3906 B14R1.10 BrCC(=O)NC(c1ccc(cc1)F)C Amb17331122 [0,2,0,0,0,0|1,0,0]=3 3907 B14R1.10 C=CC(=O)NC(c1ccc(cc1)N)C Amb16192607 [0,2,0,0,0,0|1,0,1]=4 3908 B14R1.10 CC(CC(=O)C#C)c1ccc(N)cc1 Amb25335015 [0,2,0,0,0,0|1,0,1]=4 3909 B14R1.10 CC(CC(=O)NN)c1ccc(N)cc1 Amb25222520 [0,2,0,0,0,0|2,0,0]=4 3910 B14R1.10 CC(CC(=O)NO)c1ccc(N)cc1 Amb25732303 [0,2,0,0,0,0|2,0,0]=4 3911 B14R1.10 CC(NC(=O)C#C)c1ccc(Br)cc1 Amb25059022 [0,2,0,0,0,0|1,0,1]=4 3912 B14R1.10 CC(NC(=O)C=C)c1ccc(F)cc1 Amb19042014 [0,2,0,0,0,0|1,0,1]=4 3913 B14R1.10 CC(NC(=O)CI)c1ccc(Br)cc1 Amb24729191 [0,2,0,0,0,0|1,0,0]=3 3914 B14R1.10 CC(NC(=O)CI)c1ccc(F)cc1 Amb25037723 [0,2,0,0,0,0|1,0,0]=3 3915 B14R1.10 CC(NC(=O)CN)c1ccc(Br)cc1 Amb18246463 [0,2,0,0,0,0|1,0,0]=3 3916 B14R1.10 CC(NC(=O)CN)c1ccc(Br)cc1 Amb24770024 [0,2,0,0,0,0|1,0,0]=3 3917 B14R1.10 CC(NC(=O)CN)c1ccc(Cl)cc1 Amb18972404 [0,2,0,0,0,0|1,0,0]=3 3918 B14R1.10 CC(NC(=O)CN)c1ccc(Cl)cc1 Amb24770027 [0,2,0,0,0,0|1,0,0]=3 3919 B14R1.10 CC(NC(=O)CN)c1ccc(F)cc1 Amb18972402 [0,2,0,0,0,0|1,0,0]=3 3920 B14R1.10 CC(NC(=O)CN)c1ccc(F)cc1 Amb19374822 [0,2,0,0,0,0|1,0,0]=3 3921 B14R1.10 CC(NC(=O)CS)c1ccc(Br)cc1 Amb24350493 [0,2,0,0,0,0|1,0,0]=3 3922 B14R1.10 CC(NC(=O)CS)c1ccc(Cl)cc1 Amb24394925 [0,2,0,0,0,0|1,0,0]=3 3923 B14R1.10 CC(NC(=O)CS)c1ccc(F)cc1 Amb24411017 [0,2,0,0,0,0|1,0,0]=3 3924 B14R1.10 CC(NC(=O)NN)c1ccc(Cl)cc1 Amb24521096 [0,2,0,0,0,0|2,0,0]=4 3925 B14R1.10 CC(NC(=O)NN)c1ccc(F)cc1 Amb19054050 [0,2,0,0,0,0|2,0,0]=4 3926 B14R1.10 CCC(=O)NC(c1ccc(cc1)C)C Amb11014280 [0,2,0,0,0,0|1,0,0]=3 3927 B14R1.10 CCC(=O)NC(c1ccc(cc1)F)C Amb11014281 [0,2,0,0,0,0|1,0,0]=3 3928 B14R1.10 CCC(=O)N[C@@H](C)c1ccc(F)cc1 Amb24636527 [0,2,0,0,0,0|1,0,0]=3 3929 B14R1.10 CCC(=O)N[C@H](C)c1ccc(Cl)cc1 Amb25693419 [0,2,0,0,0,0|1,0,0]=3 3930 B14R1.10 CCC(=O)N[C@H](C)c1ccc(F)cc1 Amb24364359 [0,2,0,0,0,0|1,0,0]=3 3931 B14R1.10 CNC(=N)NC(C)c1ccc(Cl)cc1 Amb24656978 [0,2,0,0,0,0|2,0,0]=4 3932 B14R1.10 CNC(=N)NC(C)c1ccc(F)cc1 Amb19063436 [0,2,0,0,0,0|2,0,0]=4 3933 B14R1.10 CNC(=N)N[C@@H](C)c1ccc(Br)cc1 Amb24386393 [0,2,0,0,0,0|2,0,0]=4 3934 B14R1.10 CNC(=N)N[C@@H](C)c1ccc(Cl)cc1 Amb24682025 [0,2,0,0,0,0|2,0,0]=4 3935 B14R1.10 CNC(=N)N[C@@H](C)c1ccc(F)cc1 Amb25112452 [0,2,0,0,0,0|2,0,0]=4 3936 B14R1.10 CNC(=N)N[C@H](C)c1ccc(F)cc1 Amb25353296 [0,2,0,0,0,0|2,0,0]=4 3937 B14R1.10 CNC(=O)CC(C)c1ccc(N)cc1 Amb25166575 [0,2,0,0,0,0|1,0,0]=3 3938 B14R1.10 CNC(=O)CC(O)c1ccc(F)cc1 Amb25166087 [0,2,0,0,0,0|2,0,0]=4 3939 B14R1.10 CNC(=O)CC(c1ccc(cc1)Br)C Amb17264933 [0,2,0,0,0,0|1,0,0]=3 3940 B14R1.10 CNC(=O)CC(c1ccc(cc1)Br)N Amb17265542 [0,2,0,0,0,0|2,0,0]=4 3941 B14R1.10 CNC(=O)CC(c1ccc(cc1)C)C Amb17235122 [0,2,0,0,0,0|1,0,0]=3 3942 B14R1.10 CNC(=O)CC(c1ccc(cc1)C)N Amb17235449 [0,2,0,0,0,0|2,0,0]=4 3943 B14R1.10 CNC(=O)CC(c1ccc(cc1)Cl)C Amb17241033 [0,2,0,0,0,0|1,0,0]=3 3944 B14R1.10 CNC(=O)CC(c1ccc(cc1)Cl)N Amb17241280 [0,2,0,0,0,0|2,0,0]=4 3945 B14R1.10 CNC(=O)CC(c1ccc(cc1)F)C Amb17236170 [0,2,0,0,0,0|1,0,0]=3 3946 B14R1.10 CNC(=O)CC(c1ccc(cc1)F)N Amb17236391 [0,2,0,0,0,0|2,0,0]=4 3947 B14R1.10 CNC(=O)C[C@H](N)c1ccc(F)cc1 Amb25672519 [0,2,0,0,0,0|2,0,0]=4 3948 B14R1.10 CNC(=O)NC(C)c1ccc(N)cc1 Amb24472752 [0,2,0,0,0,0|1,0,0]=3 3949 B14R1.10 CNC(=O)NC(c1ccc(cc1)Br)C Amb11258671 [0,2,0,0,0,0|1,0,0]=3 3950 B14R1.10 CNC(=O)N[C@@H](C)c1ccc(Br)cc1 Amb25748584 [0,2,0,0,0,0|1,0,0]=3 3951 B14R1.10 CNC(=S)NC(C)c1ccc(Br)cc1 Amb25099078 [0,2,0,0,0,0|1,1,0]=4 3952 B14R1.10 CNC(=S)NC(C)c1ccc(Cl)cc1 Amb24386740 [0,2,0,0,0,0|1,1,0]=4 3953 B14R1.10 COC(=O)CC(c1ccc(cc1)Br)C Amb17265526 [0,2,0,0,0,0|1,0,0]=3 3954 B14R1.10 COC(=O)CC(c1ccc(cc1)Br)N Amb10619468 [0,2,0,0,0,0|2,0,0]=4 3955 B14R1.10 COC(=O)CC(c1ccc(cc1)Br)N Amb2371490 [0,2,0,0,0,0|2,0,0]=4 3956 B14R1.10 COC(=O)CC(c1ccc(cc1)C)C Amb17235400 [0,2,0,0,0,0|1,0,0]=3 3957 B14R1.10 COC(=O)CC(c1ccc(cc1)Cl)C Amb17241254 [0,2,0,0,0,0|1,0,0]=3 3958 B14R1.10 COC(=O)CC(c1ccc(cc1)Cl)N Amb1104817 [0,2,0,0,0,0|2,0,0]=4 3959 B14R1.10 COC(=O)CC(c1ccc(cc1)Cl)N Amb2260568 [0,2,0,0,0,0|2,0,0]=4 3960 B14R1.10 COC(=O)CC(c1ccc(cc1)F)C Amb17236380 [0,2,0,0,0,0|1,0,0]=3 3961 B14R1.10 COC(=O)CC(c1ccc(cc1)F)N Amb10610265 [0,2,0,0,0,0|2,0,0]=4 3962 B14R1.10 COC(=O)C[C@@H](N)c1ccc(Br)cc1 Amb23440353 [0,2,0,0,0,0|2,0,0]=4 3963 B14R1.10 COC(=O)C[C@@H](N)c1ccc(Cl)cc1 Amb22747570 [0,2,0,0,0,0|2,0,0]=4 3964 B14R1.10 COC(=O)C[C@@H](N)c1ccc(O)cc1 Amb24181931 [0,2,0,0,0,0|2,0,0]=4 3965 B14R1.10 COC(=O)C[C@H](N)c1ccc(Cl)cc1 Amb24271443 [0,2,0,0,0,0|2,0,0]=4 3966 B14R1.10 COC(=O)NC(C)c1ccc(Br)cc1 Amb25670911 [0,2,0,0,0,0|1,0,0]=3 3967 B14R1.10 COC(=O)NC(C)c1ccc(F)cc1 Amb25782128 [0,2,0,0,0,0|1,0,0]=3 3968 B14R1.10 C[C@@H](NC(=O)CBr)c1ccc(Br)cc1 Amb25681337 [0,2,0,0,0,0|1,0,0]=3 3969 B14R1.10 C[C@@H](NC(=O)CBr)c1ccc(Cl)cc1 Amb25310880 [0,2,0,0,0,0|1,0,0]=3 3970 B14R1.10 C[C@@H](NC(=O)CBr)c1ccc(F)cc1 Amb25061094 [0,2,0,0,0,0|1,0,0]=3 3971 B14R1.10 C[C@@H](NC(=O)CCl)c1ccc(Cl)cc1 Amb25061095 [0,2,0,0,0,0|1,0,0]=3 3972 B14R1.10 C[C@@H](NC(=O)CN)c1ccc(Cl)cc1 Amb25165240 [0,2,0,0,0,0|1,0,0]=3 3973 B14R1.10 C[C@H](NC(=O)CCl)c1ccc(Br)cc1 Amb25124392 [0,2,0,0,0,0|1,0,0]=3 3974 B14R1.10 C\C(=C/C(=O)OC)\c1ccc(Br)cc1 Amb25256042 [0,2,0,0,0,0|1,0,1]=4 3975 B14R1.10 C\C(=C\C(=O)OC)\c1ccc(Br)cc1 Amb25717231 [0,2,0,0,0,0|1,0,1]=4 3976 B14R1.10 Cc1ccc(cc1)C(C)NC(=N)NC Amb19073522 [0,2,0,0,0,0|2,0,0]=4 3977 B14R1.10 Cc1ccc(cc1)C(C)NC(=O)C=C Amb19060544 [0,2,0,0,0,0|1,0,1]=4 3978 B14R1.10 Cc1ccc(cc1)C(C)NC(=O)CN Amb18970035 [0,2,0,0,0,0|1,0,0]=3 3979 B14R1.10 Cc1ccc(cc1)C(C)NC(=O)NC Amb25184070 [0,2,0,0,0,0|1,0,0]=3 3980 B14R1.10 Cc1ccc(cc1)C(C)NC(=O)NN Amb19051094 [0,2,0,0,0,0|2,0,0]=4 3981 B14R1.10 Cc1ccc(cc1)C(C)NC(=O)OC Amb24752178 [0,2,0,0,0,0|1,0,0]=3 3982 B14R1.10 Cc1ccc(cc1)C(O)CC(=O)NC Amb24566206 [0,2,0,0,0,0|2,0,0]=4 3983 B14R1.10 Cc1ccc(cc1)[C@@H](C)NC(=N)NC Amb25170569 [0,2,0,0,0,0|2,0,0]=4 3984 B14R1.10 Cc1ccc(cc1)[C@@H](C)NC(=O)CC Amb24471742 [0,2,0,0,0,0|1,0,0]=3 3985 B14R1.10 Cc1ccc(cc1)\C(\C)=C/C(=O)NC Amb25690812 [0,2,0,0,0,0|1,0,1]=4 3986 B14R1.10 Cc1ccc(cc1)\C(\C)=C/C(=O)OC Amb24635465 [0,2,0,0,0,0|1,0,1]=4 3987 B14R1.10 Cc1ccc(cc1)\C(\C)=C\C(=O)OC Amb25049394 [0,2,0,0,0,0|1,0,1]=4 3988 B14R1.10 ClCC(=O)NC(c1ccc(cc1)Br)C Amb1041431 [0,2,0,0,0,0|1,0,0]=3 3989 B14R1.10 ClCC(=O)NC(c1ccc(cc1)C)C Amb10608767 [0,2,0,0,0,0|1,0,0]=3 3990 B14R1.10 ClCC(=O)NC(c1ccc(cc1)Cl)C Amb1105986 [0,2,0,0,0,0|1,0,0]=3 3991 B14R1.10 ClCC(=O)NC(c1ccc(cc1)F)C Amb2281753 [0,2,0,0,0,0|1,0,0]=3 3992 B14R1.11 CC(NC(=O)C#C)c1cccc(Br)c1 Amb25281993 [0,2,0,0,0,0|1,0,1]=4 3993 B14R1.11 CC(NC(=O)C=C)c1cccc(F)c1 Amb19042015 [0,2,0,0,0,0|1,0,1]=4 3994 B14R1.11 CC(NC(=O)CBr)c1cccc(Cl)c1 Amb25753592 [0,2,0,0,0,0|1,0,0]=3 3995 B14R1.11 CC(NC(=O)CBr)c1cccc(O)c1 Amb25095551 [0,2,0,0,0,0|1,0,0]=3 3996 B14R1.11 CC(NC(=O)CCl)c1cccc(F)c1 Amb25838110 [0,2,0,0,0,0|1,0,0]=3 3997 B14R1.11 CC(NC(=O)CCl)c1cccc(N)c1 Amb25857609 [0,2,0,0,0,0|1,0,0]=3 3998 B14R1.11 CC(NC(=O)CN)c1cccc(Cl)c1 Amb18971004 [0,2,0,0,0,0|1,0,0]=3 3999 B14R1.11 CC(NC(=O)CN)c1cccc(Cl)c1 Amb24769872 [0,2,0,0,0,0|1,0,0]=3 4000 B14R1.11 CC(NC(=O)CN)c1cccc(F)c1 Amb18973816 [0,2,0,0,0,0|1,0,0]=3 4001 B14R1.11 CC(NC(=O)NN)c1cc(F)ccc1 Amb19054052 [0,2,0,0,0,0|2,0,0]=4 4002 B14R1.11 CCC(=O)NC(C)c1cccc(Cl)c1 Amb21619217 [0,2,0,0,0,0|1,0,0]=3 4003 B14R1.11 CCC(=O)NC(c1cccc(c1)Br)C Amb10715140 [0,2,0,0,0,0|1,0,0]=3 4004 B14R1.11 CCC(=O)NC(c1cccc(c1)F)C Amb10667279 [0,2,0,0,0,0|1,0,0]=3 4005 B14R1.11 CCC(=O)N[C@@H](C)c1cccc(Br)c1 Amb24546353 [0,2,0,0,0,0|1,0,0]=3 4006 B14R1.11 CCC(=O)N[C@@H](C)c1cccc(Cl)c1 Amb25066717 [0,2,0,0,0,0|1,0,0]=3 4007 B14R1.11 CCC(=O)N[C@H](C)c1cccc(Br)c1 Amb24709777 [0,2,0,0,0,0|1,0,0]=3 4008 B14R1.11 CN(CC(=O)OC)c1cccc(Cl)c1 Amb18269092 [0,2,0,0,0,0|2,0,0]=4 4009 B14R1.11 CNC(=N)NC(C)c1cccc(Br)c1 Amb24335637 [0,2,0,0,0,0|2,0,0]=4 4010 B14R1.11 CNC(=N)NC(C)c1cccc(Cl)c1 Amb24700654 [0,2,0,0,0,0|2,0,0]=4 4011 B14R1.11 CNC(=N)NC(C)c1cccc(F)c1 Amb19063437 [0,2,0,0,0,0|2,0,0]=4 4012 B14R1.11 CNC(=N)N[C@@H](C)c1cccc(Br)c1 Amb25125638 [0,2,0,0,0,0|2,0,0]=4 4013 B14R1.11 CNC(=N)N[C@@H](C)c1cccc(Cl)c1 Amb25742166 [0,2,0,0,0,0|2,0,0]=4 4014 B14R1.11 CNC(=N)N[C@H](C)c1cccc(Br)c1 Amb25303515 [0,2,0,0,0,0|2,0,0]=4 4015 B14R1.11 CNC(=O)CC(c1cccc(c1)Br)N Amb17265541 [0,2,0,0,0,0|2,0,0]=4 4016 B14R1.11 CNC(=O)CC(c1cccc(c1)C)C Amb17235149 [0,2,0,0,0,0|1,0,0]=3 4017 B14R1.11 CNC(=O)CC(c1cccc(c1)C)N Amb17235448 [0,2,0,0,0,0|2,0,0]=4 4018 B14R1.11 CNC(=O)CC(c1cccc(c1)Cl)C Amb17241039 [0,2,0,0,0,0|1,0,0]=3 4019 B14R1.11 CNC(=O)CC(c1cccc(c1)Cl)N Amb17241279 [0,2,0,0,0,0|2,0,0]=4 4020 B14R1.11 CNC(=O)CC(c1cccc(c1)F)C Amb17236181 [0,2,0,0,0,0|1,0,0]=3 4021 B14R1.11 CNC(=O)NC(c1cccc(c1)Cl)C Amb11258670 [0,2,0,0,0,0|1,0,0]=3 4022 B14R1.11 CNC(=S)NC(C)c1cccc(Cl)c1 Amb24348217 [0,2,0,0,0,0|1,1,0]=4 4023 B14R1.11 CNC(=S)NC(C)c1cccc(F)c1 Amb25748474 [0,2,0,0,0,0|1,1,0]=4 4024 B14R1.11 COC(=O)CC(N)c1cccc(O)c1 Amb18814212 [0,2,0,0,0,0|2,0,0]=4 4025 B14R1.11 COC(=O)CC(c1cccc(c1)Br)N Amb10610090 [0,2,0,0,0,0|2,0,0]=4 4026 B14R1.11 COC(=O)CC(c1cccc(c1)F)N Amb1884736 [0,2,0,0,0,0|2,0,0]=4 4027 B14R1.11 COC(=O)CC(c1cccc(c1)F)[NH3+] Amb1770964 [0,2,0,0,0,0|2,0,0]=4 4028 B14R1.11 COC(=O)C[C@@H](N)c1cccc(O)c1 Amb24181932 [0,2,0,0,0,0|2,0,0]=4 4029 B14R1.11 COC(=O)C[C@@H](O)c1cc(O)ccc1 Amb24181934 [0,2,0,0,0,0|2,0,0]=4 4030 B14R1.11 COC(=O)NC(C)c1cccc(Br)c1 Amb25183234 [0,2,0,0,0,0|1,0,0]=3 4031 B14R1.11 COC(=O)NC(C)c1cccc(Cl)c1 Amb24575794 [0,2,0,0,0,0|1,0,0]=3 4032 B14R1.11 COC(=O)NC(C)c1cccc(F)c1 Amb25206914 [0,2,0,0,0,0|1,0,0]=3 4033 B14R1.11 C[C@@H](NC(=O)CBr)c1cccc(Cl)c1 Amb25087451 [0,2,0,0,0,0|1,0,0]=3 4034 B14R1.11 C[C@@H](NC(=O)CCl)c1cc(Cl)ccc1 Amb24521626 [0,2,0,0,0,0|1,0,0]=3 4035 B14R1.11 C[C@@H](NC(=O)CCl)c1cccc(F)c1 Amb25782474 [0,2,0,0,0,0|1,0,0]=3 4036 B14R1.11 C[C@@H](NC(=O)CN)c1cccc(Br)c1 Amb24692373 [0,2,0,0,0,0|1,0,0]=3 4037 B14R1.11 C[C@@H](NC(=O)CN)c1cccc(Cl)c1 Amb24425265 [0,2,0,0,0,0|1,0,0]=3 4038 B14R1.11 C[C@H](NC(=O)C=C)c1cccc(Cl)c1 Amb24521627 [0,2,0,0,0,0|1,0,1]=4 4039 B14R1.11 C[C@H](NC(=O)C=C)c1cccc(F)c1 Amb24406129 [0,2,0,0,0,0|1,0,1]=4 4040 B14R1.11 C[C@H](NC(=O)CBr)c1cccc(Cl)c1 Amb25165340 [0,2,0,0,0,0|1,0,0]=3 4041 B14R1.11 C[C@H](NC(=O)CBr)c1cccc(F)c1 Amb24739292 [0,2,0,0,0,0|1,0,0]=3 4042 B14R1.11 C[C@H](NC(=O)CCl)c1cccc(F)c1 Amb25089683 [0,2,0,0,0,0|1,0,0]=3 4043 B14R1.11 C[C@H](NC(=O)CN)c1cccc(Cl)c1 Amb25346992 [0,2,0,0,0,0|1,0,0]=3 4044 B14R1.11 C[C@H](NC(=O)CN)c1cccc(F)c1 Amb25074945 [0,2,0,0,0,0|1,0,0]=3 4045 B14R1.11 C\C(=C\C(=O)OC)\c1cc(Cl)ccc1 Amb25850659 [0,2,0,0,0,0|1,0,1]=4 4046 B14R1.11 Cc1cc(ccc1)[C@@H](C)NC(=N)NC Amb24717726 [0,2,0,0,0,0|2,0,0]=4 4047 B14R1.11 Cc1cc(ccc1)[C@@H](C)NC(=O)CBr Amb24421740 [0,2,0,0,0,0|1,0,0]=3 4048 B14R1.11 Cc1cc(ccc1)[C@@H](C)NC(=O)CN Amb25778367 [0,2,0,0,0,0|1,0,0]=3 4049 B14R1.11 Cc1cc(ccc1)[C@H](C)NC(=O)C=C Amb24751733 [0,2,0,0,0,0|1,0,1]=4 4050 B14R1.11 Cc1cc(ccc1)[C@H](C)NC(=O)CCl Amb24630918 [0,2,0,0,0,0|1,0,0]=3 4051 B14R1.11 Cc1cc(ccc1)[C@H](C)NC(=O)CN Amb25266907 [0,2,0,0,0,0|1,0,0]=3 4052 B14R1.11 ClCC(=O)NC(c1cccc(c1)Cl)C Amb2281876 [0,2,0,0,0,0|1,0,0]=3 4053 B14R1.29 BrCCC(=O)NC(c1ccccc1)C Amb17330864 [0,2,0,0,0,0|1,0,0]=3 4054 B14R1.29 BrCCC(=O)NC(c1ccncc1)C Amb17326236 [0,2,0,0,0,0|2,0,0]=4 4055 B14R1.29 CC#CC(=O)CC(O)c1ccccc1 Amb24555541 [0,2,0,0,0,0|2,0,0]=4 4056 B14R1.29 CC(NC(=O)NN=C)c1ccccc1 Amb24385383 [0,2,0,0,0,0|1,0,1]=4 4057 B14R1.29 CC(N[C@H](C)c1ccccc1)=NC#N Amb22482377 [0,2,0,0,0,0|2,0,0]=4 4058 B14R1.29 CCCC(=O)OC(C)c1ccccc1 Amb22363249 [0,2,0,0,0,0|0,0,0]=2 4059 B14R1.29 CCNC(=N)NC(C)c1ccccc1 Amb19073531 [0,2,0,0,0,0|2,0,0]=4 4060 B14R1.29 CCNC(=N)N[C@@H](C)c1ccccc1 Amb25170606 [0,2,0,0,0,0|2,0,0]=4 4061 B14R1.29 CCNC(=O)CN(C)c1ccccc1 Amb19971419 [0,2,0,0,0,0|2,0,0]=4 4062 B14R1.29 CCNC(=O)NC(C)c1cc[n]cc1 Amb24421499 [0,2,0,0,0,0|2,0,0]=4 4063 B14R1.29 CCOC(=O)C[C@@H](N)c1ccccc1 Amb19051013 [0,2,0,0,0,0|2,0,0]=4 4064 B14R1.29 CCOC(=O)C[C@H](c1ccccc1)O Amb10070415 [0,2,0,0,0,0|2,0,0]=4 4065 B14R1.29 CCOC(=O)NC(c1ccccc1)C Amb2558890 [0,2,0,0,0,0|1,0,0]=3 4066 B14R1.29 CCOC(=O)\C=C(/c1ccccc1)\C Amb10566527 [0,2,0,0,0,0|1,0,1]=4 4067 B14R1.29 CN(NC(=O)NCC)c1ccccc1 Amb24336746 [0,2,0,0,0,0|2,0,0]=4 4068 B14R1.29 COCC(=O)NC(C)c1ccc[n]c1 Amb19210048 [0,2,0,0,0,0|2,0,0]=4 4069 B14R1.29 COCC(=O)NC(c1ccncc1)C Amb13958099 [0,2,0,0,0,0|2,0,0]=4 4070 B14R1.29 COCC(=O)N[C@@H](C)c1ccccc1 Amb23166824 [0,2,0,0,0,0|1,0,0]=3 4071 B14R1.29 CSCC(=O)NC(C)c1ccc[n]c1 Amb21142213 [0,2,0,0,0,0|2,0,0]=4 4072 B14R1.29 CSCC(=O)NC(c1ccccc1)C Amb13957661 [0,2,0,0,0,0|1,0,0]=3 4073 B14R1.29 C[C@@H](NC(=O)N=[N+]=[N-])c1ccccc1 Amb25685930 [0,2,0,0,0,0|2,0,0]=4 4074 B14R1.29 C\C(\NC#N)=N\C(C)c1ccccc1 Amb24618110 [0,2,0,0,0,0|2,0,0]=4 4075 B14R1.29 C\C=C\C(=O)NC(C)c1ccc[n]c1 Amb25285889 [0,2,0,0,0,0|2,0,0]=4 4076 B14R1.29 C\C=C\C(=O)NC(C)c1cccc[n]1 Amb25712484 [0,2,0,0,0,0|2,0,0]=4 4077 B14R1.29 C\C=C\C(=O)N[C@@H](C)c1ccc[n]c1 Amb25165342 [0,2,0,0,0,0|2,0,0]=4 4078 B14R1.29 C\C=C\C(=O)N[C@@H](C)c1cccc[n]1 Amb25185758 [0,2,0,0,0,0|2,0,0]=4 4079 B14R1.29 C\C=C\C(=O)N[C@@H](C)c1ccccc1 Amb25266904 [0,2,0,0,0,0|1,0,0]=3 4080 B14R1.29 C\C=C\C(=O)N[C@H](C)c1cc[n]cc1 Amb24433572 [0,2,0,0,0,0|2,0,0]=4 4081 B14R1.29 C\C=C\C(=O)N[C@H](C)c1ccccc1 Amb24600012 [0,2,0,0,0,0|1,0,0]=3 4082 B14R1.29 C\C=C\C(=S)NC(C)c1ccccc1 Amb25090828 [0,2,0,0,0,0|1,1,0]=4 4083 B14R1.29 C\C=C\C(=S)N[C@@H](C)c1ccccc1 Amb25166190 [0,2,0,0,0,0|1,1,0]=4 4084 B14R1.29 ClCCC(=O)NC(c1ccccc1)C Amb1106284 [0,2,0,0,0,0|1,0,0]=3 4085 B14R1.29 OCCC(=O)NC(c1ccccc1)C Amb17336606 [0,2,0,0,0,0|1,0,0]=3 4086 B14R1.29 [C-]#[N+]CC(=O)NC(C)c1ccccc1 Amb24452588 [0,2,0,0,0,0|1,0,0]=3 4087 B14R1.29 [C-]#[N+]CC(=O)N[C@@H](C)c1ccccc1 Amb25840960 [0,2,0,0,0,0|1,0,0]=3 4088 B14R1.58 CNC(NC(C)c1ccccc1)=NC Amb20631907 [0,2,0,0,0,0|2,0,0]=4 4089 B14R1.58 CN\C(=N\C)\SC(C)c1ccccc1 Amb25293833 [0,2,0,0,0,0|1,1,0]=4 4090 B14R1.58 CN\C(\N[C@@H](C)c1ccccc1)=N\C Amb24603079 [0,2,0,0,0,0|2,0,0]=4 4091 B14R1.85 CC(=C=C)C(O)C(C)c1ccccc1 Amb24354363 [0,2,0,0,0,0|2,0,0]=4 4092 B14R1.85 CC(C(Cl)C(=O)OC)c1ccccc1 Amb22059076 [0,2,0,0,0,0|1,0,0]=3 4093 B14R1.85 CC(C(N)C(=O)OC)c1ccccc1 Amb19013065 [0,2,0,0,0,0|1,0,0]=3 4094 B14R1.85 CC(C(N)c1ccccc1)C(=O)OC Amb20623659 [0,2,0,0,0,0|2,0,0]=4 4095 B14R1.85 CC(C(O)c1ccccc1)C(=O)NC Amb25166106 [0,2,0,0,0,0|2,0,0]=4 4096 B14R1.85 CN(C(C)c1cc[n]cc1)C(=O)NC Amb24607653 [0,2,0,0,0,0|2,0,0]=4 4097 B14R1.85 CN(C(C)c1cccc[n]1)C(=O)CCl Amb21861860 [0,2,0,0,0,0|2,0,0]=4 4098 B14R1.85 CN(C(C)c1cccc[n]1)C(=O)CN Amb21861876 [0,2,0,0,0,0|2,0,0]=4 4099 B14R1.85 CN(C(C)c1ccccc1)C(=S)NC Amb24545436 [0,2,0,0,0,0|1,1,0]=4 4100 B14R1.85 CNC(=O)C(Cl)C(O)c1ccccc1 Amb25790564 [0,2,0,0,0,0|2,0,0]=4 4101 B14R1.85 CNC(=O)C(N)C(F)c1ccccc1 Amb24757801 [0,2,0,0,0,0|2,0,0]=4 4102 B14R1.85 CNC(=O)C(O)C(O)c1ccccc1 Amb25035731 [0,2,0,0,0,0|2,0,0]=4 4103 B14R1.85 CNC(=O)N(O)C(C)c1ccccc1 Amb25678566 [0,2,0,0,0,0|1,0,0]=3 4104 B14R1.85 CNC(=O)[C@@H](N)[C@H](F)c1ccccc1 Amb25738665 [0,2,0,0,0,0|2,0,0]=4 4105 B14R1.85 COC(=O)C(=O)C(Cl)c1ccccc1 Amb18866388 [0,2,0,0,0,0|2,0,0]=4 4106 B14R1.85 COC(=O)C(=O)C(c1ccccc1)C Amb17139343 [0,2,0,0,0,0|1,0,0]=3 4107 B14R1.85 COC(=O)C(=O)N(c1ccccc1)C Amb2438091 [0,2,0,0,0,0|2,0,0]=4 4108 B14R1.85 COC(=O)[C@@H](O)[C@@H](N)c1ccccc1 Amb23439859 [0,2,0,0,0,0|2,0,0]=4 4109 B14R1.85 COC(=O)[C@@H](O)[C@H](Cl)c1ccccc1 Amb17844463 [0,2,0,0,0,0|2,0,0]=4 4110 B14R1.85 COC(=O)[C@@H](O)[C@H](N)c1ccccc1 Amb22744727 [0,2,0,0,0,0|2,0,0]=4 4111 B14R1.85 COC(=O)[C@@H](O)[C@H](O)c1ccccc1 Amb22336526 [0,2,0,0,0,0|2,0,0]=4 4112 B14R1.85 COC(=O)[C@@H]([C@H](c1ccccc1)N)O Amb10603125 [0,2,0,0,0,0|2,0,0]=4 4113 B14R1.85 COC(=O)[C@H](O)[C@@H](O)c1ccccc1 Amb22230835 [0,2,0,0,0,0|2,0,0]=4 4114 B14R1.85 ClCC(=O)N(C(c1ccccc1)C)C Amb2333311 [0,2,0,0,0,0|1,0,0]=3 4115 B14R1.85 NCC(=O)N(C(c1ccccc1)C)C Amb17235469 [0,2,0,0,0,0|1,0,0]=3 4116 B14R1.85 OCC(=O)N(C(c1ccccc1)C)C Amb1109670 [0,2,0,0,0,0|1,0,0]=3 4117 B14R1.587 CC(NC(=O)CBr)c1ccccc1Br Amb25098743 [0,2,0,0,0,0|1,0,0]=3 4118 B14R1.587 CC(NC(=O)CBr)c1ccccc1Cl Amb25112968 [0,2,0,0,0,0|1,0,0]=3 4119 B14R1.587 CC(NC(=O)CBr)c1ccccc1F Amb25753587 [0,2,0,0,0,0|1,0,0]=3 4120 B14R1.587 CC(NC(=O)CI)c1ccccc1Cl Amb24510684 [0,2,0,0,0,0|1,0,0]=3 4121 B14R1.587 CC(NC(=O)CN)c1ccccc1Br Amb24770023 [0,2,0,0,0,0|1,0,0]=3 4122 B14R1.587 CC(NC(=O)CN)c1ccccc1Cl Amb18972405 [0,2,0,0,0,0|1,0,0]=3 4123 B14R1.587 CC(NC(=O)CN)c1ccccc1Cl Amb24770026 [0,2,0,0,0,0|1,0,0]=3 4124 B14R1.587 CC(NC(=O)CN)c1ccccc1F Amb18970031 [0,2,0,0,0,0|1,0,0]=3 4125 B14R1.587 CC(NC(=O)NN)c1ccccc1F Amb19054051 [0,2,0,0,0,0|2,0,0]=4 4126 B14R1.587 CCC(=N)NC(C)c1ccccc1F Amb25130857 [0,2,0,0,0,0|2,0,0]=4 4127 B14R1.587 CCC(=O)NC(C)c1ccccc1Br Amb20685170 [0,2,0,0,0,0|1,0,0]=3 4128 B14R1.587 CCC(=O)N[C@@H](C)c1ccccc1Br Amb24624981 [0,2,0,0,0,0|1,0,0]=3 4129 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1Cl Amb25360380 [0,2,0,0,0,0|1,0,0]=3 4130 B14R1.587 CCC(=O)N[C@H](C)c1ccccc1F Amb25204075 [0,2,0,0,0,0|1,0,0]=3 4131 B14R1.587 CNC(=N)NC(C)c1ccccc1Cl Amb25085374 [0,2,0,0,0,0|2,0,0]=4 4132 B14R1.587 CNC(=N)NC(C)c1ccccc1F Amb19063435 [0,2,0,0,0,0|2,0,0]=4 4133 B14R1.587 CNC(=N)N[C@@H](C)c1ccccc1Cl Amb25170516 [0,2,0,0,0,0|2,0,0]=4 4134 B14R1.587 CNC(=N)N[C@H](C)c1ccccc1Br Amb25281442 [0,2,0,0,0,0|2,0,0]=4 4135 B14R1.587 CNC(=O)CC(c1ccccc1C)C Amb17235147 [0,2,0,0,0,0|1,0,0]=3 4136 B14R1.587 CNC(=O)CC(c1ccccc1C)N Amb17235447 [0,2,0,0,0,0|2,0,0]=4 4137 B14R1.587 CNC(=O)CC(c1ccccc1Cl)C Amb17241037 [0,2,0,0,0,0|1,0,0]=3 4138 B14R1.587 CNC(=O)CC(c1ccccc1Cl)N Amb17241278 [0,2,0,0,0,0|2,0,0]=4 4139 B14R1.587 CNC(=O)CC(c1ccccc1F)C Amb17236178 [0,2,0,0,0,0|1,0,0]=3 4140 B14R1.587 CNC(=O)CC(c1ccccc1F)N Amb17236390 [0,2,0,0,0,0|2,0,0]=4 4141 B14R1.587 CNC(=O)NC(C)c1ccccc1F Amb25358401 [0,2,0,0,0,0|1,0,0]=3 4142 B14R1.587 CNC(=O)NC(c1ccccc1Cl)C Amb11258574 [0,2,0,0,0,0|1,0,0]=3 4143 B14R1.587 CNC(=S)NC(C)c1ccccc1Cl Amb25687639 [0,2,0,0,0,0|1,1,0]=4 4144 B14R1.587 COC(=O)CC(c1ccccc1Cl)N Amb1106205 [0,2,0,0,0,0|2,0,0]=4 4145 B14R1.587 COC(=O)CC(c1ccccc1F)N Amb1080280 [0,2,0,0,0,0|2,0,0]=4 4146 B14R1.587 COC(=O)N[C@H](C)c1c[n]ccc1Cl Amb25127377 [0,2,0,0,0,0|2,0,0]=4 4147 B14R1.587 C[C@@H](NC(=O)C=C)c1ccccc1Br Amb25360635 [0,2,0,0,0,0|1,0,1]=4 4148 B14R1.587 C[C@@H](NC(=O)CBr)c1ccccc1Br Amb24726869 [0,2,0,0,0,0|1,0,0]=3 4149 B14R1.587 C[C@@H](NC(=O)CBr)c1ccccc1Cl Amb24590082 [0,2,0,0,0,0|1,0,0]=3 4150 B14R1.587 C[C@@H](NC(=O)CBr)c1ccccc1F Amb25805771 [0,2,0,0,0,0|1,0,0]=3 4151 B14R1.587 C[C@@H](NC(=O)CCl)c1ccccc1Cl Amb25165654 [0,2,0,0,0,0|1,0,0]=3 4152 B14R1.587 C[C@@H](NC(=O)CCl)c1ccccc1F Amb24643283 [0,2,0,0,0,0|1,0,0]=3 4153 B14R1.587 C[C@@H](NC(=O)CN)c1ccccc1Br Amb24726868 [0,2,0,0,0,0|1,0,0]=3 4154 B14R1.587 C[C@@H](NC(=O)CN)c1ccccc1Cl Amb24465458 [0,2,0,0,0,0|1,0,0]=3 4155 B14R1.587 C[C@@H](NC(=O)CN)c1ccccc1F Amb25165247 [0,2,0,0,0,0|1,0,0]=3 4156 B14R1.587 C[C@H](NC(=O)C=C)c1ccccc1Br Amb25348117 [0,2,0,0,0,0|1,0,1]=4 4157 B14R1.587 C[C@H](NC(=O)C=C)c1ccccc1Cl Amb25690004 [0,2,0,0,0,0|1,0,1]=4 4158 B14R1.587 C[C@H](NC(=O)CN)c1ccccc1Br Amb25165298 [0,2,0,0,0,0|1,0,0]=3 4159 B14R1.587 C\C(=C/C(=O)OC)\c1ccccc1Cl Amb25776873 [0,2,0,0,0,0|1,0,1]=4 4160 B14R1.587 C\C(=C/C(=O)OC)\c1ccccc1O Amb25094328 [0,2,0,0,0,0|1,0,1]=4 4161 B14R1.587 C\C(=C\C(=O)OC)\c1ccccc1Br Amb24687209 [0,2,0,0,0,0|1,0,1]=4 4162 B14R1.587 C\C(=C\C(=O)OC)\c1ccccc1Cl Amb24463095 [0,2,0,0,0,0|1,0,1]=4 4163 B14R1.587 C\C(=C\C(=O)OC)\c1ccccc1F Amb25856433 [0,2,0,0,0,0|1,0,1]=4 4164 B14R1.587 C\C(\CO)=C/C(C)c1ccccc1O Amb18651241 [0,2,0,0,0,0|1,0,1]=4 4165 B14R1.587 Cc1ccccc1C(C)NC(=N)CC Amb24372356 [0,2,0,0,0,0|2,0,0]=4 4166 B14R1.587 Cc1ccccc1C(C)NC(=N)NC Amb19073523 [0,2,0,0,0,0|2,0,0]=4 4167 B14R1.587 Cc1ccccc1C(C)NC(=O)CC Amb19555980 [0,2,0,0,0,0|1,0,0]=3 4168 B14R1.587 Cc1ccccc1C(C)NC(=O)CI Amb25090113 [0,2,0,0,0,0|1,0,0]=3 4169 B14R1.587 Cc1ccccc1C(C)NC(=O)CN Amb18972432 [0,2,0,0,0,0|1,0,0]=3 4170 B14R1.587 Cc1ccccc1C(C)NC(=O)NN Amb19051092 [0,2,0,0,0,0|2,0,0]=4 4171 B14R1.587 Cc1ccccc1[C@@H](C)NC(=N)NC Amb25303511 [0,2,0,0,0,0|2,0,0]=4 4172 B14R1.587 Cc1ccccc1[C@@H](C)NC(=O)C=C Amb25165300 [0,2,0,0,0,0|1,0,1]=4 4173 B14R1.587 Cc1ccccc1[C@@H](C)NC(=O)CBr Amb25198103 [0,2,0,0,0,0|1,0,0]=3 4174 B14R1.587 Cc1ccccc1[C@@H](C)NC(=O)CCl Amb25849526 [0,2,0,0,0,0|1,0,0]=3 4175 B14R1.587 Cc1ccccc1[C@@H](C)NC(=O)CN Amb25374756 [0,2,0,0,0,0|1,0,0]=3 4176 B14R1.587 Cc1ccccc1[C@@H](C)NC(=O)OC Amb25036982 [0,2,0,0,0,0|1,0,0]=3 4177 B14R1.587 Cc1ccccc1[C@@H](O)CC(=O)OC Amb19515343 [0,2,0,0,0,0|2,0,0]=4 4178 B14R1.587 Cc1ccccc1[C@H](C)NC(=O)CBr Amb25354143 [0,2,0,0,0,0|1,0,0]=3 4179 B14R1.587 Cc1ccccc1[C@H](C)NC(=O)CC Amb24425789 [0,2,0,0,0,0|1,0,0]=3 4180 B14R1.587 Cc1ccccc1[C@H](C)NC(=O)CCl Amb25126299 [0,2,0,0,0,0|1,0,0]=3 4181 B14R1.587 Cc1ccccc1[C@H](C)NC(=O)OC Amb24392176 [0,2,0,0,0,0|1,0,0]=3 4182 B14R1.587 Cc1ccccc1\C(\C)=C/C(=O)OC Amb24701693 [0,2,0,0,0,0|1,0,1]=4 4183 B14R1.587 Cc1ccccc1\C(\C)=C\C(=O)OC Amb25228450 [0,2,0,0,0,0|1,0,1]=4 4184 B14R1.587 ClCC(=O)NC(c1ccccc1Br)C Amb1105988 [0,2,0,0,0,0|1,0,0]=3 4185 B14R1.587 ClCC(=O)NC(c1ccccc1C)C Amb2281712 [0,2,0,0,0,0|1,0,0]=3 4186 B14R1.587 ClCC(=O)NC(c1ccccc1Cl)C Amb2281869 [0,2,0,0,0,0|1,0,0]=3 4187 B14R1.741 BrCC(=O)NC(c1ccccc1)(C)C Amb17327265 [0,2,0,0,0,0|1,0,0]=3 4188 B14R1.741 BrCC(=O)NC(c1ccccn1)(C)C Amb17323515 [0,2,0,0,0,0|2,0,0]=4 4189 B14R1.741 BrCC(=O)NC(c1cccnc1)(C)C Amb17332407 [0,2,0,0,0,0|2,0,0]=4 4190 B14R1.741 BrCC(=O)NC(c1ccncc1)(C)C Amb17330361 [0,2,0,0,0,0|2,0,0]=4 4191 B14R1.741 CC(C)(NC(=O)C=C)c1ccccc1 Amb24506530 [0,2,0,0,0,0|1,0,1]=4 4192 B14R1.741 CC(C)(NC(=O)CC)c1ccccc1 Amb25689494 [0,2,0,0,0,0|1,0,0]=3 4193 B14R1.741 CC(C)(NC(=O)NN)c1ccccc1 Amb25121664 [0,2,0,0,0,0|2,0,0]=4 4194 B14R1.741 CC(C)(OC(=O)NN)c1cc[n]cc1 Amb25320568 [0,2,0,0,0,0|2,0,0]=4 4195 B14R1.741 CC(C)(OC(=O)NN)c1ccccc1 Amb25083399 [0,2,0,0,0,0|1,0,0]=3 4196 B14R1.741 CC(O)(CC(=O)NC)c1ccccc1 Amb25800022 [0,2,0,0,0,0|1,0,0]=3 4197 B14R1.741 CNC(=O)N=S(C)(=O)c1ccccc1 Amb24605066 [0,2,0,0,0,0|2,0,0]=4 4198 B14R1.741 CNC(=O)NC(C)(C)c1ccccc1 Amb24424436 [0,2,0,0,0,0|1,0,0]=3 4199 B14R1.741 CNC(=S)NC(c1ccccc1)(C)C Amb14176390 [0,2,0,0,0,0|1,1,0]=4 4200 B14R1.741 CS(=O)(=NC(=O)CCl)c1ccccc1 Amb25226877 [0,2,0,0,0,0|2,0,0]=4 4201 B14R1.741 ClCC(=O)NC(c1ccccc1)(C)C Amb17327772 [0,2,0,0,0,0|1,0,0]=3 4202 B14R1.741 ClCC(=O)NC(c1ccccn1)(C)C Amb17325305 [0,2,0,0,0,0|2,0,0]=4 4203 B14R1.741 ClCC(=O)NC(c1cccnc1)(C)C Amb17323232 [0,2,0,0,0,0|2,0,0]=4 4204 B14R1.741 ClCC(=O)NC(c1ccncc1)(C)C Amb17332135 [0,2,0,0,0,0|2,0,0]=4 4205 B14R1.3297 C#CC(=O)NC(CO)c1ccccc1 Amb24589581 [0,2,0,0,0,0|1,0,1]=4 4206 B14R1.3297 C#CC(=O)N[C@@H](CO)c1ccccc1 Amb24348222 [0,2,0,0,0,0|1,0,1]=4 4207 B14R1.3297 CCC(=O)NC(c1ccccc1)C#N Amb17335968 [0,2,0,0,0,0|1,0,1]=4 4208 B14R1.3297 CCC(NC(=O)CN)c1ccccc1 Amb19074013 [0,2,0,0,0,0|1,0,0]=3 4209 B14R1.3297 CCC(NC(=O)NN)c1ccccc1 Amb19061783 [0,2,0,0,0,0|2,0,0]=4 4210 B14R1.3297 CCC(c1ccccc1)CC(=O)NC Amb17235145 [0,2,0,0,0,0|1,0,0]=3 4211 B14R1.3297 CCC(c1ccccc1)NC(=O)CBr Amb17325196 [0,2,0,0,0,0|1,0,0]=3 4212 B14R1.3297 CCN(CC(=O)NC)c1ccccc1 Amb19967477 [0,2,0,0,0,0|2,0,0]=4 4213 B14R1.3297 CC[C@@H](c1ccccc1)NC(=O)CC Amb10559461 [0,2,0,0,0,0|1,0,0]=3 4214 B14R1.3297 CC[C@@H](c1ccccc1)NC(=O)OC Amb10559460 [0,2,0,0,0,0|1,0,0]=3 4215 B14R1.3297 CNC(=N)NC(CC)c1ccccc1 Amb19073519 [0,2,0,0,0,0|2,0,0]=4 4216 B14R1.3297 CNC(=N)N[C@@H](CC)c1ccccc1 Amb25339467 [0,2,0,0,0,0|2,0,0]=4 4217 B14R1.3297 CNC(=O)CC(c1ccccc1)C#N Amb17401189 [0,2,0,0,0,0|1,0,1]=4 4218 B14R1.3297 CNC(=O)NC(CN)c1ccccc1 Amb18910466 [0,2,0,0,0,0|1,0,0]=3 4219 B14R1.3297 CNC(=O)N[C@H](CC)c1ccccc1 Amb25327671 [0,2,0,0,0,0|1,0,0]=3 4220 B14R1.3297 CNC(=O)OC(C#C)c1ccccc1 Amb24419937 [0,2,0,0,0,0|0,0,1]=3 4221 B14R1.3297 CNC(=O)\C=C(\SC)/c1ccccc1 Amb25243048 [0,2,0,0,0,0|1,0,1]=4 4222 B14R1.3297 CN\C(=C\C(=O)NC)\c1ccccc1 Amb24571935 [0,2,0,0,0,0|1,0,1]=4 4223 B14R1.3297 COC(=O)NC(C#N)c1ccccc1 Amb19060872 [0,2,0,0,0,0|1,0,1]=4 4224 B14R1.3297 C\C=C(\CC(=O)NC)/c1ccccc1 Amb25201547 [0,2,0,0,0,0|1,0,1]=4 4225 B14R1.3297 NCC(c1ccccc1)CC(=O)NC Amb17401665 [0,2,0,0,0,0|1,0,0]=3 4226 B14R1.3297 NCC(c1ccccc1)CC(=O)OC Amb17401739 [0,2,0,0,0,0|1,0,0]=3 4227 B14R1.3297 OCC(c1ccccc1)NC(=O)CC Amb17139390 [0,2,0,0,0,0|1,0,0]=3 4228 B14R1.2 CC(=O)CC(O)c1ccc(cc1)C#C Amb24584044 [0,2,0,0,0,0|2,0,0]=4 4229 B14R1.2 CC(=O)CC(O)c1ccc(cc1)C#N Amb25246249 [0,2,0,0,0,0|2,0,0]=4 4230 B14R1.2 CC(=O)CN(C)c1ccc(cc1)C#N Amb19046989 [0,2,0,0,0,0|2,0,0]=4 4231 B14R1.2 CC(=O)C[C@@H](O)c1ccc(cc1)C#N Amb24361911 [0,2,0,0,0,0|2,0,0]=4 4232 B14R1.2 CC(=O)NC(C)c1c[n]c(cc1)OC Amb24551078 [0,2,0,0,0,0|2,0,0]=4 4233 B14R1.2 CC(=O)NC(C)c1ccc(CC)cc1 Amb23253399 [0,2,0,0,0,0|1,0,0]=3 4234 B14R1.2 CC(=O)NC(C)c1ccc(CCl)cc1 Amb25136383 [0,2,0,0,0,0|1,0,0]=3 4235 B14R1.2 CC(=O)NC(C)c1ccc(CN)cc1 Amb18982296 [0,2,0,0,0,0|1,0,0]=3 4236 B14R1.2 CC(=O)NC(C)c1ccc(CO)cc1 Amb25350454 [0,2,0,0,0,0|1,0,0]=3 4237 B14R1.2 CC(=O)NC(C)c1ccc(cc1)C#N Amb24073029 [0,2,0,0,0,0|1,0,0]=3 4238 B14R1.2 CC(=O)N[C@@H](C)c1c[n]c(cc1)OC Amb24743206 [0,2,0,0,0,0|2,0,0]=4 4239 B14R1.2 CC(=O)N[C@@H](C)c1ccc(CO)cc1 Amb25779360 [0,2,0,0,0,0|1,0,0]=3 4240 B14R1.2 CC(=O)N[C@@H](C)c1ccc(cc1)C#C Amb24644738 [0,2,0,0,0,0|1,0,0]=3 4241 B14R1.2 CC(=O)N[C@H](C)c1ccc(CCl)cc1 Amb24613616 [0,2,0,0,0,0|1,0,0]=3 4242 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#C Amb24704262 [0,2,0,0,0,0|1,0,0]=3 4243 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)C#N Amb24418066 [0,2,0,0,0,0|1,0,0]=3 4244 B14R1.2 CC(=O)N[C@H](C)c1ccc(cc1)OC Amb25107266 [0,2,0,0,0,0|1,0,0]=3 4245 B14R1.2 CC(CC(N)=O)c1ccc(cc1)C#N Amb18649950 [0,2,0,0,0,0|2,0,0]=4 4246 B14R1.2 CC(NC(N)=O)c1ccc(CN)cc1 Amb18969897 [0,2,0,0,0,0|2,0,0]=4 4247 B14R1.2 CC(c1ccc(cc1)C#N)OC(=O)C Amb17594909 [0,2,0,0,0,0|0,0,0]=2 4248 B14R1.2 CCc1ccc(cc1)C(CC(=O)N)C Amb17235123 [0,2,0,0,0,0|2,0,0]=4 4249 B14R1.2 COc1ccc(cc1)C(/C)=C/C(C)=O Amb17778943 [0,2,0,0,0,0|1,0,1]=4 4250 B14R1.2 COc1ccc(cc1)C(CC(=O)N)C Amb17235622 [0,2,0,0,0,0|2,0,0]=4 4251 B14R1.2 CSc1ccc(cc1)C(C)CC(O)=O Amb18896194 [0,2,0,0,0,0|2,0,0]=4 4252 B14R1.2 C\C(=C/C(C)=O)\c1ccc(CC)cc1 Amb25713175 [0,2,0,0,0,0|1,0,1]=4 4253 B14R1.2 C\C(=C/C(C)=O)\c1ccc(cc1)SC Amb25116125 [0,2,0,0,0,0|1,0,1]=4 4254 B14R1.2 C\C(=C\C(C)=O)\c1ccc(cc1)C#N Amb24718982 [0,2,0,0,0,0|1,0,1]=4 4255 B14R1.132 BrC(C(C(=O)C)Br)c1ccc(cc1)Cl Amb2433255 [0,2,0,0,0,0|2,0,0]=4 4256 B14R1.132 CC(=C)C(=O)C(C)c1ccc(N)cc1 Amb25366376 [0,2,0,0,0,0|2,0,0]=4 4257 B14R1.132 CC(=N)N(C)C(C)c1ccc(Cl)cc1 Amb25164746 [0,2,0,0,0,0|2,0,0]=4 4258 B14R1.132 CC(=O)C(=C)C(O)c1ccc(F)cc1 Amb25848604 [0,2,0,0,0,0|2,0,0]=4 4259 B14R1.132 CC(=O)C(=C)C(O)c1ccc(O)cc1 Amb25752582 [0,2,0,0,0,0|2,0,0]=4 4260 B14R1.132 CC(=O)C(Br)C(C)c1ccc(Br)cc1 Amb24510717 [0,2,0,0,0,0|1,0,0]=3 4261 B14R1.132 CC(=O)C(Br)C(C)c1ccc(F)cc1 Amb24696136 [0,2,0,0,0,0|1,0,0]=3 4262 B14R1.132 CC(=O)N(C)C(C)c1ccc(Br)cc1 Amb25676582 [0,2,0,0,0,0|1,0,0]=3 4263 B14R1.132 CC(=O)N(C)C(C)c1ccc(Cl)cc1 Amb25731242 [0,2,0,0,0,0|1,0,0]=3 4264 B14R1.132 CC(=O)N(C)C(C)c1ccc(O)cc1 Amb19051003 [0,2,0,0,0,0|1,0,0]=3 4265 B14R1.132 CC(=O)N(C)[C@@H](C)c1ccc(O)cc1 Amb25729209 [0,2,0,0,0,0|1,0,0]=3 4266 B14R1.132 CC(=O)[C@@H](Cl)[C@@H](O)c1ccc(F)cc1 Amb24539280 [0,2,0,0,0,0|2,0,0]=4 4267 B14R1.132 CC(=O)[C@@H](O)[C@@H](O)c1ccc(F)cc1 Amb25803025 [0,2,0,0,0,0|2,0,0]=4 4268 B14R1.132 CC(=O)[C@H](Cl)[C@H](O)c1ccc(F)cc1 Amb25309554 [0,2,0,0,0,0|2,0,0]=4 4269 B14R1.132 CC(=O)[C@H](O)[C@@H](O)c1ccc(F)cc1 Amb25069715 [0,2,0,0,0,0|2,0,0]=4 4270 B14R1.132 CC(=O)[C@H](O)[C@H](O)c1ccc(F)cc1 Amb25343905 [0,2,0,0,0,0|2,0,0]=4 4271 B14R1.132 CC(C(=C)C(O)=O)c1ccc(F)cc1 Amb24634260 [0,2,0,0,0,0|2,0,0]=4 4272 B14R1.132 CC(C(Br)C(C)=O)c1ccc(C)cc1 Amb25324813 [0,2,0,0,0,0|1,0,0]=3 4273 B14R1.132 CC(C(C)c1ccc(Br)cc1)C(O)=O Amb18692614 [0,2,0,0,0,0|2,0,0]=4 4274 B14R1.132 CC(C(C)c1ccc(Cl)cc1)C(O)=O Amb25237125 [0,2,0,0,0,0|2,0,0]=4 4275 B14R1.132 CC(C(C)c1ccc(F)cc1)C(O)=O Amb18813112 [0,2,0,0,0,0|2,0,0]=4 4276 B14R1.132 CC(C(Cl)C(O)=O)c1ccc(F)cc1 Amb24539303 [0,2,0,0,0,0|2,0,0]=4 4277 B14R1.132 CC(C(F)C(O)=O)c1ccc(Br)cc1 Amb25200829 [0,2,0,0,0,0|2,0,0]=4 4278 B14R1.132 CC(C(F)C(O)=O)c1ccc(F)cc1 Amb25738779 [0,2,0,0,0,0|2,0,0]=4 4279 B14R1.132 CC(C(F)C(O)=O)c1ccc(I)cc1 Amb25235034 [0,2,0,0,0,0|2,0,0]=4 4280 B14R1.132 CC(C(N)C(O)=O)c1ccc(Cl)cc1 Amb18657526 [0,2,0,0,0,0|2,0,0]=4 4281 B14R1.132 CC(C(N)C(O)=O)c1ccc(N)cc1 Amb18651901 [0,2,0,0,0,0|2,0,0]=4 4282 B14R1.132 CC(c1ccc(F)cc1)N(O)C(N)=O Amb18188130 [0,2,0,0,0,0|2,0,0]=4 4283 B14R1.132 CN(C(C)c1ccc(Cl)cc1)C(N)=O Amb25312996 [0,2,0,0,0,0|2,0,0]=4 4284 B14R1.132 CN(C(C)c1ccc(O)cc1)C(N)=O Amb19051563 [0,2,0,0,0,0|2,0,0]=4 4285 B14R1.132 CN(C(C)c1ccc(O)cc1)S(C)=O Amb24725104 [0,2,0,0,0,0|2,0,0]=4 4286 B14R1.132 C[C@@H]([C@@H](N)C(O)=O)c1ccc(F)cc1 Amb24590238 [0,2,0,0,0,0|2,0,0]=4 4287 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(Br)cc1 Amb24575274 [0,2,0,0,0,0|2,0,0]=4 4288 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(Cl)cc1 Amb24640346 [0,2,0,0,0,0|2,0,0]=4 4289 B14R1.132 C[C@@H]([C@H](N)C(O)=O)c1ccc(O)cc1 Amb25783870 [0,2,0,0,0,0|2,0,0]=4 4290 B14R1.132 C[C@@H]([C@H](O)c1ccc(C)cc1)C(C)=O Amb25357373 [0,2,0,0,0,0|2,0,0]=4 4291 B14R1.132 C[C@H]([C@H](N)C(O)=O)c1ccc(Br)cc1 Amb25198880 [0,2,0,0,0,0|2,0,0]=4 4292 B14R1.132 C[C@H]([C@H](N)C(O)=O)c1ccc(O)cc1 Amb25774999 [0,2,0,0,0,0|2,0,0]=4 4293 B14R1.132 Cc1ccc(cc1)C(C)C(=S)C(O)=O Amb25218249 [0,2,0,0,0,0|2,0,0]=4 4294 B14R1.132 Cc1ccc(cc1)C(C)C(C)C(=O)Cl Amb25677417 [0,2,0,0,0,0|2,0,0]=4 4295 B14R1.132 Cc1ccc(cc1)C(C)C(C)C(O)=O Amb18190563 [0,2,0,0,0,0|2,0,0]=4 4296 B14R1.132 Cc1ccc(cc1)C(C)C(F)C(O)=O Amb25289864 [0,2,0,0,0,0|2,0,0]=4 4297 B14R1.132 Cc1ccc(cc1)C(C)C(N)C(O)=O Amb18651559 [0,2,0,0,0,0|2,0,0]=4 4298 B14R1.132 Cc1ccc(cc1)C(C)C(O)C(O)=O Amb19149343 [0,2,0,0,0,0|2,0,0]=4 4299 B14R1.132 Cc1ccc(cc1)C(C)N(O)C(N)=O Amb25684668 [0,2,0,0,0,0|2,0,0]=4 4300 B14R1.132 Cc1ccc(cc1)C(N)C(=C)C(C)=O Amb24443914 [0,2,0,0,0,0|2,0,0]=4 4301 B14R1.132 Cc1ccc(cc1)C(O)C(=C)C(C)=O Amb24414990 [0,2,0,0,0,0|2,0,0]=4 4302 B14R1.132 Cc1ccc(cc1)C(O)C(O)C(C)=O Amb24575586 [0,2,0,0,0,0|2,0,0]=4 4303 B14R1.132 Cc1ccc(cc1)[C@@H](C)[C@@H](N)C(O)=O Amb25109337 [0,2,0,0,0,0|2,0,0]=4 4304 B14R1.132 Cc1ccc(cc1)[C@H](O)[C@@H](O)C(C)=O Amb24353141 [0,2,0,0,0,0|2,0,0]=4 4305 B14R1.683 CC(C)(C)OC(C)c1ccc(N)cc1 Amb18974005 [0,2,0,0,0,0|1,0,1]=4 4306 B14R1.683 CS(=O)(=O)N[C@@H](C)c1ccc(Cl)cc1 Amb25250489 [0,2,0,0,0,0|2,0,0]=4 4307 B14R1.683 CS(=O)(=O)N[C@@H](C)c1ccc(F)cc1 Amb25723630 [0,2,0,0,0,0|2,0,0]=4 4308 B14R1.683 CS(=O)(=O)N[C@H](C)c1ccc(F)cc1 Amb24378868 [0,2,0,0,0,0|2,0,0]=4 4309 B14R1.683 CS(=O)(=O)OC(C)c1ccc(F)c[n]1 Amb25106307 [0,2,0,0,0,0|2,0,0]=4 4310 B14R1.683 CS(=O)(=O)OC(C)c1ccc(I)cc1 Amb25298821 [0,2,0,0,0,0|1,0,0]=3 4311 B14R1.683 Cc1ccc(cc1)C(C)OS(C)(=O)=O Amb25306680 [0,2,0,0,0,0|1,0,0]=3 4312 B14R1.683 Cc1ccc(cc1)[C@@H](C)NS(C)(=O)=O Amb25704497 [0,2,0,0,0,0|2,0,0]=4 4313 B14R1.683 Cc1ccc(cc1)[C@H](C)NS(C)(=O)=O Amb24730124 [0,2,0,0,0,0|2,0,0]=4 4314 B14R1.685 CC(=O)CC(O)c1cc(Cl)c(Cl)cc1 Amb25750455 [0,2,0,0,0,0|2,0,0]=4 4315 B14R1.685 CC(=O)CC(O)c1cc(F)c(F)cc1 Amb25763837 [0,2,0,0,0,0|2,0,0]=4 4316 B14R1.685 CC(=O)C[C@@H](O)c1ccc(F)c(Cl)c1 Amb25097673 [0,2,0,0,0,0|2,0,0]=4 4317 B14R1.685 CC(=O)C[C@H](O)c1cc(Cl)c(Cl)cc1 Amb25129532 [0,2,0,0,0,0|2,0,0]=4 4318 B14R1.685 CC(=O)NC(C)c1cc(F)c(F)cc1 Amb24510701 [0,2,0,0,0,0|1,0,0]=3 4319 B14R1.685 CC(=O)NC(C)c1ccc(Cl)c(N)c1 Amb24428107 [0,2,0,0,0,0|1,0,0]=3 4320 B14R1.685 CC(=O)N[C@@H](C)c1cc(F)c(F)cc1 Amb24594717 [0,2,0,0,0,0|1,0,0]=3 4321 B14R1.685 CC(CC(N)=O)c1cc(O)c(O)cc1 Amb25193189 [0,2,0,0,0,0|2,0,0]=4 4322 B14R1.685 CC(CC(O)=O)c1cc(O)c(Br)cc1 Amb25028867 [0,2,0,0,0,0|2,0,0]=4 4323 B14R1.685 CC(CC(O)=O)c1cc(O)c(Cl)cc1 Amb24361721 [0,2,0,0,0,0|2,0,0]=4 4324 B14R1.685 CC(CC(O)=O)c1cc(O)c(F)cc1 Amb25184035 [0,2,0,0,0,0|2,0,0]=4 4325 B14R1.685 CC(CC(O)=O)c1cc(O)c(O)cc1 Amb25224446 [0,2,0,0,0,0|2,0,0]=4 4326 B14R1.685 CC(CC(O)=O)c1ccc(Cl)c(Br)c1 Amb24644100 [0,2,0,0,0,0|2,0,0]=4 4327 B14R1.685 CC(CC(O)=O)c1ccc(F)c(Cl)c1 Amb18244368 [0,2,0,0,0,0|2,0,0]=4 4328 B14R1.685 CC(CC(O)=O)c1ccc(F)c(N)c1 Amb25207908 [0,2,0,0,0,0|2,0,0]=4 4329 B14R1.685 C\C(=C\C(C)=O)\c1cc(Br)c(F)cc1 Amb25668139 [0,2,0,0,0,0|1,0,1]=4 4330 B14R1.685 C\C(=C\C(C)=O)\c1cc(C)c(C)cc1 Amb24625402 [0,2,0,0,0,0|1,0,1]=4 4331 B14R1.685 C\C(=C\C(C)=O)\c1cc(Cl)c(F)cc1 Amb25713844 [0,2,0,0,0,0|1,0,1]=4 4332 B14R1.685 Cc1cc(c[n]c1C)C(C)CC(C)=O Amb25275979 [0,2,0,0,0,0|2,0,0]=4 4333 B14R1.685 Cc1cc(ccc1O)C(C)CC(O)=O Amb18651787 [0,2,0,0,0,0|2,0,0]=4 4334 B14R1.685 Cc1ccc(cc1Br)C(C)CC(O)=O Amb22339318 [0,2,0,0,0,0|2,0,0]=4 4335 B14R1.685 Cc1ccc(cc1F)C(C)CC(O)=O Amb25693144 [0,2,0,0,0,0|2,0,0]=4 4336 B14R1.685 Cc1ccc(cc1F)C(C)NC(C)=N Amb25710224 [0,2,0,0,0,0|2,0,0]=4 4337 B14R1.685 Cc1ccc(cc1N)C(C)OC(C)C Amb23541109 [0,2,0,0,0,0|1,0,1]=4 4338 B14R1.685 Cc1ccc(cc1O)C(C)CC(O)=O Amb24595812 [0,2,0,0,0,0|2,0,0]=4 4339 B14R1.685 NC(=O)CC(c1ccc(c(c1)C)C)C Amb17235126 [0,2,0,0,0,0|2,0,0]=4 4340 B14R1.685 NC(=O)CC(c1ccc(c(c1)C)F)C Amb17236172 [0,2,0,0,0,0|2,0,0]=4 4341 B14R1.685 NC(=O)CC(c1ccc(c(c1)F)F)C Amb17236903 [0,2,0,0,0,0|2,0,0]=4 4342 B14R1.694 CC(=C)CC(C)(O)c1ccc(O)cc1 Amb25129007 [0,2,0,0,0,0|2,0,0]=4 4343 B14R1.694 CC(=O)CC(C)(C)c1ccc(O)cc1 Amb18129971 [0,2,0,0,0,0|1,0,0]=3 4344 B14R1.694 CC(=O)NC(C)(C)c1ccc(Cl)c[n]1 Amb25795442 [0,2,0,0,0,0|2,0,0]=4 4345 B14R1.694 CC(=O)NC(c1ccc(cc1)Cl)(C)C Amb16898245 [0,2,0,0,0,0|1,0,0]=3 4346 B14R1.694 CC(=O)OC(C)(C)c1[n]cc(Br)c[n]1 Amb24319095 [0,2,0,0,0,0|2,0,0]=4 4347 B14R1.694 CC(=O)OS(=O)(=O)c1ccc(cc1)C Amb16227183 [0,2,0,0,0,0|2,0,0]=4 4348 B14R1.694 CC(C)(CC(O)=O)c1ccc(I)cc1 Amb22371932 [0,2,0,0,0,0|2,0,0]=4 4349 B14R1.694 CC(C)(CC(O)=O)c1ccc(N)cc1 Amb22372049 [0,2,0,0,0,0|2,0,0]=4 4350 B14R1.694 CC(C)(CC(O)=O)c1ccc(O)cc1 Amb23440688 [0,2,0,0,0,0|2,0,0]=4 4351 B14R1.694 CC(C)=CC(C)(O)c1ccc(O)cc1 Amb24443589 [0,2,0,0,0,0|2,0,0]=4 4352 B14R1.694 CC(F)(CC(O)=O)c1ccc(Br)cc1 Amb24654099 [0,2,0,0,0,0|2,0,0]=4 4353 B14R1.694 CC(N)(CC(O)=O)c1ccc(I)cc1 Amb24664201 [0,2,0,0,0,0|2,0,0]=4 4354 B14R1.694 CC(N)(CC(O)=O)c1ccc(N)cc1 Amb25062541 [0,2,0,0,0,0|2,0,0]=4 4355 B14R1.694 CC(N)(CC(O)=O)c1ccc(O)cc1 Amb24460762 [0,2,0,0,0,0|2,0,0]=4 4356 B14R1.694 C[C@@](N)(CC(O)=O)c1ccc(Br)cc1 Amb25780675 [0,2,0,0,0,0|2,0,0]=4 4357 B14R1.694 C[C@@](N)(CC(O)=O)c1ccc(F)cc1 Amb24736443 [0,2,0,0,0,0|2,0,0]=4 4358 B14R1.694 C[C@@](N)(CC(O)=O)c1ccc(I)cc1 Amb25758977 [0,2,0,0,0,0|2,0,0]=4 4359 B14R1.694 C[C@@](N)(CC(O)=O)c1ccc(O)cc1 Amb25749759 [0,2,0,0,0,0|2,0,0]=4 4360 B14R1.694 C[C@@](N)(CC(O)=O)c1ccc(S)cc1 Amb24638945 [0,2,0,0,0,0|2,0,0]=4 4361 B14R1.694 C[C@](N)(CC(O)=O)c1ccc(Br)cc1 Amb24637735 [0,2,0,0,0,0|2,0,0]=4 4362 B14R1.694 C[C@](N)(CC(O)=O)c1ccc(N)cc1 Amb24744381 [0,2,0,0,0,0|2,0,0]=4 4363 B14R1.694 C[C@](N)(CC(O)=O)c1ccc(O)cc1 Amb24746810 [0,2,0,0,0,0|2,0,0]=4 4364 B14R1.694 Cc1ccc(c[n]1)C(C)(C)CC(C)=O Amb25293571 [0,2,0,0,0,0|2,0,0]=4 4365 B14R1.694 OC(=O)CC(c1ccc(cc1)Br)(C)C Amb17162562 [0,2,0,0,0,0|2,0,0]=4 4366 B14R1.694 OC(=O)CC(c1ccc(cc1)Br)(N)C Amb17473603 [0,2,0,0,0,0|2,0,0]=4 4367 B14R1.694 OC(=O)CC(c1ccc(cc1)Br)(O)C Amb17163101 [0,2,0,0,0,0|2,0,0]=4 4368 B14R1.694 OC(=O)CC(c1ccc(cc1)C)(N)C Amb17470849 [0,2,0,0,0,0|2,0,0]=4 4369 B14R1.694 OC(=O)CC(c1ccc(cc1)C)(O)C Amb17139451 [0,2,0,0,0,0|2,0,0]=4 4370 B14R1.694 OC(=O)CC(c1ccc(cc1)Cl)(C)C Amb17138357 [0,2,0,0,0,0|2,0,0]=4 4371 B14R1.694 OC(=O)CC(c1ccc(cc1)Cl)(N)C Amb17471488 [0,2,0,0,0,0|2,0,0]=4 4372 B14R1.694 OC(=O)CC(c1ccc(cc1)Cl)(O)C Amb17140889 [0,2,0,0,0,0|2,0,0]=4 4373 B14R1.694 OC(=O)CC(c1ccc(cc1)F)(C)C Amb17139590 [0,2,0,0,0,0|2,0,0]=4 4374 B14R1.694 OC(=O)CC(c1ccc(cc1)F)(N)C Amb17470963 [0,2,0,0,0,0|2,0,0]=4 4375 B14R1.694 OC(=O)CC(c1ccc(cc1)F)(O)C Amb17139695 [0,2,0,0,0,0|2,0,0]=4 4376 B14R1.1019 CC(=O)CC(C#N)c1ccc(Br)cc1 Amb25716893 [0,2,0,0,0,0|1,0,1]=4 4377 B14R1.1019 CC(=O)CC(C#N)c1ccc(Cl)cc1 Amb24701534 [0,2,0,0,0,0|1,0,1]=4 4378 B14R1.1019 CC(=O)CC(C#N)c1ccc(F)cc1 Amb25316061 [0,2,0,0,0,0|1,0,1]=4 4379 B14R1.1019 CC(=O)NC(C#C)c1ccc(F)cc1 Amb25207079 [0,2,0,0,0,0|1,0,1]=4 4380 B14R1.1019 CC(=O)NC(C=C)c1ccc(Cl)cc1 Amb24600010 [0,2,0,0,0,0|1,0,1]=4 4381 B14R1.1019 CC(=O)N[C@@H](C#C)c1ccc(F)cc1 Amb25095756 [0,2,0,0,0,0|1,0,1]=4 4382 B14R1.1019 CC(=O)N[C@@H](CC)c1ccc(Cl)cc1 Amb24336634 [0,2,0,0,0,0|1,0,0]=3 4383 B14R1.1019 CC(=O)N[C@H](C#C)c1ccc(Cl)cc1 Amb24342607 [0,2,0,0,0,0|1,0,1]=4 4384 B14R1.1019 CC(=O)N[C@H](C#C)c1ccc(F)cc1 Amb24639182 [0,2,0,0,0,0|1,0,1]=4 4385 B14R1.1019 CC(=O)N[C@H](CC)c1ccc(Cl)cc1 Amb25770537 [0,2,0,0,0,0|1,0,0]=3 4386 B14R1.1019 CC(=O)OC(C#N)c1ccc(Cl)cc1 Amb24507254 [0,2,0,0,0,0|0,0,1]=3 4387 B14R1.1019 CC(=O)OC(C#N)c1ccc(F)cc1 Amb25723073 [0,2,0,0,0,0|0,0,1]=3 4388 B14R1.1019 CC(=O)\C=C(\CC)/c1ccc(Br)cc1 Amb24633825 [0,2,0,0,0,0|1,0,1]=4 4389 B14R1.1019 CC(C)=CC(NC)c1ccc(Cl)cc1 Amb25695069 [0,2,0,0,0,0|2,0,0]=4 4390 B14R1.1019 CC(C)=CC(NC)c1ccc(I)cc1 Amb25166812 [0,2,0,0,0,0|2,0,0]=4 4391 B14R1.1019 CC(C)OC(CC)c1ccc(Br)cc1 Amb23443746 [0,2,0,0,0,0|1,0,1]=4 4392 B14R1.1019 CCC(c1ccc(cc1)Br)NC(=O)C Amb1781431 [0,2,0,0,0,0|1,0,0]=3 4393 B14R1.1019 CCC(c1ccc(cc1)C)CC(=O)N Amb17235150 [0,2,0,0,0,0|2,0,0]=4 4394 B14R1.1019 CCC(c1ccc(cc1)C)NC(=O)C Amb11014212 [0,2,0,0,0,0|1,0,0]=3 4395 B14R1.1019 CCC(c1ccc(cc1)Cl)CC(=O)N Amb17241040 [0,2,0,0,0,0|2,0,0]=4 4396 B14R1.1019 CCC(c1ccc(cc1)Cl)NC(=O)C Amb13994108 [0,2,0,0,0,0|1,0,0]=3 4397 B14R1.1019 CCC(c1ccc(cc1)F)CC(=O)N Amb17236182 [0,2,0,0,0,0|2,0,0]=4 4398 B14R1.1019 C\C=C(\NC(C)=O)/c1ccc(C)cc1 Amb24072837 [0,2,0,0,0,0|1,0,1]=4 4399 B14R1.1019 Cc1ccc(cc1)C(C#C)NC(C)=O Amb24073031 [0,2,0,0,0,0|1,0,1]=4 4400 B14R1.1019 Cc1ccc(cc1)[C@@H](CN)CC(O)=O Amb20241746 [0,2,0,0,0,0|2,0,0]=4 4401 B14R1.1019 Cc1ccc(cc1)[C@H](CN)CC(O)=O Amb20241742 [0,2,0,0,0,0|2,0,0]=4 4402 B14R1.1019 Cc1ccc(cc1)\C(\CC)=C/C(C)=O Amb25782019 [0,2,0,0,0,0|1,0,1]=4 4403 B14R1.1019 N#CC(c1ccc(cc1)Br)NC(=O)C Amb17354082 [0,2,0,0,0,0|1,0,1]=4 4404 B14R1.1019 N#CC(c1ccc(cc1)C)NC(=O)C Amb17335971 [0,2,0,0,0,0|1,0,1]=4 4405 B14R1.1019 N#CC(c1ccc(cc1)Cl)NC(=O)C Amb2434602 [0,2,0,0,0,0|1,0,1]=4 4406 B14R1.1019 N#CC(c1ccc(cc1)F)NC(=O)C Amb17336387 [0,2,0,0,0,0|1,0,1]=4 4407 B14R1.1019 N#CC(c1ccc(cc1)O)NC(=O)C Amb1982392 [0,2,0,0,0,0|1,0,1]=4 4408 B14R1.1019 NCC(c1ccc(cc1)Br)CC(=O)O Amb17415240 [0,2,0,0,0,0|2,0,0]=4 4409 B14R1.1019 NCC(c1ccc(cc1)Br)OC(C)C Amb17605964 [0,2,0,0,0,0|1,0,1]=4 4410 B14R1.1019 NCC(c1ccc(cc1)C)OC(C)C Amb17605979 [0,2,0,0,0,0|1,0,1]=4 4411 B14R1.1019 NCC(c1ccc(cc1)Cl)OC(C)C Amb17605980 [0,2,0,0,0,0|1,0,1]=4 4412 B14R1.1019 NCC(c1ccc(cc1)F)CC(=O)O Amb17217141 [0,2,0,0,0,0|2,0,0]=4 4413 B14R1.1019 NC[C@@H](CC(O)=O)c1ccc(Cl)cc1 Amb22349962 [0,2,0,0,0,0|2,0,0]=4 4414 B14R1.1019 NC[C@@H](CC(O)=O)c1ccc(F)cc1 Amb20241713 [0,2,0,0,0,0|2,0,0]=4 4415 B14R1.1019 NC[C@H](CC(O)=O)c1ccc(Cl)cc1 Amb19930345 [0,2,0,0,0,0|2,0,0]=4 4416 B14R1.1019 NC[C@H](CC(O)=O)c1ccc(F)cc1 Amb20241712 [0,2,0,0,0,0|2,0,0]=4 4417 B14R1.1019 NC[C@H](c1ccc(cc1)Cl)CC(=O)O Amb17608724 [0,2,0,0,0,0|2,0,0]=4 4418 B14R1.1019 OC[C@@H](c1ccc(cc1)Cl)CC(=O)O Amb17611042 [0,2,0,0,0,0|2,0,0]=4 4419 B14R1.1019 [NH3+]CC(c1ccc(cc1)Cl)CC(=O)O Amb10845652 [0,2,0,0,0,0|2,0,0]=4 4420 B14R1.1019 [O-]C(=O)CC(CO)c1ccc(Cl)cc1 Amb22054724 [0,2,0,0,0,0|2,0,0]=4 4421 B14R1.6048 CC(=N)NC(C)c1ccc(Cl)cc1Cl Amb24615490 [0,2,0,0,0,0|2,0,0]=4 4422 B14R1.6048 CC(=O)CC(C)c1ccc(Cl)cc1Cl Amb24634826 [0,2,0,0,0,0|1,0,0]=3 4423 B14R1.6048 CC(=O)CC(C)c1ccc(Cl)cc1F Amb24640125 [0,2,0,0,0,0|1,0,0]=3 4424 B14R1.6048 CC(=O)CC(C)c1ccc(F)cc1F Amb24510659 [0,2,0,0,0,0|1,0,0]=3 4425 B14R1.6048 CC(=O)NC(C)c1[n]cc(Br)cc1F Amb24715532 [0,2,0,0,0,0|2,0,0]=4 4426 B14R1.6048 CC(=O)NC(C)c1ccc(Cl)cc1Cl Amb24348130 [0,2,0,0,0,0|1,0,0]=3 4427 B14R1.6048 CC(=O)NC(C)c1ccc(F)cc1F Amb24510700 [0,2,0,0,0,0|1,0,0]=3 4428 B14R1.6048 CC(=O)NC(C)c1ccc(F)cc1O Amb24694137 [0,2,0,0,0,0|1,0,0]=3 4429 B14R1.6048 CC(=O)N[C@@H](C)c1[n]cc(F)cc1F Amb25779380 [0,2,0,0,0,0|2,0,0]=4 4430 B14R1.6048 CC(=O)N[C@H](C)c1ccc(Br)cc1F Amb25121767 [0,2,0,0,0,0|1,0,0]=3 4431 B14R1.6048 CC(CC(O)=O)c1ccc(Br)cc1Cl Amb25084468 [0,2,0,0,0,0|2,0,0]=4 4432 B14R1.6048 CC(CC(O)=O)c1ccc(Cl)cc1F Amb25702862 [0,2,0,0,0,0|2,0,0]=4 4433 B14R1.6048 C\C(=C\C(C)=O)\c1ccc(Br)cc1Cl Amb25859437 [0,2,0,0,0,0|1,0,1]=4 4434 B14R1.6048 C\C(=C\C(C)=O)\c1ccc(Cl)cc1Cl Amb24646885 [0,2,0,0,0,0|1,0,1]=4 4435 B14R1.6048 Cc1cc(C)c(cc1)C(C)NC(C)=O Amb22906121 [0,2,0,0,0,0|1,0,0]=3 4436 B14R1.6048 Cc1cc(C)c(cc1)N(C)CC(C)=O Amb19041281 [0,2,0,0,0,0|2,0,0]=4 4437 B14R1.6048 Cc1cc(Cl)ccc1C(C)CC(O)=O Amb25326221 [0,2,0,0,0,0|2,0,0]=4 4438 B14R1.6048 Cc1cc(F)ccc1C(C)CC(O)=O Amb25304640 [0,2,0,0,0,0|2,0,0]=4 4439 B14R1.6048 Cc1cc(O)ccc1C(C)CC(O)=O Amb18651790 [0,2,0,0,0,0|2,0,0]=4 4440 B14R1.6048 Cc1ccc(C(C)CC(O)=O)c(O)c1 Amb18651792 [0,2,0,0,0,0|2,0,0]=4 4441 B14R1.6048 NC(=O)CC(c1ccc(cc1C)C)C Amb17235136 [0,2,0,0,0,0|2,0,0]=4 4442 B14R1.74 CC(=O)CN(C)c1cc(ccc1)C#N Amb19046990 [0,2,0,0,0,0|2,0,0]=4 4443 B14R1.74 CC(=O)C[C@@H](O)c1cc(ccc1)C#N Amb25356255 [0,2,0,0,0,0|2,0,0]=4 4444 B14R1.74 CC(=O)C[C@H](O)c1cc(ccc1)C#N Amb25317474 [0,2,0,0,0,0|2,0,0]=4 4445 B14R1.74 CC(=O)NC(C)c1cc(ccc1)C#N Amb24073027 [0,2,0,0,0,0|1,0,0]=3 4446 B14R1.74 CC(=O)NC(C)c1cc(ccc1)OC Amb25730496 [0,2,0,0,0,0|1,0,0]=3 4447 B14R1.74 CC(=O)NC(C)c1cccc(C#C)[n]1 Amb24073032 [0,2,0,0,0,0|2,0,0]=4 4448 B14R1.74 CC(=O)N[C@@H](C)c1cc(ccc1)C#N Amb24336731 [0,2,0,0,0,0|1,0,0]=3 4449 B14R1.74 CC(=O)N[C@@H](C)c1cc(ccc1)OC Amb25758378 [0,2,0,0,0,0|1,0,0]=3 4450 B14R1.74 CC(=O)N[C@H](C)c1cc(ccc1)OC Amb25348941 [0,2,0,0,0,0|1,0,0]=3 4451 B14R1.74 COc1cccc(c1)C(CC(=O)N)C Amb17235628 [0,2,0,0,0,0|2,0,0]=4 4452 B14R1.74 C\C(=C/C(C)=O)\c1cc(ccc1)OC Amb24467160 [0,2,0,0,0,0|1,0,1]=4 4453 B14R1.74 C\C(=C\C(C)=O)\c1cc(ccc1)C#N Amb24454074 [0,2,0,0,0,0|1,0,1]=4 4454 B14R1.150 CC(=O)C(Br)C(C)c1c[n]cc(F)c1 Amb24507648 [0,2,0,0,0,0|2,0,0]=4 4455 B14R1.150 CC(=O)C(Br)C(C)c1cccc(Cl)c1 Amb25732259 [0,2,0,0,0,0|1,0,0]=3 4456 B14R1.150 CC(=O)C(Br)C(C)c1cccc(F)c1 Amb25181187 [0,2,0,0,0,0|1,0,0]=3 4457 B14R1.150 CC(=O)C(Cl)C(O)c1cccc(F)c1 Amb25112169 [0,2,0,0,0,0|2,0,0]=4 4458 B14R1.150 CC(=O)N(C)C(C)c1cccc(Cl)c1 Amb24577567 [0,2,0,0,0,0|1,0,0]=3 4459 B14R1.150 CC(=O)[C@@H](Cl)[C@@H](O)c1cccc(F)c1 Amb25798340 [0,2,0,0,0,0|2,0,0]=4 4460 B14R1.150 CC(C(Br)C(C)=O)c1cc(C)ccc1 Amb24400063 [0,2,0,0,0,0|1,0,0]=3 4461 B14R1.150 CC(C(C)c1cccc(Br)c1)C(O)=O Amb25200830 [0,2,0,0,0,0|2,0,0]=4 4462 B14R1.150 CC(C(C)c1cccc(Cl)c1)C(O)=O Amb25265872 [0,2,0,0,0,0|2,0,0]=4 4463 B14R1.150 CC(C(C)c1cccc(F)c1)C(O)=O Amb25707225 [0,2,0,0,0,0|2,0,0]=4 4464 B14R1.150 CC(C(F)C(O)=O)c1cccc(Br)c1 Amb25200831 [0,2,0,0,0,0|2,0,0]=4 4465 B14R1.150 CC(C(F)C(O)=O)c1cccc(Cl)c1 Amb25213678 [0,2,0,0,0,0|2,0,0]=4 4466 B14R1.150 CC(C(F)C(O)=O)c1cccc(F)c1 Amb25289863 [0,2,0,0,0,0|2,0,0]=4 4467 B14R1.150 CC(C(N)C(O)=O)c1cccc(N)c1 Amb18651902 [0,2,0,0,0,0|2,0,0]=4 4468 B14R1.150 CC(C(O)C(O)=O)c1cccc(F)c1 Amb25139188 [0,2,0,0,0,0|2,0,0]=4 4469 B14R1.150 CN(C(C)c1cccc(Cl)c1)C(N)=O Amb25037811 [0,2,0,0,0,0|2,0,0]=4 4470 B14R1.150 C[C@H]([C@H](N)C(O)=O)c1cccc(N)c1 Amb24552903 [0,2,0,0,0,0|2,0,0]=4 4471 B14R1.150 Cc1cc(ccc1)C(C)C(C)C(O)=O Amb25795828 [0,2,0,0,0,0|2,0,0]=4 4472 B14R1.152 CC(=O)CC(C)c1cccc(Br)c1F Amb24713166 [0,2,0,0,0,0|1,0,0]=3 4473 B14R1.152 CC(=O)CC(C)c1cccc(Cl)c1Cl Amb24664866 [0,2,0,0,0,0|1,0,0]=3 4474 B14R1.152 CC(=O)CC(C)c1cccc(F)c1F Amb24666158 [0,2,0,0,0,0|1,0,0]=3 4475 B14R1.152 CC(=O)CC(O)c1cccc(F)c1F Amb25750460 [0,2,0,0,0,0|2,0,0]=4 4476 B14R1.152 CC(CC(=O)Cl)c1cccc(F)c1F Amb24507197 [0,2,0,0,0,0|2,0,0]=4 4477 B14R1.152 CC(CC(O)=O)c1cccc(Br)c1F Amb24609723 [0,2,0,0,0,0|2,0,0]=4 4478 B14R1.152 CC(CC(O)=O)c1cccc(Cl)c1F Amb25045555 [0,2,0,0,0,0|2,0,0]=4 4479 B14R1.152 CC(CC(O)=O)c1cccc(O)c1F Amb25056756 [0,2,0,0,0,0|2,0,0]=4 4480 B14R1.152 CC(NC(C)=O)c1cccc(C)c1O Amb24398686 [0,2,0,0,0,0|1,0,0]=3 4481 B14R1.152 CC(c1cccc(c1C)C)CC(=O)N Amb17235152 [0,2,0,0,0,0|2,0,0]=4 4482 B14R1.152 CC(c1cccc(c1C)C)CC(=O)O Amb17235417 [0,2,0,0,0,0|2,0,0]=4 4483 B14R1.152 Cc1c(Br)cccc1C(C)CC(O)=O Amb25780945 [0,2,0,0,0,0|2,0,0]=4 4484 B14R1.152 Cc1c(F)cccc1C(C)CC(O)=O Amb25689050 [0,2,0,0,0,0|2,0,0]=4 4485 B14R1.152 Cc1c(O)cccc1C(C)CC(O)=O Amb18651789 [0,2,0,0,0,0|2,0,0]=4 4486 B14R1.152 Cc1cccc(C(C)CC(O)=O)c1O Amb18651788 [0,2,0,0,0,0|2,0,0]=4 4487 B14R1.1020 C#CC(OC(N)=O)c1cccc(F)c1 Amb24415397 [0,2,0,0,0,0|1,0,1]=4 4488 B14R1.1020 CC(=O)CC(C#N)c1cccc(Br)c1 Amb24672383 [0,2,0,0,0,0|1,0,1]=4 4489 B14R1.1020 CC(=O)CC(C#N)c1cccc(F)c1 Amb24457008 [0,2,0,0,0,0|1,0,1]=4 4490 B14R1.1020 CC(=O)NC(CC)c1cccc(Br)[n]1 Amb25245099 [0,2,0,0,0,0|2,0,0]=4 4491 B14R1.1020 CC(=O)NC(CO)c1cccc(Cl)c1 Amb24122903 [0,2,0,0,0,0|1,0,0]=3 4492 B14R1.1020 CC(=O)N[C@@H](C#C)c1cccc(F)c1 Amb24402194 [0,2,0,0,0,0|1,0,1]=4 4493 B14R1.1020 CC(=O)N[C@H](C=C)c1cccc(F)c1 Amb25121120 [0,2,0,0,0,0|1,0,1]=4 4494 B14R1.1020 CC(=O)N\C(=C\C)\c1cc(Cl)ccc1 Amb24743295 [0,2,0,0,0,0|1,0,1]=4 4495 B14R1.1020 CC(=O)N\C(=C\C)\c1cc(F)ccc1 Amb25139574 [0,2,0,0,0,0|1,0,1]=4 4496 B14R1.1020 CC(=O)OC(C#C)c1cccc(O)c1 Amb25735721 [0,2,0,0,0,0|0,0,1]=3 4497 B14R1.1020 CC(=O)OC(C#N)c1cccc(Br)c1 Amb24685197 [0,2,0,0,0,0|0,0,1]=3 4498 B14R1.1020 CC(=O)OC(C#N)c1cccc(Cl)c1 Amb24556406 [0,2,0,0,0,0|0,0,1]=3 4499 B14R1.1020 CC(C)=CC(NC)c1cccc(F)c1 Amb25725806 [0,2,0,0,0,0|2,0,0]=4 4500 B14R1.1020 CCC(c1cccc(c1)C)CC(=O)N Amb17235148 [0,2,0,0,0,0|2,0,0]=4 4501 B14R1.1020 CCC(c1cccc(c1)C)CC(=O)O Amb17235412 [0,2,0,0,0,0|2,0,0]=4 4502 B14R1.1020 CCC(c1cccc(c1)Cl)CC(=O)N Amb17241038 [0,2,0,0,0,0|2,0,0]=4 4503 B14R1.1020 CCC(c1cccc(c1)Cl)CC(=O)O Amb17241266 [0,2,0,0,0,0|2,0,0]=4 4504 B14R1.1020 CCC(c1cccc(c1)F)CC(=O)N Amb17236180 [0,2,0,0,0,0|2,0,0]=4 4505 B14R1.1020 CCC(c1cccc(c1)F)CC(=O)O Amb17236386 [0,2,0,0,0,0|2,0,0]=4 4506 B14R1.1020 Cc1cccc(c1)C(C#C)NC(C)=O Amb24073028 [0,2,0,0,0,0|1,0,1]=4 4507 B14R1.1020 Cc1cccc(c1)C(C=C)NC(C)=O Amb25165733 [0,2,0,0,0,0|1,0,1]=4 4508 B14R1.1020 Cc1cccc(c1)[C@H](C#C)NC(C)=O Amb24547040 [0,2,0,0,0,0|1,0,1]=4 4509 B14R1.1020 N#CC(c1cccc(c1)Br)NC(=O)C Amb17354081 [0,2,0,0,0,0|1,0,1]=4 4510 B14R1.1020 N#CC(c1cccc(c1)C)NC(=O)C Amb17335970 [0,2,0,0,0,0|1,0,1]=4 4511 B14R1.1020 N#CC(c1cccc(c1)Cl)NC(=O)C Amb17339164 [0,2,0,0,0,0|1,0,1]=4 4512 B14R1.1020 N#CC(c1cccc(c1)F)NC(=O)C Amb2437717 [0,2,0,0,0,0|1,0,1]=4 4513 B14R1.1020 N#CC(c1cccc(c1)O)NC(=O)C Amb17336198 [0,2,0,0,0,0|1,0,1]=4 4514 B14R1.1020 N#CC(c1cccc(c1)O)OC(=O)C Amb17615476 [0,2,0,0,0,0|0,0,1]=3 4515 B14R1.1020 NCC(CC(O)=O)c1cc(F)ccc1 Amb23441523 [0,2,0,0,0,0|2,0,0]=4 4516 B14R1.1020 NCC(c1cccc(c1)Br)CC(=O)O Amb17415238 [0,2,0,0,0,0|2,0,0]=4 4517 B14R1.1020 NCC(c1cccc(c1)Br)OC(C)C Amb17605984 [0,2,0,0,0,0|1,0,1]=4 4518 B14R1.1020 NCC(c1cccc(c1)C)CC(=O)O Amb17217144 [0,2,0,0,0,0|2,0,0]=4 4519 B14R1.1020 NCC(c1cccc(c1)Cl)CC(=O)O Amb17404283 [0,2,0,0,0,0|2,0,0]=4 4520 B14R1.1020 NCC(c1cccc(c1)Cl)OC(C)C Amb17605966 [0,2,0,0,0,0|1,0,1]=4 4521 B14R1.1020 NCC(c1cccc(c1)F)OC(C)C Amb17605981 [0,2,0,0,0,0|1,0,1]=4 4522 B14R1.4252 CC(=O)CC(C)c1cc(F)cc(F)c1 Amb25312812 [0,2,0,0,0,0|1,0,0]=3 4523 B14R1.4252 CC(=O)CC(O)c1cc(C)cc(C)c1 Amb25072513 [0,2,0,0,0,0|2,0,0]=4 4524 B14R1.4252 CC(=O)CN(C)c1cc(C)cc(C)c1 Amb19041280 [0,2,0,0,0,0|2,0,0]=4 4525 B14R1.4252 CC(=O)C[C@@H](O)c1cc(Cl)cc(Cl)c1 Amb25850335 [0,2,0,0,0,0|2,0,0]=4 4526 B14R1.4252 CC(=O)\C=C(\C)/c1cc(C)cc(C)c1 Amb24736603 [0,2,0,0,0,0|1,0,1]=4 4527 B14R1.4252 CC(CC(O)=O)c1cc(Cl)cc(Br)c1 Amb24659914 [0,2,0,0,0,0|2,0,0]=4 4528 B14R1.4252 CC(CC(O)=O)c1cc(Cl)cc(Cl)c1 Amb25694167 [0,2,0,0,0,0|2,0,0]=4 4529 B14R1.4252 CC(CC(O)=O)c1cc(F)cc(Br)c1 Amb25711501 [0,2,0,0,0,0|2,0,0]=4 4530 B14R1.4252 CC(CC(O)=O)c1cc(N)cc(F)c1 Amb25269758 [0,2,0,0,0,0|2,0,0]=4 4531 B14R1.4252 CC(CC(O)=O)c1cc(O)cc(Br)c1 Amb25183849 [0,2,0,0,0,0|2,0,0]=4 4532 B14R1.4252 CC(CC(O)=O)c1cc(O)cc(F)c1 Amb24507232 [0,2,0,0,0,0|2,0,0]=4 4533 B14R1.4252 CC(c1cc(C)cc(c1)C)CC(=O)N Amb17235151 [0,2,0,0,0,0|2,0,0]=4 4534 B14R1.4252 CC(c1cc(C)cc(c1)C)CC(=O)O Amb17235414 [0,2,0,0,0,0|2,0,0]=4 4535 B14R1.4252 CC(c1cc(F)cc(c1)F)CC(=O)N Amb17236904 [0,2,0,0,0,0|2,0,0]=4 4536 B14R1.4252 CC(c1cc(F)cc(c1)F)CC(=O)O Amb17237069 [0,2,0,0,0,0|2,0,0]=4 4537 B14R1.4252 C\C(=C\C(C)=O)\c1cc(F)cc(F)c1 Amb25086777 [0,2,0,0,0,0|1,0,1]=4 4538 B14R1.4252 Cc1cc(cc(F)c1)C(C)CC(O)=O Amb25689302 [0,2,0,0,0,0|2,0,0]=4 4539 B14R1.4252 Cc1cc(cc(O)c1)C(C)CC(O)=O Amb18651791 [0,2,0,0,0,0|2,0,0]=4 4540 B14R1.4403 CC(=O)CC(C)(C)c1c[n]cc(F)c1 Amb24721022 [0,2,0,0,0,0|2,0,0]=4 4541 B14R1.4403 CC(=O)CC(C)(C)c1cccc(Cl)c1 Amb24448273 [0,2,0,0,0,0|1,0,0]=3 4542 B14R1.4403 CC(=O)CC(C)(C)c1cccc(F)c1 Amb24387190 [0,2,0,0,0,0|1,0,0]=3 4543 B14R1.4403 CC(=O)CC(C)(N)c1cc(Br)cc[n]1 Amb25092869 [0,2,0,0,0,0|2,0,0]=4 4544 B14R1.4403 CC(=O)NC(C)(C)c1cccc(Br)[n]1 Amb25127606 [0,2,0,0,0,0|2,0,0]=4 4545 B14R1.4403 CC(=O)NC(c1cccc(c1)Cl)(C)C Amb16898248 [0,2,0,0,0,0|1,0,0]=3 4546 B14R1.4403 CC(C)(CC(O)=O)c1cccc(F)c1 Amb18565818 [0,2,0,0,0,0|2,0,0]=4 4547 B14R1.4403 CC(F)(CC(N)=O)c1cccc(Cl)c1 Amb24393501 [0,2,0,0,0,0|2,0,0]=4 4548 B14R1.4403 CC(N)(CC(O)=O)c1cccc(Br)c1 Amb24356863 [0,2,0,0,0,0|2,0,0]=4 4549 B14R1.4403 CC(N)(CC(O)=O)c1cccc(Cl)c1 Amb25181189 [0,2,0,0,0,0|2,0,0]=4 4550 B14R1.4403 CC(N)(CC(O)=O)c1cccc(F)c1 Amb24744350 [0,2,0,0,0,0|2,0,0]=4 4551 B14R1.4403 CC(N)(CC(O)=O)c1cccc(I)c1 Amb24741654 [0,2,0,0,0,0|2,0,0]=4 4552 B14R1.4403 CC(O)(CC(O)=O)c1cccc(Cl)c1 Amb18990555 [0,2,0,0,0,0|2,0,0]=4 4553 B14R1.4403 C[C@@](N)(CC(O)=O)c1cc(N)ccc1 Amb25090356 [0,2,0,0,0,0|2,0,0]=4 4554 B14R1.4403 C[C@@](N)(CC(O)=O)c1cc(O)ccc1 Amb25127928 [0,2,0,0,0,0|2,0,0]=4 4555 B14R1.4403 C[C@@](N)(CC(O)=O)c1cccc(F)c1 Amb24448607 [0,2,0,0,0,0|2,0,0]=4 4556 B14R1.4403 C[C@@](N)(CC(O)=O)c1cccc(S)c1 Amb25289014 [0,2,0,0,0,0|2,0,0]=4 4557 B14R1.4403 C[C@](N)(CC(O)=O)c1cc(N)ccc1 Amb25824148 [0,2,0,0,0,0|2,0,0]=4 4558 B14R1.4403 C[C@](N)(CC(O)=O)c1cccc(Br)c1 Amb25729919 [0,2,0,0,0,0|2,0,0]=4 4559 B14R1.4403 C[C@](N)(CC(O)=O)c1cccc(F)c1 Amb25053382 [0,2,0,0,0,0|2,0,0]=4 4560 B14R1.4403 Cc1cc(ccc1)[C@@](C)(N)CC(O)=O Amb24513714 [0,2,0,0,0,0|2,0,0]=4 4561 B14R1.4403 Cc1cccc(c1)C(C)(C)CC(C)=O Amb25261607 [0,2,0,0,0,0|1,0,0]=3 4562 B14R1.4403 Cc1cccc(c1)C(C)(O)CC(O)=O Amb18298170 [0,2,0,0,0,0|2,0,0]=4 4563 B14R1.4403 OC(=O)CC(c1cccc(c1)Br)(C)C Amb17265520 [0,2,0,0,0,0|2,0,0]=4 4564 B14R1.4403 OC(=O)CC(c1cccc(c1)C)(C)C Amb17139346 [0,2,0,0,0,0|2,0,0]=4 4565 B14R1.4403 OC(=O)CC(c1cccc(c1)Cl)(C)C Amb17140717 [0,2,0,0,0,0|2,0,0]=4 4566 B14R1.5966 CC(C)(C)OC(C)c1cccc(N)c1 Amb18973988 [0,2,0,0,0,0|1,0,1]=4 4567 B14R1.5966 CC(OS(C)(=O)=O)c1c[n]cc(F)c1 Amb24665486 [0,2,0,0,0,0|2,0,0]=4 4568 B14R1.5966 CS(=O)(=O)NC(C)c1cccc(O)c1 Amb24406430 [0,2,0,0,0,0|2,0,0]=4 4569 B14R1.5966 CS(=O)(=O)N[C@H](C)c1cccc(Br)c1 Amb25165383 [0,2,0,0,0,0|2,0,0]=4 4570 B14R1.5966 CS(=O)(=O)OC(C)c1cccc(Br)[n]1 Amb24714913 [0,2,0,0,0,0|2,0,0]=4 4571 B14R1.5966 CS(=O)(=O)O[C@@H](C)c1cccc(Br)[n]1 Amb25246854 [0,2,0,0,0,0|2,0,0]=4 4572 B14R1.5966 Cc1cccc(c1)[C@H](C)NS(C)(=O)=O Amb25183464 [0,2,0,0,0,0|2,0,0]=4 4573 B14R1.5966 Clc1cccc(c1)C(NS(=O)(=O)C)C Amb11251275 [0,2,0,0,0,0|2,0,0]=4 4574 B14R1.5966 Fc1cccc(c1)C(NS(=O)(=O)C)C Amb13975447 [0,2,0,0,0,0|2,0,0]=4 4575 B14R1.6052 CC(=O)CC(C)c1cc(Br)ccc1F Amb25228368 [0,2,0,0,0,0|1,0,0]=3 4576 B14R1.6052 CC(=O)CC(C)c1cc(C)c[n]c1N Amb24362139 [0,2,0,0,0,0|2,0,0]=4 4577 B14R1.6052 CC(=O)CC(C)c1cc(Cl)c[n]c1N Amb24525925 [0,2,0,0,0,0|2,0,0]=4 4578 B14R1.6052 CC(=O)CC(C)c1cc(Cl)ccc1Cl Amb25343953 [0,2,0,0,0,0|1,0,0]=3 4579 B14R1.6052 CC(=O)CC(C)c1cc(F)ccc1F Amb25742834 [0,2,0,0,0,0|1,0,0]=3 4580 B14R1.6052 CC(=O)CC(O)c1cc(Br)ccc1O Amb25787238 [0,2,0,0,0,0|2,0,0]=4 4581 B14R1.6052 CC(=O)CC(O)c1cc(Cl)ccc1O Amb25773467 [0,2,0,0,0,0|2,0,0]=4 4582 B14R1.6052 CC(=O)CC(O)c1cc(F)ccc1O Amb25767868 [0,2,0,0,0,0|2,0,0]=4 4583 B14R1.6052 CC(=O)C[C@@H](O)c1cc(Br)ccc1O Amb24708934 [0,2,0,0,0,0|2,0,0]=4 4584 B14R1.6052 CC(=O)C[C@H](O)c1cc(Cl)ccc1O Amb25071133 [0,2,0,0,0,0|2,0,0]=4 4585 B14R1.6052 CC(=O)C[C@H](O)c1cc(F)ccc1O Amb25071134 [0,2,0,0,0,0|2,0,0]=4 4586 B14R1.6052 CC(=O)NC(C)c1cc(F)ccc1F Amb24510600 [0,2,0,0,0,0|1,0,0]=3 4587 B14R1.6052 CC(=O)OC(=O)c1cc(N)ccc1Cl Amb25131168 [0,2,0,0,0,0|1,0,1]=4 4588 B14R1.6052 CC(=O)OC(=O)c1cc(N)ccc1F Amb24563371 [0,2,0,0,0,0|1,0,1]=4 4589 B14R1.6052 CC(=O)OC(=O)c1cc(O)ccc1C Amb24506157 [0,2,0,0,0,0|1,0,1]=4 4590 B14R1.6052 CC(CC(O)=O)c1cc(Br)ccc1Cl Amb25028935 [0,2,0,0,0,0|2,0,0]=4 4591 B14R1.6052 CC(CC(O)=O)c1cc(Br)ccc1F Amb25780520 [0,2,0,0,0,0|2,0,0]=4 4592 B14R1.6052 CC(CC(O)=O)c1cc(Cl)ccc1F Amb18244371 [0,2,0,0,0,0|2,0,0]=4 4593 B14R1.6052 CC(CC(O)=O)c1cc(F)ccc1Br Amb24361856 [0,2,0,0,0,0|2,0,0]=4 4594 B14R1.6052 CC(CC(O)=O)c1cc(F)ccc1Cl Amb24469125 [0,2,0,0,0,0|2,0,0]=4 4595 B14R1.6052 CC(CC(O)=O)c1cc(O)ccc1Br Amb25028924 [0,2,0,0,0,0|2,0,0]=4 4596 B14R1.6052 CC(c1cc(C)ccc1C)CC(=O)N Amb17235129 [0,2,0,0,0,0|2,0,0]=4 4597 B14R1.6052 CC(c1cc(C)ccc1Cl)CC(=O)O Amb16206684 [0,2,0,0,0,0|2,0,0]=4 4598 B14R1.6052 C\C(=C\C(C)=O)\c1cc(C)ccc1C Amb25807765 [0,2,0,0,0,0|1,0,1]=4 4599 B14R1.6052 C\C(=C\C(C)=O)\c1cc(Cl)ccc1Cl Amb25773613 [0,2,0,0,0,0|1,0,1]=4 4600 B14R1.6052 Cc1ccc(Br)c(c1)C(C)CC(O)=O Amb25316176 [0,2,0,0,0,0|2,0,0]=4 4601 B14R1.6052 Cc1ccc(Br)cc1C(C)CC(O)=O Amb24534892 [0,2,0,0,0,0|2,0,0]=4 4602 B14R1.6052 Cc1ccc(Cl)c(c1)C(C)CC(C)=O Amb25111319 [0,2,0,0,0,0|1,0,0]=3 4603 B14R1.6052 Cc1ccc(Cl)cc1C(C)CC(O)=O Amb24671424 [0,2,0,0,0,0|2,0,0]=4 4604 B14R1.6052 Cc1ccc(F)c(c1)C(C)CC(C)=O Amb25731513 [0,2,0,0,0,0|1,0,0]=3 4605 B14R1.6052 Cc1ccc(F)cc1C(C)CC(C)=O Amb25312811 [0,2,0,0,0,0|1,0,0]=3 4606 B14R1.6052 Cc1ccc(F)cc1C(C)CC(O)=O Amb25165678 [0,2,0,0,0,0|2,0,0]=4 4607 B14R1.6052 Cc1ccc(O)c(c1)C(C)CC(O)=O Amb18651794 [0,2,0,0,0,0|2,0,0]=4 4608 B14R1.6052 Cc1ccc(O)cc1C(C)CC(O)=O Amb18651793 [0,2,0,0,0,0|2,0,0]=4 4609 B14R1.243 CC(=N)N(C)C(C)c1ccccc1Cl Amb24753636 [0,2,0,0,0,0|2,0,0]=4 4610 B14R1.243 CC(=O)C(=C)[C@@H](O)c1ccccc1F Amb25236478 [0,2,0,0,0,0|2,0,0]=4 4611 B14R1.243 CC(=O)C(=C)[C@H](O)c1ccccc1F Amb25748817 [0,2,0,0,0,0|2,0,0]=4 4612 B14R1.243 CC(=O)C(Br)C(C)c1ccccc1Br Amb25239210 [0,2,0,0,0,0|1,0,0]=3 4613 B14R1.243 CC(=O)C(Br)C(C)c1ccccc1Cl Amb25731644 [0,2,0,0,0,0|1,0,0]=3 4614 B14R1.243 CC(=O)N(C)C(C)c1ccccc1Cl Amb24448469 [0,2,0,0,0,0|1,0,0]=3 4615 B14R1.243 CC(=O)N(C)C(C)c1ccccc1F Amb24510870 [0,2,0,0,0,0|1,0,0]=3 4616 B14R1.243 CC(=O)N(C)C(C)c1ccccc1O Amb19051004 [0,2,0,0,0,0|1,0,0]=3 4617 B14R1.243 CC(C(Br)C(C)=O)c1ccccc1C Amb24696137 [0,2,0,0,0,0|1,0,0]=3 4618 B14R1.243 CC(C(C)c1ccccc1Br)C(O)=O Amb25200833 [0,2,0,0,0,0|2,0,0]=4 4619 B14R1.243 CC(C(C)c1ccccc1Cl)C(O)=O Amb24521299 [0,2,0,0,0,0|2,0,0]=4 4620 B14R1.243 CC(C(F)C(O)=O)c1ccccc1F Amb25165246 [0,2,0,0,0,0|2,0,0]=4 4621 B14R1.243 CC(C(N)C(O)=O)c1ccccc1Br Amb24679388 [0,2,0,0,0,0|2,0,0]=4 4622 B14R1.243 CC(C(N)C(O)=O)c1ccccc1N Amb18651900 [0,2,0,0,0,0|2,0,0]=4 4623 B14R1.243 CC(C(O)C(O)=O)c1ccccc1Br Amb25301573 [0,2,0,0,0,0|2,0,0]=4 4624 B14R1.243 CC(C(O)c1ccccc1C)C(C)=O Amb25750420 [0,2,0,0,0,0|2,0,0]=4 4625 B14R1.243 CC(c1ccccc1Cl)N(C)C(=O)Cl Amb25777543 [0,2,0,0,0,0|2,0,0]=4 4626 B14R1.243 CN(C(C)c1ccccc1F)C(N)=O Amb19053110 [0,2,0,0,0,0|2,0,0]=4 4627 B14R1.243 CN(C(C)c1ccccc1O)C(N)=O Amb19051562 [0,2,0,0,0,0|2,0,0]=4 4628 B14R1.243 C[C@H]([C@@H](N)C(O)=O)c1ccccc1N Amb24355363 [0,2,0,0,0,0|2,0,0]=4 4629 B14R1.243 C[C@H]([C@H](N)C(O)=O)c1ccccc1N Amb25193515 [0,2,0,0,0,0|2,0,0]=4 4630 B14R1.243 Cc1ccccc1C(C)C(=C)C(O)=O Amb25815056 [0,2,0,0,0,0|2,0,0]=4 4631 B14R1.243 Cc1ccccc1C(C)C(C)C(O)=O Amb24552960 [0,2,0,0,0,0|2,0,0]=4 4632 B14R1.243 Cc1ccccc1C(C)C(F)C(O)=O Amb25165245 [0,2,0,0,0,0|2,0,0]=4 4633 B14R1.243 Cc1ccccc1C(C)C(O)C(O)=O Amb25779784 [0,2,0,0,0,0|2,0,0]=4 4634 B14R1.1017 CC(=O)N(CC)C(C)c1ccccc1 Amb24096584 [0,2,0,0,0,0|1,0,0]=3 4635 B14R1.1017 CC(C(C(=O)O)C#N)c1ccccc1 Amb17089331 [0,2,0,0,0,0|2,0,0]=4 4636 B14R1.1017 CC(\C(=N\O)\C(O)=O)c1ccccc1 Amb25756389 [0,2,0,0,0,0|2,0,0]=4 4637 B14R1.1027 CCN(C(=O)C(=O)C)c1ccccc1 Amb17401508 [0,2,0,0,0,0|2,0,0]=4 4638 B14R1.1027 CN(C(c1ccccc1)C#N)C(=O)C Amb17335972 [0,2,0,0,0,0|1,0,1]=4 4639 B14R1.1027 C\C(=C(\NC)/c1ccccc1)\C(C)=O Amb24367223 [0,2,0,0,0,0|1,0,1]=4 4640 B14R1.6306 CC(=C)C(=O)C(C)(C)c1ccccc1 Amb25310729 [0,2,0,0,0,0|2,0,0]=4 4641 B14R1.6306 CC(=C)C(=O)C(C)(N)c1ccccc1 Amb24400960 [0,2,0,0,0,0|2,0,0]=4 4642 B14R1.6306 CC(=C)C(N)C(C)(C)c1ccccc1 Amb24726953 [0,2,0,0,0,0|2,0,0]=4 4643 B14R1.6306 CC(C(O)=O)C(C)(O)c1ccccc1 Amb18990602 [0,2,0,0,0,0|2,0,0]=4 4644 B14R1.6306 CC(C)(C(O)C(O)=O)c1ccccc1 Amb18651885 [0,2,0,0,0,0|2,0,0]=4 4645 B14R1.6306 CC(C)(C(S)C(O)=O)c1ccccc1 Amb25119225 [0,2,0,0,0,0|2,0,0]=4 4646 B14R1.6306 CC(C)([C@H](C)C(O)=O)c1ccccc1 Amb24498135 [0,2,0,0,0,0|2,0,0]=4 4647 B14R1.6306 CC(F)(C(N)C(O)=O)c1ccccc1 Amb25341618 [0,2,0,0,0,0|2,0,0]=4 4648 B14R1.6306 CC(N)(C(O)C(N)=O)c1ccccc1 Amb25279511 [0,2,0,0,0,0|2,0,0]=4 4649 B14R1.6306 CC(O)(C(C)C(N)=O)c1ccccc1 Amb25114161 [0,2,0,0,0,0|2,0,0]=4 4650 B14R1.6306 CC(O)(C(Cl)C(O)=O)c1ccccc1 Amb24452133 [0,2,0,0,0,0|2,0,0]=4 4651 B14R1.6306 CC(O)(C(N)C(O)=O)c1ccccc1 Amb25672532 [0,2,0,0,0,0|2,0,0]=4 4652 B14R1.6306 C[C@@H](C(O)=O)[C@](C)(O)c1ccccc1 Amb25164442 [0,2,0,0,0,0|2,0,0]=4 4653 B14R1.6306 C[C@@](N)([C@H](C)C(O)=O)c1ccccc1 Amb19929617 [0,2,0,0,0,0|2,0,0]=4 4654 B14R1.6306 C[C@](N)([C@H](C)C(O)=O)c1ccccc1 Amb19929616 [0,2,0,0,0,0|2,0,0]=4 4655 B14R1.6306 C[C@](O)([C@@H](F)C(O)=O)c1ccccc1 Amb24498134 [0,2,0,0,0,0|2,0,0]=4 4656 B14R1.6391 CC(=O)C(C)(N)C(O)c1ccccc1 Amb25339242 [0,2,0,0,0,0|2,0,0]=4 4657 B14R1.6391 CC(=O)C(C)(O)C(O)c1ccccc1 Amb24474267 [0,2,0,0,0,0|2,0,0]=4 4658 B14R1.6391 CC(C(C(=O)O)(C)C)c1ccccc1 Amb17333790 [0,2,0,0,0,0|2,0,0]=4 4659 B14R1.6391 CC(C)([C@H](C)c1ccccc1)C(O)=O Amb24498119 [0,2,0,0,0,0|2,0,0]=4 4660 B14R1.6391 CC(c1ccccc1)C(C)(O)C(O)=O Amb20623542 [0,2,0,0,0,0|2,0,0]=4 4661 B14R1.6391 C[C@](N)([C@H](C)c1ccccc1)C(O)=O Amb24739555 [0,2,0,0,0,0|2,0,0]=4 4662 B14R1.10526 CC(c1ccccc1)N(C)S(C)(=O)=O Amb20777617 [0,2,0,0,0,0|2,0,0]=4 4663 B14R1.840 CC(=O)CC(O)c1ccccc1C#N Amb24457018 [0,2,0,0,0,0|2,0,0]=4 4664 B14R1.840 CC(=O)C[C@@H](O)c1ccccc1C#N Amb24398015 [0,2,0,0,0,0|2,0,0]=4 4665 B14R1.840 CC(=O)NC(C)c1ccccc1OC Amb19671653 [0,2,0,0,0,0|1,0,0]=3 4666 B14R1.840 CC(=O)N[C@@H](C)c1ccccc1OC Amb24440503 [0,2,0,0,0,0|1,0,0]=3 4667 B14R1.840 CC(=O)N[C@H](C)c1ccccc1OC Amb24718903 [0,2,0,0,0,0|1,0,0]=3 4668 B14R1.840 CC(=O)OC(C)c1ccccc1NC Amb25216111 [0,2,0,0,0,0|0,0,0]=2 4669 B14R1.840 CC(=O)\C=C(/C)\c1ccccc1C=O Amb25729091 [0,2,0,0,0,0|1,0,1]=4 4670 B14R1.840 CC(CC(O)=O)c1ccccc1C#N Amb25270131 [0,2,0,0,0,0|2,0,0]=4 4671 B14R1.840 COc1ccccc1C(CC(=O)N)C Amb17235626 [0,2,0,0,0,0|2,0,0]=4 4672 B14R1.4451 CC(c1ccccc1Br)NS(=O)(=O)C Amb11251267 [0,2,0,0,0,0|2,0,0]=4 4673 B14R1.4451 CC(c1ccccc1C)NS(=O)(=O)C Amb16016045 [0,2,0,0,0,0|2,0,0]=4 4674 B14R1.4451 CC(c1ccccc1Cl)NS(=O)(=O)C Amb11251179 [0,2,0,0,0,0|2,0,0]=4 4675 B14R1.4451 CS(=O)(=O)N[C@@H](C)c1ccccc1Br Amb24390681 [0,2,0,0,0,0|2,0,0]=4 4676 B14R1.4451 CS(=O)(=O)N[C@@H](C)c1ccccc1Cl Amb24662930 [0,2,0,0,0,0|2,0,0]=4 4677 B14R1.4451 CS(=O)(=O)N[C@H](C)c1ccccc1Br Amb24739312 [0,2,0,0,0,0|2,0,0]=4 4678 B14R1.4451 CS(=O)(=O)N[C@H](C)c1ccccc1Cl Amb25116794 [0,2,0,0,0,0|2,0,0]=4 4679 B14R1.4451 CS(=O)(=O)N[C@H](C)c1ccccc1F Amb25049582 [0,2,0,0,0,0|2,0,0]=4 4680 B14R1.4451 Cc1ccccc1[C@H](C)NS(C)(=O)=O Amb25165251 [0,2,0,0,0,0|2,0,0]=4 4681 B14R1.5805 CC(=C)CC(C)(O)c1ccccc1O Amb25320182 [0,2,0,0,0,0|2,0,0]=4 4682 B14R1.5805 CC(=O)CC(C)(C)c1ccc[n]c1N Amb24721021 [0,2,0,0,0,0|2,0,0]=4 4683 B14R1.5805 CC(=O)CC(C)(C)c1ccccc1Cl Amb24461811 [0,2,0,0,0,0|1,0,0]=3 4684 B14R1.5805 CC(=O)NC(C)(C)c1ccccc1Cl Amb24087494 [0,2,0,0,0,0|1,0,0]=3 4685 B14R1.5805 CC(C)(CC(O)=O)c1ccccc1S Amb24521523 [0,2,0,0,0,0|2,0,0]=4 4686 B14R1.5805 CC(C)=CC(C)(O)c1ccccc1F Amb24752518 [0,2,0,0,0,0|2,0,0]=4 4687 B14R1.5805 CC(N)(CC(O)=O)c1ccccc1Br Amb24510837 [0,2,0,0,0,0|2,0,0]=4 4688 B14R1.5805 CC(N)(CC(O)=O)c1ccccc1I Amb24597046 [0,2,0,0,0,0|2,0,0]=4 4689 B14R1.5805 CC(N)(CC(O)=O)c1ccccc1N Amb25183036 [0,2,0,0,0,0|2,0,0]=4 4690 B14R1.5805 CC(N)(CC(O)=O)c1ccccc1S Amb24637907 [0,2,0,0,0,0|2,0,0]=4 4691 B14R1.5805 CC(O)(CC(O)=O)c1ccccc1Cl Amb18990550 [0,2,0,0,0,0|2,0,0]=4 4692 B14R1.5805 C[C@@](N)(CC(O)=O)c1ccccc1Br Amb24399311 [0,2,0,0,0,0|2,0,0]=4 4693 B14R1.5805 C[C@@](N)(CC(O)=O)c1ccccc1Cl Amb24382021 [0,2,0,0,0,0|2,0,0]=4 4694 B14R1.5805 C[C@@](N)(CC(O)=O)c1ccccc1N Amb25814368 [0,2,0,0,0,0|2,0,0]=4 4695 B14R1.5805 C[C@](N)(CC(O)=O)c1ccccc1Br Amb24545699 [0,2,0,0,0,0|2,0,0]=4 4696 B14R1.5805 C[C@](N)(CC(O)=O)c1ccccc1Cl Amb25778096 [0,2,0,0,0,0|2,0,0]=4 4697 B14R1.5805 C[C@](N)(CC(O)=O)c1ccccc1N Amb25068410 [0,2,0,0,0,0|2,0,0]=4 4698 B14R1.5805 Cc1ccccc1C(C)(N)CC(O)=O Amb25843814 [0,2,0,0,0,0|2,0,0]=4 4699 B14R1.5805 Cc1ccccc1C(C)(O)CC(O)=O Amb18990560 [0,2,0,0,0,0|2,0,0]=4 4700 B14R1.5805 Cc1ccccc1[C@@](C)(N)CC(O)=O Amb25760788 [0,2,0,0,0,0|2,0,0]=4 4701 B14R1.5805 OC(=O)CC(c1ccccc1C)(C)C Amb17235385 [0,2,0,0,0,0|2,0,0]=4 4702 B14R1.5805 OC(=O)CC(c1ccccc1Cl)(C)C Amb17241245 [0,2,0,0,0,0|2,0,0]=4 4703 B14R1.5805 OC(=O)CC(c1ccccc1F)(C)C Amb17236373 [0,2,0,0,0,0|2,0,0]=4 4704 B14R1.5958 CC(=O)C[C@@H](O)c1c(C)cccc1C Amb24431045 [0,2,0,0,0,0|2,0,0]=4 4705 B14R1.5958 CC(CC(O)=O)c1c(Cl)cccc1Cl Amb24439353 [0,2,0,0,0,0|2,0,0]=4 4706 B14R1.5958 CC(CC(O)=O)c1c(N)cccc1F Amb24564625 [0,2,0,0,0,0|2,0,0]=4 4707 B14R1.5958 C\C(=C\C(C)=O)\c1c(Cl)cccc1Cl Amb25267260 [0,2,0,0,0,0|1,0,1]=4 4708 B14R1.5958 C\C(=C\C(C)=O)\c1c(F)cccc1Cl Amb25701490 [0,2,0,0,0,0|1,0,1]=4 4709 B14R1.5958 Cc1cccc(F)c1C(C)CC(O)=O Amb25178476 [0,2,0,0,0,0|2,0,0]=4 4710 B14R1.5958 Cc1cccc(F)c1C(O)CC(C)=O Amb24613431 [0,2,0,0,0,0|2,0,0]=4 4711 B14R1.6474 CC(=O)CC(C#N)c1ccccc1Br Amb25141185 [0,2,0,0,0,0|1,0,1]=4 4712 B14R1.6474 CC(=O)CC(C#N)c1ccccc1Cl Amb25262843 [0,2,0,0,0,0|1,0,1]=4 4713 B14R1.6474 CC(=O)NC(C#N)c1ccccc1Br Amb24369588 [0,2,0,0,0,0|1,0,1]=4 4714 B14R1.6474 CC(=O)NC(CC)c1ccccc1O Amb24740996 [0,2,0,0,0,0|1,0,0]=3 4715 B14R1.6474 CC(=O)N[C@@H](CC)c1ccccc1O Amb24347179 [0,2,0,0,0,0|1,0,0]=3 4716 B14R1.6474 CC(=O)N[C@H](CC)c1ccccc1O Amb25233466 [0,2,0,0,0,0|1,0,0]=3 4717 B14R1.6474 CC(=O)OC(C#N)c1ccccc1Br Amb24701535 [0,2,0,0,0,0|0,0,1]=3 4718 B14R1.6474 CC(=O)OC(C#N)c1ccccc1O Amb25272992 [0,2,0,0,0,0|0,0,1]=3 4719 B14R1.6474 CC(=O)\C=C(\CC)/c1ccccc1F Amb25729412 [0,2,0,0,0,0|1,0,1]=4 4720 B14R1.6474 CC(C)=CC(NC)c1ccccc1C Amb25853199 [0,2,0,0,0,0|2,0,0]=4 4721 B14R1.6474 CC(C)=CC(NC)c1ccccc1F Amb25229900 [0,2,0,0,0,0|2,0,0]=4 4722 B14R1.6474 CCC(c1ccccc1C)CC(=O)N Amb17235146 [0,2,0,0,0,0|2,0,0]=4 4723 B14R1.6474 CCC(c1ccccc1C)CC(=O)O Amb17235410 [0,2,0,0,0,0|2,0,0]=4 4724 B14R1.6474 CCC(c1ccccc1Cl)CC(=O)N Amb17241036 [0,2,0,0,0,0|2,0,0]=4 4725 B14R1.6474 CCC(c1ccccc1Cl)CC(=O)O Amb17241264 [0,2,0,0,0,0|2,0,0]=4 4726 B14R1.6474 CCC(c1ccccc1F)CC(=O)N Amb17236177 [0,2,0,0,0,0|2,0,0]=4 4727 B14R1.6474 CCC(c1ccccc1F)CC(=O)O Amb17236384 [0,2,0,0,0,0|2,0,0]=4 4728 B14R1.6474 Cc1ccccc1C(C#C)NC(C)=O Amb24073022 [0,2,0,0,0,0|1,0,1]=4 4729 B14R1.6474 Cc1ccccc1C(C#N)OC(C)=O Amb25045446 [0,2,0,0,0,0|0,0,1]=3 4730 B14R1.6474 Cc1ccccc1\C(\CC)=N\C(C)=O Amb24671117 [0,2,0,0,0,0|1,0,1]=4 4731 B14R1.6474 N#CC(c1ccccc1C)NC(=O)C Amb17335969 [0,2,0,0,0,0|1,0,1]=4 4732 B14R1.6474 N#CC(c1ccccc1Cl)NC(=O)C Amb17339163 [0,2,0,0,0,0|1,0,1]=4 4733 B14R1.6474 N#CC(c1ccccc1F)NC(=O)C Amb17336386 [0,2,0,0,0,0|1,0,1]=4 4734 B14R1.6474 NC(=O)NC(CN)c1ccccc1Cl Amb25714421 [0,2,0,0,0,0|2,0,0]=4 4735 B14R1.6474 NC(=O)OC(C#N)c1ccccc1Cl Amb25752594 [0,2,0,0,0,0|1,0,1]=4 4736 B14R1.6474 NCC(CC(O)=O)c1ccccc1Br Amb18692425 [0,2,0,0,0,0|2,0,0]=4 4737 B14R1.6474 NCC(c1ccccc1C)CC(=O)O Amb17401740 [0,2,0,0,0,0|2,0,0]=4 4738 B14R1.6474 NCC(c1ccccc1C)OC(C)C Amb17605993 [0,2,0,0,0,0|1,0,1]=4 4739 B14R1.6474 NCC(c1ccccc1Cl)CC(=O)O Amb17404281 [0,2,0,0,0,0|2,0,0]=4 4740 B14R1.6474 NCC(c1ccccc1Cl)OC(C)C Amb17605986 [0,2,0,0,0,0|1,0,1]=4 4741 B14R1.6474 NCC(c1ccccc1F)CC(=O)O Amb17217146 [0,2,0,0,0,0|2,0,0]=4 4742 B14R1.6474 NCC(c1ccccc1F)OC(C)C Amb17605987 [0,2,0,0,0,0|1,0,1]=4 4743 B14R1.3642 CC(=O)CC(C)(CC)c1ccccc1 Amb22458377 [0,2,0,0,0,0|1,0,0]=3 4744 B14R1.3642 CC(=O)NC(C)(C#C)c1ccccc1 Amb24666700 [0,2,0,0,0,0|1,0,0]=3 4745 B14R1.3642 CC(=O)NC(C)(C=C)c1ccccc1 Amb25828549 [0,2,0,0,0,0|1,0,0]=3 4746 B14R1.3642 CC(=O)NC(C)(CBr)c1ccccc1 Amb25067677 [0,2,0,0,0,0|1,0,0]=3 4747 B14R1.3642 CC(=O)NC(C)(CCl)c1ccccc1 Amb24446453 [0,2,0,0,0,0|1,0,0]=3 4748 B14R1.3642 CC(=O)NC(C)(CF)c1ccccc1 Amb25324165 [0,2,0,0,0,0|1,0,0]=3 4749 B14R1.3642 CC(=O)NC(C)(CN)c1ccccc1 Amb18910322 [0,2,0,0,0,0|1,0,0]=3 4750 B14R1.3642 CC(=O)NC(C)(CO)c1ccccc1 Amb25076053 [0,2,0,0,0,0|1,0,0]=3 4751 B14R1.3642 CC(=O)N[C@@](C)(C=C)c1ccccc1 Amb24521555 [0,2,0,0,0,0|1,0,0]=3 4752 B14R1.3642 CC(C#N)(NC(N)=O)c1ccccc1 Amb24521764 [0,2,0,0,0,0|2,0,0]=4 4753 B14R1.3642 CC(C#N)(OC(N)=O)c1ccccc1 Amb24426128 [0,2,0,0,0,0|1,0,0]=3 4754 B14R1.3642 CC(C)=CC(C)(C=O)c1ccccc1 Amb25166036 [0,2,0,0,0,0|2,0,0]=4 4755 B14R1.3642 CC(CN)(NC(N)=O)c1ccccc1 Amb18910479 [0,2,0,0,0,0|2,0,0]=4 4756 B14R1.3642 CC(CO)(NC(N)=O)c1ccccc1 Amb24654272 [0,2,0,0,0,0|2,0,0]=4 4757 B14R1.3642 CCC(c1ccccc1)(CC(=O)O)O Amb17139452 [0,2,0,0,0,0|2,0,0]=4 4758 B14R1.3642 C[C@@](CC(N)=O)(C#N)c1ccccc1 Amb25724459 [0,2,0,0,0,0|2,0,0]=4 4759 B14R1.3642 C[C@@](CC(O)=O)(C#N)c1ccccc1 Amb25111239 [0,2,0,0,0,0|2,0,0]=4 4760 B14R1.3642 C[C@](CC(O)=O)(C#N)c1ccccc1 Amb25815055 [0,2,0,0,0,0|2,0,0]=4 4761 B14R1.544 OCC(c1ccccc1)NS(=O)(=O)C Amb17140928 [0,2,0,0,0,0|2,0,0]=4 4762 B14R1.515 C=CCC(c1ccccc1)NC(=O)C Amb10559350 [0,2,0,0,0,0|1,0,0]=3 4763 B14R1.515 CC(=O)NC(CC#N)c1ccccc1 Amb24639060 [0,2,0,0,0,0|1,0,0]=3 4764 B14R1.515 CC(=O)N[C@@H](CC#N)c1ccccc1 Amb25233116 [0,2,0,0,0,0|1,0,0]=3 4765 B14R1.515 CC(=O)N[C@H](C#CC)c1ccccc1 Amb25049309 [0,2,0,0,0,0|1,0,0]=3 4766 B14R1.515 CC(=O)N\C(=C\OC)\c1ccccc1 Amb24530298 [0,2,0,0,0,0|1,0,1]=4 4767 B14R1.515 CCO\C(=C/C(=O)C)\c1ccccc1 Amb17594959 [0,2,0,0,0,0|1,0,1]=4 4768 B14R1.515 CCO\C(=N/C(=O)C)\c1ccccc1 Amb10553486 [0,2,0,0,0,0|1,0,1]=4 4769 B14R1.515 CNCC(c1ccccc1)OC(C)C Amb17605933 [0,2,0,0,0,0|1,0,1]=4 4770 B14R1.6455 CC(=C)C(CC(N)=O)c1ccccc1 Amb22469556 [0,2,0,0,0,0|2,0,0]=4 4771 B14R1.6455 CC(=N)NC(C(C)C)c1ccccc1 Amb25774926 [0,2,0,0,0,0|2,0,0]=4 4772 B14R1.6455 CC(=O)C(NC(C)=O)c1ccccc1 Amb23442748 [0,2,0,0,0,0|1,0,0]=3 4773 B14R1.6455 CC(=O)C(c1ccccc1)SC(=O)C Amb17595586 [0,2,0,0,0,0|0,1,0]=3 4774 B14R1.6455 CC(=O)CC(c1ccccn1)N(C)C Amb17401662 [0,2,0,0,0,0|2,0,0]=4 4775 B14R1.6455 CC(=O)CC(c1cccnc1)N(C)C Amb17401663 [0,2,0,0,0,0|2,0,0]=4 4776 B14R1.6455 CC(=O)N(c1ccccc1)CC(=O)C Amb17594992 [0,2,0,0,0,0|2,0,0]=4 4777 B14R1.6455 CC(=O)NC(C(C)C)c1ccccc1 Amb25037562 [0,2,0,0,0,0|1,0,0]=3 4778 B14R1.6455 CC(=O)NC(C(C)N)c1ccccc1 Amb18651300 [0,2,0,0,0,0|1,0,0]=3 4779 B14R1.6455 CC(=O)NC(C(N)=O)c1ccccc1 Amb25818740 [0,2,0,0,0,0|1,0,1]=4 4780 B14R1.6455 CC(=O)NC(c1ccccc1)C(=O)S Amb25125249 [0,2,0,0,0,0|1,0,1]=4 4781 B14R1.6455 CC(=O)N[C@@H](C(C)C)c1ccccc1 Amb25782643 [0,2,0,0,0,0|1,0,0]=3 4782 B14R1.6455 CC(=O)N[C@@H](C(N)=O)c1ccccc1 Amb25806232 [0,2,0,0,0,0|1,0,1]=4 4783 B14R1.6455 CC(=O)N[C@@H](C(O)=O)c1ccccc1 Amb19050932 [0,2,0,0,0,0|1,0,1]=4 4784 B14R1.6455 CC(=O)N[C@@H]([C@H](C)F)c1ccccc1 Amb24374648 [0,2,0,0,0,0|1,0,0]=3 4785 B14R1.6455 CC(=O)N[C@@H]([C@H](C)N)c1ccccc1 Amb24627041 [0,2,0,0,0,0|1,0,0]=3 4786 B14R1.6455 CC(=O)N[C@H](C(C)C)c1ccccc1 Amb25346706 [0,2,0,0,0,0|1,0,0]=3 4787 B14R1.6455 CC(=O)N[C@H](C(N)=O)c1ccccc1 Amb25181508 [0,2,0,0,0,0|1,0,1]=4 4788 B14R1.6455 CC(=O)N[C@H](C(O)=O)c1ccccc1 Amb22262940 [0,2,0,0,0,0|1,0,1]=4 4789 B14R1.6455 CC(=O)SC(C(O)=O)c1ccccc1 Amb20668813 [0,2,0,0,0,0|0,1,1]=4 4790 B14R1.6455 CC(C(c1ccccc1)CC(=O)N)C Amb17235121 [0,2,0,0,0,0|2,0,0]=4 4791 B14R1.6455 CC(C(c1ccccc1)NC(=O)N)C Amb11034127 [0,2,0,0,0,0|2,0,0]=4 4792 B14R1.6455 CN(C(c1ccccc1)CC(=O)C)C Amb17401547 [0,2,0,0,0,0|1,0,0]=3 4793 B14R1.6455 CN(C(c1ccccc1)CC(=O)N)C Amb10554007 [0,2,0,0,0,0|2,0,0]=4 4794 B14R1.6455 CN(C(c1ccncc1)CC(=O)C)C Amb17401664 [0,2,0,0,0,0|2,0,0]=4 4795 B14R1.6455 C\C(\Cl)=C(/NC(C)=O)\c1ccccc1 Amb24753984 [0,2,0,0,0,0|1,0,1]=4 4796 B14R1.6455 C\C(\Cl)=C(\NC(C)=O)/c1ccccc1 Amb24559800 [0,2,0,0,0,0|1,0,1]=4 4797 B14R1.6455 ClC(C(c1ccccc1)NC(=O)N)Cl Amb2237432 [0,2,0,0,0,0|2,0,0]=4 4798 B14R1.6455 NC(=S)C(c1ccccc1)NC(=O)C Amb17339101 [0,2,0,0,0,0|1,0,1]=4 4799 B14R1.6455 OC(=O)C(c1ccccc1)NC(=O)C Amb1117778 [0,2,0,0,0,0|1,0,1]=4 4800 B12R1.260 CC(=O)OC(C)Nc1ccco1 Amb25350526 [0,0,1,1,0,0|2,0,0]=4 4801 B12R1.438 CC(=O)Oc1cccc(C=C)[n]1 Amb24471307 [0,0,1,1,0,0|1,0,1]=4 4802 B12R1.65 CC(=O)OC1CC(=O)C=C1C=O Amb25262694 [0,0,1,1,0,0|2,0,0]=4 4803 B12R1.65 CC(=O)O[C@@H]1CC(=O)C=C1C=O Amb24743204 [0,0,1,1,0,0|2,0,0]=4 4804 B12R1.75 CC(=O)Oc1ccccc1C=C Amb18798087 [0,0,1,1,0,0|0,0,2]=4 4805 B12R2.2 C1=NC(CC1)c2cccnc2 Amb17616205 [1,0,0,1,0,0|2,0,0]=4 4806 B12R2.2 C1C=CC(N1)c2ccccc2 Amb25087257 [1,0,0,1,0,0|2,0,0]=4 4807 B12R2.2 C1C=COC1c2ccccc2 Amb24081226 [1,0,0,1,0,0|0,0,1]=3 4808 B12R2.2 C1C=NC(N1)c2ccccc2 Amb25145901 [1,0,0,1,0,0|2,0,0]=4 4809 B12R2.2 C1C=NC(S1)c2ccccc2 Amb25375170 [1,0,0,1,0,0|2,0,0]=4 4810 B12R2.2 C1CC(ON1)c2cc[n]cc2 Amb24102629 [1,0,0,1,0,0|2,0,0]=4 4811 B12R2.2 C1CCC(O1)c2cccc[n]2 Amb24729132 [1,0,0,1,0,0|1,0,1]=4 4812 B12R2.2 C1CCC(S1)c2ccccc2 Amb25801021 [1,0,0,1,0,0|0,1,1]=4 4813 B12R2.2 C1CC[C@@H](N1)c2ccccc2 Amb20241932 [1,0,0,1,0,0|1,0,1]=4 4814 B12R2.2 C1CC[C@H](N1)c2ccccc2 Amb20241933 [1,0,0,1,0,0|1,0,1]=4 4815 B12R2.2 C1CNC(C1)c2ccccc2 Amb10808365 [1,0,0,1,0,0|1,0,1]=4 4816 B12R2.2 C1CNC(C1)c2ccccc2 Amb1106311 [1,0,0,1,0,0|1,0,1]=4 4817 B12R2.2 C1COC(C1)c2ccccc2 Amb17334283 [1,0,0,1,0,0|0,0,1]=3 4818 B12R2.2 C1COC(N1)c2ccccc2 Amb17334284 [1,0,0,1,0,0|1,0,1]=4 4819 B12R2.2 C1NCC(C1)c2ccccc2 Amb10069263 [1,0,0,1,0,0|2,0,0]=4 4820 B12R2.2 C1NCC(C1)c2ccccc2 Amb10072809 [1,0,0,1,0,0|2,0,0]=4 4821 B12R2.2 C1NCC(O1)c2ccccc2 Amb18065307 [1,0,0,1,0,0|1,0,1]=4 4822 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb19887561 [1,0,0,1,0,0|2,0,0]=4 4823 B12R2.2 C1NCC[C@@H]1c2ccccc2 Amb24183516 [1,0,0,1,0,0|2,0,0]=4 4824 B12R2.2 C1NCC[C@H]1c2ccccc2 Amb19888399 [1,0,0,1,0,0|2,0,0]=4 4825 B12R2.2 C1OC=NC1c2ccccc2 Amb20247138 [1,0,0,1,0,0|1,0,1]=4 4826 B12R2.2 C1OCCC1c2ccccc2 Amb21960825 [1,0,0,1,0,0|2,0,0]=4 4827 B12R2.2 C1OCOC1c2ccccc2 Amb24101078 [1,0,0,1,0,0|0,0,2]=4 4828 B12R2.2 c1ccccc1C2NC=CO2 Amb20621985 [1,0,0,1,0,0|1,0,1]=4 4829 B12R2.22 O=C1CC(C1)c2cc[n]cc2 Amb24407200 [1,0,0,1,0,0|2,0,0]=4 4830 B12R2.22 O=C1CC(C1)c2ccc[n]c2 Amb25151161 [1,0,0,1,0,0|2,0,0]=4 4831 B12R2.22 O=C1CC(N1)c2ccc[n]c2 Amb25322297 [1,0,0,1,0,0|2,0,0]=4 4832 B12R2.22 O=C1CC(N1)c2ccccc2 Amb1993905 [1,0,0,1,0,0|1,0,0]=3 4833 B12R2.22 O=C1C[C@@H](N1)c2ccccc2 Amb24598586 [1,0,0,1,0,0|1,0,0]=3 4834 B12R2.27 CNC1CC1c2ccccc2 Amb18957298 [1,0,0,1,0,0|2,0,0]=4 4835 B12R2.27 CNC1CC1c2ccccc2 Amb20630184 [1,0,0,1,0,0|2,0,0]=4 4836 B12R2.27 CSC1CC1c2ccccc2 Amb25086341 [1,0,0,1,0,0|2,0,0]=4 4837 B12R2.27 O=CC1CC1c2ccccc2 Amb10844842 [1,0,0,1,0,0|1,0,0]=3 4838 B12R2.27 O=CC1C[C@@H]1c2ccccc2 Amb24619601 [1,0,0,1,0,0|1,0,0]=3 4839 B12R2.27 O=CC1OC1c2ccccc2 Amb25737974 [1,0,0,1,0,0|2,0,0]=4 4840 B12R2.27 O=C[C@@H]1CC1c2ccccc2 Amb25128247 [1,0,0,1,0,0|1,0,0]=3 4841 B12R2.27 O=C[C@@H]1C[C@H]1c2cc[n]cc2 Amb25288457 [1,0,0,1,0,0|2,0,0]=4 4842 B12R2.27 O=C[C@@H]1C[C@H]1c2ccccc2 Amb25368620 [1,0,0,1,0,0|1,0,0]=3 4843 B12R2.27 O=C[C@H]1CC1c2ccccc2 Amb24484808 [1,0,0,1,0,0|1,0,0]=3 4844 B12R2.116 CC1(CCO1)c2ccccc2 Amb22497354 [1,0,0,1,0,0|0,0,1]=3 4845 B12R2.116 CC1(CNC1)c2ccccc2 Amb18065223 [1,0,0,1,0,0|2,0,0]=4 4846 B12R2.116 CC1(CNC1)c2ccccc2 Amb22549211 [1,0,0,1,0,0|2,0,0]=4 4847 B12R2.116 CC1(COC1)c2ccccc2 Amb22497353 [1,0,0,1,0,0|2,0,0]=4 4848 B12R2.931 CNCC1Cc2ccccc21 Amb24670284 [1,0,0,1,0,0|2,0,0]=4 4849 B12R2.931 O=C=NC1Cc2ccccc21 Amb25149119 [1,0,0,1,0,0|1,0,1]=4 4850 B12R2.931 O=CCC1Cc2ccccc21 Amb25808254 [1,0,0,1,0,0|1,0,0]=3 4851 B12R2.1081 BrC1OCCc2ccccc21 Amb23441457 [1,0,0,1,0,0|1,0,1]=4 4852 B12R2.1081 CC1CCCc2ccccc21 Amb22730060 [1,0,0,1,0,0|1,0,1]=4 4853 B12R2.1081 CC1CNCc2c1cccc2 Amb17399906 [1,0,0,1,0,0|2,0,0]=4 4854 B12R2.1081 CC1CNCc2ccccc21 Amb22275944 [1,0,0,1,0,0|2,0,0]=4 4855 B12R2.1081 CC1COCc2ccccc21 Amb23580749 [1,0,0,1,0,0|2,0,0]=4 4856 B12R2.1081 CC1NC=Nc2ccccc21 Amb24582943 [1,0,0,1,0,0|2,0,0]=4 4857 B12R2.1081 CC1NCCc2ccccc21 Amb19514854 [1,0,0,1,0,0|1,0,1]=4 4858 B12R2.1081 CC1OCCc2ccccc21 Amb25773190 [1,0,0,1,0,0|0,0,1]=3 4859 B12R2.1081 CC1OCOc2ccccc21 Amb24070527 [1,0,0,1,0,0|0,0,2]=4 4860 B12R2.1081 CC1SC=Cc2ccccc21 Amb24485795 [1,0,0,1,0,0|0,1,1]=4 4861 B12R2.1081 C[C@@H]1CNCc2ccccc21 Amb22751935 [1,0,0,1,0,0|2,0,0]=4 4862 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22751772 [1,0,0,1,0,0|1,0,1]=4 4863 B12R2.1081 C[C@@H]1NCCc2ccccc21 Amb22756655 [1,0,0,1,0,0|1,0,1]=4 4864 B12R2.1081 C[C@H]1CNCc2ccccc21 Amb22886463 [1,0,0,1,0,0|2,0,0]=4 4865 B12R2.1081 FC1OCCc2ccccc21 Amb25073157 [1,0,0,1,0,0|1,0,1]=4 4866 B12R2.1081 IC1OCCc2ccccc21 Amb25309346 [1,0,0,1,0,0|1,0,1]=4 4867 B12R2.1081 NC1C=CCc2ccccc21 Amb18124751 [1,0,0,1,0,0|2,0,0]=4 4868 B12R2.1081 O[C@@H]1C=CCc2ccccc21 Amb25149702 [1,0,0,1,0,0|2,0,0]=4 4869 B12R2.2028 C=C1OC(=O)c2ccccc21 Amb22229358 [1,0,0,1,0,0|0,0,2]=4 4870 B12R2.2028 CC1=CC(C)c2ccccc12 Amb24641446 [1,0,0,1,0,0|1,0,0]=3 4871 B12R2.2028 CC1=CC(O)c2ccccc12 Amb17778893 [1,0,0,1,0,0|2,0,0]=4 4872 B12R2.2028 CC1=C[C@@H](Br)c2ccccc21 Amb25827191 [1,0,0,1,0,0|2,0,0]=4 4873 B12R2.2028 CC1=NC(C)c2ccccc12 Amb25223537 [1,0,0,1,0,0|1,0,0]=3 4874 B12R2.2028 CC1C=C(Cl)c2ccccc12 Amb17778911 [1,0,0,1,0,0|2,0,0]=4 4875 B12R2.2028 CC1CC(=O)c2cc[n]cc21 Amb24071420 [1,0,0,1,0,0|2,0,0]=4 4876 B12R2.2028 CC1N=C(N)c2ccccc21 Amb24426364 [1,0,0,1,0,0|2,0,0]=4 4877 B12R2.2028 CC1NC(=O)c2ccc[n]c21 Amb23536271 [1,0,0,1,0,0|2,0,0]=4 4878 B12R2.2028 CC1NC(=O)c2ccccc21 Amb24104648 [1,0,0,1,0,0|1,0,0]=3 4879 B12R2.2028 CC1NC(C)c2ccccc21 Amb20622620 [1,0,0,1,0,0|1,0,1]=4 4880 B12R2.2028 CC1OC(=O)c2[n]cccc21 Amb24071603 [1,0,0,1,0,0|1,0,0]=3 4881 B12R2.2028 CC1OC(=O)c2cc[n]cc21 Amb25373921 [1,0,0,1,0,0|1,0,0]=3 4882 B12R2.2028 CC1OC(=O)c2ccccc21 Amb24060113 [1,0,0,1,0,0|0,0,0]=2 4883 B12R2.2028 CC1OC(=S)c2ccccc21 Amb25115999 [1,0,0,1,0,0|0,1,0]=3 4884 B12R2.2028 CN1NC(=O)c2ccccc12 Amb22372319 [1,0,0,1,0,0|2,0,0]=4 4885 B12R2.2028 CN1OC(=O)c2ccccc12 Amb24528970 [1,0,0,1,0,0|1,0,0]=3 4886 B12R2.2028 CN1SC(=O)c2ccccc12 Amb19664923 [1,0,0,1,0,0|1,1,0]=4 4887 B12R2.2028 C[C@@H]1CC(=O)c2ccccc21 Amb24467053 [1,0,0,1,0,0|1,0,0]=3 4888 B12R2.2028 C[C@@H]1NC(=O)c2ccccc21 Amb22754730 [1,0,0,1,0,0|1,0,0]=3 4889 B12R2.2028 C[C@H]1CC(=O)c2ccccc21 Amb25768595 [1,0,0,1,0,0|1,0,0]=3 4890 B12R2.2028 C[C@H]1OC(=O)c2ccccc21 Amb24060118 [1,0,0,1,0,0|0,0,0]=2 4891 B12R2.2028 Cc1[n][n](C)c2ccccc12 Amb22491231 [1,0,0,1,0,0|2,0,0]=4 4892 B12R2.2028 Cc1oc(C)c2c[n]ccc12 Amb24760345 [1,0,0,1,0,0|1,0,1]=4 4893 B12R2.2028 Cc1oc(C)c2ccccc12 Amb25702226 [1,0,0,1,0,0|0,0,1]=3 4894 B12R2.2028 NC1CC(=O)c2ccccc21 Amb21955324 [1,0,0,1,0,0|2,0,0]=4 4895 B12R2.2028 NC1NC(=O)c2ccccc21 Amb22372261 [1,0,0,1,0,0|2,0,0]=4 4896 B12R2.2028 O=C1CC(c2c1cccc2)Br Amb10068269 [1,0,0,1,0,0|2,0,0]=4 4897 B12R2.2028 O=C1CC(c2c1cccc2)N Amb17470381 [1,0,0,1,0,0|2,0,0]=4 4898 B12R2.2028 O=C1NC(Br)c2ccccc21 Amb24728224 [1,0,0,1,0,0|2,0,0]=4 4899 B12R2.2028 O=C1NC(Cl)c2ccccc21 Amb25700425 [1,0,0,1,0,0|2,0,0]=4 4900 B12R2.2028 O=C1NC(I)c2ccccc21 Amb25149062 [1,0,0,1,0,0|2,0,0]=4 4901 B12R2.2028 O=C1NC(c2c1cccc2)O Amb17593710 [1,0,0,1,0,0|2,0,0]=4 4902 B12R2.2028 O=C1OC(=O)[13c]2[13cH][13cH][13cH][13cH][13c]21 Amb22339015 [1,0,0,1,0,0|1,0,1]=4 4903 B12R2.2028 O=C1OC(=O)c2ccccc12 Amb17748796 [1,0,0,1,0,0|1,0,1]=4 4904 B12R2.2028 O=C1OC(c2c1cccc2)O Amb10552913 [1,0,0,1,0,0|1,0,0]=3 4905 B12R2.2028 O=C1OC(c2c1cccc2)O Amb16226896 [1,0,0,1,0,0|1,0,0]=3 4906 B12R2.2028 O=[13C]1O[13C](=O)c2ccccc12 Amb22056066 [1,0,0,1,0,0|1,0,1]=4 4907 B12R2.2028 OC1OC(=O)c2[n]cccc21 Amb25222317 [1,0,0,1,0,0|2,0,0]=4 4908 B12R2.2028 OC1OC(=O)c2cc[n]cc21 Amb24426049 [1,0,0,1,0,0|2,0,0]=4 4909 B12R2.2028 OC1OC(=O)c2ccc[n]c21 Amb24092124 [1,0,0,1,0,0|2,0,0]=4 4910 B12R2.2028 OC1OS(=O)c2ccccc21 Amb25234822 [1,0,0,1,0,0|2,0,0]=4 4911 B12R2.2028 OI1OC(=O)c2ccccc12 Amb19958248 [1,0,0,1,0,0|2,0,0]=4 4912 B12R2.2028 O[C@@H]1CC(=O)c2ccccc21 Amb24724027 [1,0,0,1,0,0|2,0,0]=4 4913 B12R2.2028 O[C@H]1CC(=O)c2ccccc21 Amb25188743 [1,0,0,1,0,0|2,0,0]=4 4914 B12R2.24 C=C1Cc2ccccc2CC1 Amb25151359 [1,0,0,1,0,0|2,0,0]=4 4915 B12R2.24 CC1=Nc2c(CC1)cccc2 Amb10553816 [1,0,0,1,0,0|2,0,0]=4 4916 B12R2.24 ClC1Cc2ccccc2CO1 Amb25152704 [1,0,0,1,0,0|1,0,1]=4 4917 B12R2.24 IC1Cc2ccccc2CO1 Amb25811321 [1,0,0,1,0,0|1,0,1]=4 4918 B12R2.24 NC1Cc2ccccc2CO1 Amb24365192 [1,0,0,1,0,0|1,0,1]=4 4919 B12R2.24 O=C1C=C2C=CC=CC2=CO1 Amb25242585 [1,0,0,1,0,0|0,0,2]=4 4920 B12R2.24 O=C1CCc2c(C1)cccc2 Amb2383557 [1,0,0,1,0,0|1,0,0]=3 4921 B12R2.24 O=C1COc2c(C1)cccc2 Amb15692703 [1,0,0,1,0,0|2,0,0]=4 4922 B12R2.24 O=C1C[n+]2ccccc2CN1 Amb24342049 [1,0,0,1,0,0|2,0,0]=4 4923 B12R2.24 O=C1Cc2[n]cccc2CC1 Amb22292032 [1,0,0,1,0,0|2,0,0]=4 4924 B12R2.24 O=C1Cc2c[n]ccc2CC1 Amb24093783 [1,0,0,1,0,0|2,0,0]=4 4925 B12R2.24 O=C1Cc2cc[n]cc2CN1 Amb25760054 [1,0,0,1,0,0|2,0,0]=4 4926 B12R2.24 O=C1Cc2ccc[n]c2CN1 Amb24513882 [1,0,0,1,0,0|2,0,0]=4 4927 B12R2.24 O=C1Cc2ccc[n]c2CO1 Amb22494099 [1,0,0,1,0,0|1,0,0]=3 4928 B12R2.24 O=C1Cc2ccccc2CO1 Amb17750259 [1,0,0,1,0,0|0,0,0]=2 4929 B12R2.24 O=C1Cc2ccccc2N=C1 Amb24078566 [1,0,0,1,0,0|2,0,0]=4 4930 B12R2.24 O=C1Cc2ccccc2NC1 Amb18202302 [1,0,0,1,0,0|2,0,0]=4 4931 B12R2.24 O=C1Cc2ccccc2NN1 Amb24583135 [1,0,0,1,0,0|2,0,0]=4 4932 B12R2.24 O=C1Cc2ccccc2SC1 Amb22231635 [1,0,0,1,0,0|2,0,0]=4 4933 B12R2.24 O=C1NCc2c(N1)cccc2 Amb10603974 [1,0,0,1,0,0|2,0,0]=4 4934 B12R2.24 O=C1NCc2ccccc2S1 Amb24713217 [1,0,0,1,0,0|2,0,0]=4 4935 B12R2.24 O=C1Nc2[n]cccc2CO1 Amb24634652 [1,0,0,1,0,0|2,0,0]=4 4936 B12R2.24 O=C1Nc2ccccc2CO1 Amb19516356 [1,0,0,1,0,0|1,0,0]=3 4937 B12R2.24 O=C1Nc2ccccc2CS1 Amb24509578 [1,0,0,1,0,0|1,1,0]=4 4938 B12R2.24 O=C1OCc2ccccc2O1 Amb24536007 [1,0,0,1,0,0|1,0,0]=3 4939 B12R2.24 OC1OCc2c(C1)cccc2 Amb17593730 [1,0,0,1,0,0|0,0,2]=4 4940 B12R2.24 S=C1Cc2ccccc2CN1 Amb24538124 [1,0,0,1,0,0|1,1,0]=4 4941 B12R2.92 CC1(C)OC1c2ccccc2 Amb21964286 [1,0,0,1,0,0|1,0,1]=4 4942 B12R2.92 CC1(O)OC1c2ccccc2 Amb24353312 [1,0,0,1,0,0|0,0,2]=4 4943 B12R2.2057 C1O[C@@H]1OCc2ccccc2 Amb24631881 [1,0,0,1,0,0|0,0,2]=4 4944 B12R2.2403 CC1(C)OCc2ccccc12 Amb23558274 [1,0,0,1,0,0|1,0,1]=4 4945 B12R2.2403 C[Si]1(C)OCc2ccccc12 Amb22167083 [1,0,0,1,0,0|1,1,0]=4 4946 B12R2.2403 OP1(=O)OCc2ccccc12 Amb25149207 [1,0,0,1,0,0|2,0,0]=4 4947 B12R2.3190 CC(=O)N1Cc2ccccc12 Amb25148191 [1,0,0,1,0,0|1,0,0]=3 4948 B12R2.3190 NC(=O)C1Cc2ccccc21 Amb25064297 [1,0,0,1,0,0|2,0,0]=4 4949 B12R2.3190 O=C(Cl)C1Cc2ccccc21 Amb24745572 [1,0,0,1,0,0|2,0,0]=4 4950 B12R2.18 C=C1Cc2ccccc2C1O Amb25045696 [0,0,0,1,1,0|2,0,0]=4 4951 B12R2.18 CC1=Cc2[n]cccc2C1C Amb24070886 [0,0,0,1,1,0|2,0,0]=4 4952 B12R2.18 CC1=Cc2ccccc2C1Br Amb24757677 [0,0,0,1,1,0|2,0,0]=4 4953 B12R2.18 CC1=Cc2ccccc2C1O Amb17778950 [0,0,0,1,1,0|2,0,0]=4 4954 B12R2.18 CC1C(=O)Cc2cc[n]cc21 Amb24456658 [0,0,0,1,1,0|1,0,0]=3 4955 B12R2.18 CC1C(=O)Cc2ccccc21 Amb20622460 [0,0,0,1,1,0|0,0,0]=2 4956 B12R2.18 CC1C(=O)N=C2C=CC=CN21 Amb24102443 [0,0,0,1,1,0|2,0,0]=4 4957 B12R2.18 CC1C(=O)Nc2ccc[n]c21 Amb24330952 [0,0,0,1,1,0|2,0,0]=4 4958 B12R2.18 CC1C(=O)Oc2ccccc21 Amb25150504 [0,0,0,1,1,0|1,0,0]=3 4959 B12R2.18 CC1C(=O)Sc2ccccc21 Amb24519014 [0,0,0,1,1,0|1,0,0]=3 4960 B12R2.18 CC1C(=S)Nc2ccccc21 Amb23571295 [0,0,0,1,1,0|1,1,0]=4 4961 B12R2.18 CC1C(C)Nc2c1cccc2 Amb17593676 [0,0,0,1,1,0|1,0,1]=4 4962 B12R2.18 CC1C(N)Cc2ccccc21 Amb18124847 [0,0,0,1,1,0|1,0,1]=4 4963 B12R2.18 CC1C(O)Cc2ccccc21 Amb20622729 [0,0,0,1,1,0|0,0,2]=4 4964 B12R2.18 CC1c2ccccc2CN1N Amb25255493 [0,0,0,1,1,0|2,0,0]=4 4965 B12R2.18 CC=1C(=O)CN2C=CC=CC21 Amb25151212 [0,0,0,1,1,0|1,0,1]=4 4966 B12R2.18 CC=1c2ccccc2CC1C Amb21948330 [0,0,0,1,1,0|1,0,1]=4 4967 B12R2.18 CN1C(=O)Cc2cc[n]cc12 Amb22491400 [0,0,0,1,1,0|2,0,0]=4 4968 B12R2.18 CN1C(=O)Cc2ccc[n]c12 Amb24334650 [0,0,0,1,1,0|2,0,0]=4 4969 B12R2.18 CN1C(=O)Nc2ccccc12 Amb18537193 [0,0,0,1,1,0|2,0,0]=4 4970 B12R2.18 CN1C(=O)Oc2ccccc12 Amb18043105 [0,0,0,1,1,0|2,0,0]=4 4971 B12R2.18 CN1C(=O)Sc2ccccc12 Amb19654015 [0,0,0,1,1,0|2,0,0]=4 4972 B12R2.18 C[C@@H]1[C@@H](O)Cc2ccccc21 Amb25176418 [0,0,0,1,1,0|0,0,2]=4 4973 B12R2.18 C[C@@H]1[C@H](O)Cc2ccccc21 Amb24546023 [0,0,0,1,1,0|0,0,2]=4 4974 B12R2.18 C[C@H]1[C@@H](N)Cc2ccccc21 Amb24562844 [0,0,0,1,1,0|1,0,1]=4 4975 B12R2.18 C[n+]1c(C)oc2c1cccc2 Amb10573332 [0,0,0,1,1,0|1,0,1]=4 4976 B12R2.18 C[n+]1c(C)sc2c1cccc2 Amb10601727 [0,0,0,1,1,0|1,1,0]=4 4977 B12R2.18 Cc1[nH]c2c(c1C)cccc2 Amb1205252 [0,0,0,1,1,0|1,0,1]=4 4978 B12R2.18 Cc1[nH]c2ccccc2[n+]1C Amb24434872 [0,0,0,1,1,0|2,0,0]=4 4979 B12R2.18 Cc1c2ccccc2[s]c1C Amb22057362 [0,0,0,1,1,0|0,1,1]=4 4980 B12R2.18 Cn1c(=O)[nH]c2c1cccc2 Amb1159144 [0,0,0,1,1,0|2,0,0]=4 4981 B12R2.18 Cn1c(=O)oc2c1cccc2 Amb1905664 [0,0,0,1,1,0|2,0,0]=4 4982 B12R2.18 Cn1c(C)cc2c1cccc2 Amb1934988 [0,0,0,1,1,0|2,0,0]=4 4983 B12R2.18 N[C@@H]1C(=O)Nc2ccccc21 Amb24554831 [0,0,0,1,1,0|2,0,0]=4 4984 B12R2.18 N[C@@H]1C(=O)Oc2ccccc21 Amb25324246 [0,0,0,1,1,0|2,0,0]=4 4985 B12R2.18 O=C1Cc2c(N1C)cccc2 Amb1398903 [0,0,0,1,1,0|1,0,0]=3 4986 B12R2.18 O=C1Cc2c(N1N)cccc2 Amb10560115 [0,0,0,1,1,0|2,0,0]=4 4987 B12R2.18 O=C1Cc2ccccc2C1Br Amb21987890 [0,0,0,1,1,0|1,0,0]=3 4988 B12R2.18 O=C1Cc2ccccc2C1F Amb25142685 [0,0,0,1,1,0|1,0,0]=3 4989 B12R2.18 O=C1Cc2ccccc2C1[Na] Amb24605330 [0,0,0,1,1,0|1,0,0]=3 4990 B12R2.18 O=C1Nc2c(C1Br)cccc2 Amb2228105 [0,0,0,1,1,0|2,0,0]=4 4991 B12R2.18 O=C1Nc2c(C1C)cccn2 Amb17617196 [0,0,0,1,1,0|2,0,0]=4 4992 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1052761 [0,0,0,1,1,0|2,0,0]=4 4993 B12R2.18 O=C1Nc2c(C1N)cccc2 Amb1154822 [0,0,0,1,1,0|2,0,0]=4 4994 B12R2.18 O=C1Oc2ccccc2C1Cl Amb25124107 [0,0,0,1,1,0|2,0,0]=4 4995 B12R2.18 OC1C(=O)Oc2ccccc21 Amb24102222 [0,0,0,1,1,0|2,0,0]=4 4996 B12R2.18 ON1C(=O)Cc2ccccc12 Amb17940424 [0,0,0,1,1,0|2,0,0]=4 4997 B12R2.18 O[C@H]1C(=O)Nc2ccccc21 Amb25152859 [0,0,0,1,1,0|2,0,0]=4 4998 B12R2.23 CC1NCC1c2ccccc2 Amb25842786 [0,0,0,1,1,0|1,0,1]=4 4999 B12R2.23 C[C@@H]1NC[C@H]1c2ccccc2 Amb24618159 [0,0,0,1,1,0|1,0,1]=4 5000 B12R2.23 NC1CCC1c2ccccc2 Amb19335290 [0,0,0,1,1,0|1,0,1]=4 5001 B12R2.23 NC1CCC1c2ccccc2 Amb24120632 [0,0,0,1,1,0|1,0,1]=4 5002 B12R2.23 N[C@@H]1CC[C@H]1c2ccccc2 Amb25174969 [0,0,0,1,1,0|1,0,1]=4 5003 B12R2.23 O=C1CCC1c2ccc[n]c2 Amb24472315 [0,0,0,1,1,0|1,0,0]=3 5004 B12R2.23 O=C1CCC1c2ccccc2 Amb19515483 [0,0,0,1,1,0|0,0,0]=2 5005 B12R2.23 O=C1CCN1c2ccccc2 Amb16191926 [0,0,0,1,1,0|1,0,0]=3 5006 B12R2.23 O=C1CN=C1c2ccccc2 Amb25151517 [0,0,0,1,1,0|1,0,1]=4 5007 B12R2.23 O=C1CNC1c2ccccc2 Amb24449898 [0,0,0,1,1,0|1,0,0]=3 5008 B12R2.23 O=C1COC1c2ccccc2 Amb23456091 [0,0,0,1,1,0|1,0,0]=3 5009 B12R2.23 OC1CCC1c2ccccc2 Amb19374437 [0,0,0,1,1,0|0,0,2]=4 5010 B12R2.23 O[C@@H]1CC[C@H]1c2ccccc2 Amb24620488 [0,0,0,1,1,0|0,0,2]=4 5011 B12R2.23 S=C1CCN1c2ccccc2 Amb24709242 [0,0,0,1,1,0|1,1,0]=4 5012 B12R2.6 O=C1CC(CC1)c2cc[nH]c2 Amb25727884 [0,0,0,1,1,0|2,0,0]=4 5013 B12R2.6 O=C1CC(CC1)c2ccc[nH]2 Amb25145918 [0,0,0,1,1,0|2,0,0]=4 5014 B12R2.6 O=C1CCC(C1)c2ccco2 Amb17138428 [0,0,0,1,1,0|2,0,0]=4 5015 B12R2.6 O=C1CCC(C1)c2cccs2 Amb17138616 [0,0,0,1,1,0|2,0,0]=4 5016 B12R2.6 O=C1CCC(N1)c2cccs2 Amb17470466 [0,0,0,1,1,0|2,0,0]=4 5017 B12R2.6 O=C1CCC(O1)c2cccs2 Amb17334721 [0,0,0,1,1,0|1,0,0]=3 5018 B12R2.6 O=C1NCC(O1)c2cc[s]c2 Amb24509768 [0,0,0,1,1,0|2,0,0]=4 5019 B12R2.6 O=C1NCC(O1)c2ccco2 Amb17232113 [0,0,0,1,1,0|2,0,0]=4 5020 B12R2.6 O=C1NCC(O1)c2cccs2 Amb17232709 [0,0,0,1,1,0|2,0,0]=4 5021 B12R2.1354 CC(=O)C1CC1c2ccoc2 Amb24415934 [0,0,0,1,1,0|2,0,0]=4 5022 B12R2.1354 CC(=O)[C@@H]1C[C@H]1c2ccco2 Amb24741210 [0,0,0,1,1,0|2,0,0]=4 5023 B12R2.1354 CC(=O)[C@H]1C[C@@H]1c2ccc[s]2 Amb25286323 [0,0,0,1,1,0|2,0,0]=4 5024 B14R2.68 C=C1CNC(CC1)c2ccccc2 Amb25799677 [0,0,0,1,0,1|2,0,0]=4 5025 B14R2.68 C=C1CNC(OC1)c2ccccc2 Amb25765736 [0,0,0,1,0,1|2,0,0]=4 5026 B14R2.68 C[C@@H]1CO[C@H](CN1)c2ccccc2 Amb25326706 [0,0,0,1,0,1|1,0,1]=4 5027 B14R2.68 C[C@H]1CO[C@H](CN1)c2ccccc2 Amb24087465 [0,0,0,1,0,1|1,0,1]=4 5028 B14R2.68 NC=1COC(CN1)c2ccccc2 Amb24407090 [0,0,0,1,0,1|2,0,0]=4 5029 B14R2.68 O=C1CCC(=NN1)c2ccccc2 Amb1017246 [0,0,0,1,0,1|1,0,1]=4 5030 B14R2.68 O=C1CCC(CC1)c2cc[n]cc2 Amb18065559 [0,0,0,1,0,1|2,0,0]=4 5031 B14R2.68 O=C1CCC(CC1)c2ccc[n]c2 Amb18065558 [0,0,0,1,0,1|2,0,0]=4 5032 B14R2.68 O=C1CCC(CC1)c2cccc[n]2 Amb18065557 [0,0,0,1,0,1|2,0,0]=4 5033 B14R2.68 O=C1CCC(CC1)c2ccccc2 Amb1208394 [0,0,0,1,0,1|1,0,0]=3 5034 B14R2.68 O=C1CCC(CN1)c2cccc[n]2 Amb25110093 [0,0,0,1,0,1|2,0,0]=4 5035 B14R2.68 O=C1CCC(CN1)c2ccccc2 Amb17400501 [0,0,0,1,0,1|1,0,0]=3 5036 B14R2.68 O=C1CCC(N=N1)c2ccccc2 Amb10576464 [0,0,0,1,0,1|1,0,0]=3 5037 B14R2.68 O=C1CCN(C=C1)c2ccccc2 Amb24570373 [0,0,0,1,0,1|2,0,0]=4 5038 B14R2.68 O=C1CCN(CC1)c2ccccc2 Amb10070984 [0,0,0,1,0,1|2,0,0]=4 5039 B14R2.68 O=C1CCN(OC1)c2ccccc2 Amb25190301 [0,0,0,1,0,1|1,0,0]=3 5040 B14R2.68 O=C1CN=C(OC1)c2ccccc2 Amb25759529 [0,0,0,1,0,1|1,0,1]=4 5041 B14R2.68 O=C1CNC(CN1)c2ccccc2 Amb23452781 [0,0,0,1,0,1|2,0,0]=4 5042 B14R2.68 O=C1CNC(CO1)c2ccccc2 Amb18127910 [0,0,0,1,0,1|1,0,0]=3 5043 B14R2.68 O=C1CN[C@@H](CO1)c2ccccc2 Amb22748846 [0,0,0,1,0,1|1,0,0]=3 5044 B14R2.68 O=C1CN[C@H](CO1)c2ccccc2 Amb24052958 [0,0,0,1,0,1|1,0,0]=3 5045 B14R2.68 O=C1COC(CN1)c2ccccc2 Amb18224547 [0,0,0,1,0,1|1,0,0]=3 5046 B14R2.68 O=C1CSC(SC1)c2ccccc2 Amb22461597 [0,0,0,1,0,1|1,1,0]=4 5047 B14R2.68 O=C1NCC(CN1)c2ccccc2 Amb25295398 [0,0,0,1,0,1|2,0,0]=4 5048 B14R2.287 CN1CCC(=O)Cc2ccccc12 Amb18197184 [0,0,0,1,0,1|2,0,0]=4 5049 B14R2.287 O=C1NN=C(c2c(C1)cccc2)C Amb10560910 [0,0,0,1,0,1|1,0,1]=4 5050 B14R2.422 CN(C=1CC(=O)C1)c2ccccc2 Amb24416733 [0,0,0,1,0,1|2,0,0]=4 5051 B14R2.422 O[C@@H]([C@H]1CC(=O)N1)c2ccccc2 Amb25350566 [0,0,0,1,0,1|2,0,0]=4 5052 B14R2.453 CC(=O)O[C@@H]1[C@H](O)c2ccccc21 Amb25284410 [0,0,0,1,0,1|1,0,0]=3 5053 B14R2.779 CC(=O)N1CC(C1)c2ccccc2 Amb22494950 [0,0,0,1,0,1|1,0,0]=3 5054 B14R2.779 NC(=O)C1CC(C1)c2ccccc2 Amb24396903 [0,0,0,1,0,1|2,0,0]=4 5055 B14R2.779 OC(=O)C1CC(C1)c2ccccc2 Amb13951336 [0,0,0,1,0,1|2,0,0]=4 5056 B14R2.779 OC(=O)[C@@H]1C[C@H](C1)c2ccccc2 Amb24607374 [0,0,0,1,0,1|2,0,0]=4 5057 B14R2.790 CC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24273291 [0,0,0,1,0,1|1,0,0]=3 5058 B14R2.790 CC(=O)N[C@H]1C[C@@H]1c2ccc[n]c2 Amb24459310 [0,0,0,1,0,1|2,0,0]=4 5059 B14R2.790 NC(=O)NC1CC1c2ccccc2 Amb18180588 [0,0,0,1,0,1|2,0,0]=4 5060 B14R2.790 NC(=O)N[C@@H]1C[C@@H]1c2ccccc2 Amb24519168 [0,0,0,1,0,1|2,0,0]=4 5061 B14R2.790 NC(=O)N[C@@H]1C[C@H]1c2ccccc2 Amb24602073 [0,0,0,1,0,1|2,0,0]=4 5062 B14R2.790 OC(=O)CC1CC1c2ccccc2 Amb17233181 [0,0,0,1,0,1|2,0,0]=4 5063 B14R2.790 OC(=O)C[C@@H]1C[C@H]1c2ccccc2 Amb24467878 [0,0,0,1,0,1|2,0,0]=4 5064 B14R2.790 OC(=O)C[C@H]1C[C@@H]1c2ccccc2 Amb25209939 [0,0,0,1,0,1|2,0,0]=4 5065 B14R2.2950 CC1(CC(=C)CO1)c2ccccc2 Amb24459728 [0,0,0,1,0,1|1,0,0]=3 5066 B14R2.2950 CC1(CC(=O)CO1)c2ccccc2 Amb25236963 [0,0,0,1,0,1|0,0,0]=2 5067 B14R2.2950 CC1(CCC(=O)C1)c2ccc[n]c2 Amb25688171 [0,0,0,1,0,1|2,0,0]=4 5068 B14R2.2950 CC1(CNC(=O)C1)c2ccc[n]c2 Amb25154891 [0,0,0,1,0,1|2,0,0]=4 5069 B14R2.2950 CC1(COC(=O)N1)c2cc[n]cc2 Amb24563301 [0,0,0,1,0,1|2,0,0]=4 5070 B14R2.2950 CC1(COC(=O)N1)c2ccc[n]c2 Amb24692519 [0,0,0,1,0,1|2,0,0]=4 5071 B14R2.2950 CC1(COC(=O)N1)c2ccccc2 Amb23454646 [0,0,0,1,0,1|1,0,0]=3 5072 B14R2.2950 CC1(NCC(=O)N1)c2ccccc2 Amb24529913 [0,0,0,1,0,1|2,0,0]=4 5073 B14R2.2950 CC1(OC(=O)CS1)c2ccccc2 Amb24407680 [0,0,0,1,0,1|1,1,0]=4 5074 B14R2.2950 CC1CC(C)(CO1)c2ccccc2 Amb25324271 [0,0,0,1,0,1|1,0,1]=4 5075 B14R2.2950 CC=1CN[C@@](C)(C1)c2ccccc2 Amb24488973 [0,0,0,1,0,1|2,0,0]=4 5076 B14R2.2950 C[C@@]1(COC(=O)N1)c2ccccc2 Amb24344040 [0,0,0,1,0,1|1,0,0]=3 5077 B14R2.2950 C[C@@]1(C[C@@H](O)CO1)c2ccccc2 Amb24598298 [0,0,0,1,0,1|0,0,2]=4 5078 B14R2.2950 C[C@@]1(C[C@H](O)CO1)c2ccccc2 Amb24515231 [0,0,0,1,0,1|0,0,2]=4 5079 B14R2.2950 C[C@]1(CC(=O)C=C1)c2ccccc2 Amb24380820 [0,0,0,1,0,1|1,0,0]=3 5080 B14R2.2950 C[C@]1(CCC(=O)C1)c2ccccc2 Amb24689537 [0,0,0,1,0,1|1,0,0]=3 5081 B14R2.2950 C[C@]1(COC(N)=N1)c2ccccc2 Amb24561011 [0,0,0,1,0,1|2,0,0]=4 5082 B14R2.2950 O=C1NCC(O1)(C)c2ccccc2 Amb17194507 [0,0,0,1,0,1|2,0,0]=4 5083 B14R2.9520 CC(O)C1OC1(C)c2ccccc2 Amb24372039 [0,0,0,1,0,1|0,0,2]=4 5084 B14R2.9520 CC1(OC1C(=O)Cl)c2ccccc2 Amb25799596 [0,0,0,1,0,1|1,0,0]=3 5085 B14R2.9520 CC1(OC1C(N)=O)c2ccccc2 Amb24426189 [0,0,0,1,0,1|1,0,0]=3 5086 B14R2.9520 C[C@@]1(C[C@H]1C(N)=O)c2ccccc2 Amb24512054 [0,0,0,1,0,1|2,0,0]=4 5087 B14R2.9520 C[C@@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25176089 [0,0,0,1,0,1|2,0,0]=4 5088 B14R2.9520 C[C@]1(C[C@H]1C(N)=O)c2ccccc2 Amb24602361 [0,0,0,1,0,1|2,0,0]=4 5089 B14R2.9520 C[C@]1(C[C@H]1C(O)=O)c2ccccc2 Amb25366533 [0,0,0,1,0,1|2,0,0]=4 5090 B14R2.9520 OC(=O)C1OC1(C)c2ccccc2 Amb17594529 [0,0,0,1,0,1|1,0,0]=3 5091 B14R2.25733 CC(=N)N1CC(C)c2ccccc12 Amb24681446 [0,0,0,1,0,1|2,0,0]=4 5092 B14R2.25733 CC(=O)N1OC(O)c2ccccc12 Amb25058516 [0,0,0,1,0,1|1,0,0]=3 5093 B14R2.25733 CC(=O)c1[n][n](C)c2ccccc21 Amb21858000 [0,0,0,1,0,1|2,0,0]=4 5094 B14R2.25733 CC(=O)c1cn(c2c1cccc2)C Amb2437397 [0,0,0,1,0,1|2,0,0]=4 5095 B14R2.25733 CC(=O)n1cc(C)c2ccccc12 Amb17778657 [0,0,0,1,0,1|1,0,1]=4 5096 B14R2.25733 CC1=CC(c2ccccc12)C(C)=O Amb24576042 [0,0,0,1,0,1|1,0,1]=4 5097 B14R2.25733 CC1=C[C@@H](c2ccccc12)C(C)=O Amb25792958 [0,0,0,1,0,1|1,0,1]=4 5098 B14R2.25733 CC1CN(C(=O)Cl)c2ccccc21 Amb25231029 [0,0,0,1,0,1|2,0,0]=4 5099 B14R2.25733 CC1CN(C(N)=O)c2ccccc21 Amb25344539 [0,0,0,1,0,1|2,0,0]=4 5100 B14R2.25733 CC1OC(c2ccccc21)C(O)=O Amb18128113 [0,0,0,1,0,1|1,0,0]=3 5101 B14R2.25733 Cc1[nH]c(c2ccccc12)C(C)=O Amb24490059 [0,0,0,1,0,1|1,0,1]=4 5102 B14R2.25733 Cc1[n][n](c2ccccc12)C(C)=O Amb25831651 [0,0,0,1,0,1|1,0,1]=4 5103 B14R2.25733 OC(=O)C1=CC(c2c1cccc2)C Amb17232998 [0,0,0,1,0,1|2,0,0]=4 5104 B14R2.25733 OC(=O)C1CC(c2c1cccc2)C Amb17233191 [0,0,0,1,0,1|2,0,0]=4 5105 B14R2.31137 CC(=C)CNC1Cc2ccccc21 Amb24387460 [0,0,0,1,0,1|2,0,0]=4 5106 B14R2.31137 CC(=O)CCC1Cc2ccccc21 Amb25720706 [0,0,0,1,0,1|1,0,0]=3 5107 B14R2.31137 OC(=O)CCC1Cc2ccccc21 Amb25684770 [0,0,0,1,0,1|2,0,0]=4 5108 B14R2.19 CC=1CCC(C1)Nc2ccccc2 Amb25096401 [0,0,0,1,0,1|2,0,0]=4 5109 B14R2.19 O=C1CC(CC1)Sc2cccc[n]2 Amb25731692 [0,0,0,1,0,1|2,0,0]=4 5110 B14R2.19 O=C1CC(CC1)Sc2ccccc2 Amb25815229 [0,0,0,1,0,1|1,0,0]=3 5111 B14R2.19 O=C1CC(Cc2ccc[n]c2)CC1 Amb25684374 [0,0,0,1,0,1|2,0,0]=4 5112 B14R2.19 O=C1CC(Cc2ccccc2)CC1 Amb24455173 [0,0,0,1,0,1|1,0,0]=3 5113 B14R2.19 O=C1CCC(=C1)Sc2ccccc2 Amb25343199 [0,0,0,1,0,1|1,0,1]=4 5114 B14R2.19 O=C1CCC(Cc2cccc[n]2)N1 Amb25763357 [0,0,0,1,0,1|2,0,0]=4 5115 B14R2.19 O=C1CCC(Cc2ccccc2)O1 Amb20669272 [0,0,0,1,0,1|0,0,0]=2 5116 B14R2.19 O=C1CCN(C1)Cc2ccccc2 Amb1680105 [0,0,0,1,0,1|2,0,0]=4 5117 B14R2.19 O=C1CCN(N1)Cc2ccccc2 Amb2423894 [0,0,0,1,0,1|2,0,0]=4 5118 B14R2.19 O=C1CC[C@@H](Cc2ccccc2)N1 Amb25068439 [0,0,0,1,0,1|1,0,0]=3 5119 B14R2.19 O=C1CC[C@H](Cc2ccccc2)N1 Amb25365168 [0,0,0,1,0,1|1,0,0]=3 5120 B14R2.19 O=C1CC\C(=C\c2ccccc2)\O1 Amb24490546 [0,0,0,1,0,1|0,0,1]=3 5121 B14R2.19 O=C1CC\C(\N1)=N\c2ccccc2 Amb24642454 [0,0,0,1,0,1|1,0,1]=4 5122 B14R2.19 O=C1CC\[N+](=C/c2ccccc2)\[N-]1 Amb2423893 [0,0,0,1,0,1|2,0,0]=4 5123 B14R2.19 O=C1CC\[N+](=C\c2ccccc2)\[N-]1 Amb24640748 [0,0,0,1,0,1|2,0,0]=4 5124 B14R2.19 O=C1CN(Cc2ccccc2)CC1 Amb18048933 [0,0,0,1,0,1|2,0,0]=4 5125 B14R2.19 O=C1C[C@@H](Cc2ccccc2)CC1 Amb24723978 [0,0,0,1,0,1|1,0,0]=3 5126 B14R2.19 O=C1NCC(C1)Cc2ccccc2 Amb10608007 [0,0,0,1,0,1|2,0,0]=4 5127 B14R2.19 O=C1NCC(C[n+]2ccccc2)O1 Amb25046769 [0,0,0,1,0,1|2,0,0]=4 5128 B14R2.19 O=C1NCC(Cc2ccccc2)N1 Amb18061673 [0,0,0,1,0,1|2,0,0]=4 5129 B14R2.19 O=C1NCC(Cc2ccccc2)O1 Amb18061675 [0,0,0,1,0,1|1,0,0]=3 5130 B14R2.19 O=C1N[C@@H](Cc2ccccc2)CS1 Amb19887642 [0,0,0,1,0,1|2,0,0]=4 5131 B14R2.19 O=C1N[C@H](Cc2ccccc2)CS1 Amb19888420 [0,0,0,1,0,1|2,0,0]=4 5132 B14R2.19 O=C1OC(Cc2ccccc2)CS1 Amb25726403 [0,0,0,1,0,1|1,0,0]=3 5133 B14R2.19 O=C1OCC(O1)Sc2cc[n]cc2 Amb24410445 [0,0,0,1,0,1|2,0,0]=4 5134 B14R2.19 O=C1OCC(O1)Sc2cccc[n]2 Amb25749218 [0,0,0,1,0,1|2,0,0]=4 5135 B14R2.19 O=C1OCC(O1)Sc2ccccc2 Amb25749160 [0,0,0,1,0,1|1,0,0]=3 5136 B14R2.598 CC1=CC(=O)CC1c2ccccc2 Amb17594322 [0,0,0,1,0,1|1,0,1]=4 5137 B14R2.598 CC1CC(=O)C=C1c2ccccc2 Amb25112554 [0,0,0,1,0,1|1,0,1]=4 5138 B14R2.598 CC1CC(=O)NC1c2ccccc2 Amb24715638 [0,0,0,1,0,1|2,0,0]=4 5139 B14R2.598 CC1N=C(N)CC1c2ccccc2 Amb25700422 [0,0,0,1,0,1|2,0,0]=4 5140 B14R2.598 CC1NC(=O)OC1c2ccccc2 Amb10845025 [0,0,0,1,0,1|2,0,0]=4 5141 B14R2.598 CC1OC(=O)NC1c2ccccc2 Amb25759483 [0,0,0,1,0,1|1,0,0]=3 5142 B14R2.598 CC1OC(=O)OC1c2ccccc2 Amb25263220 [0,0,0,1,0,1|1,0,0]=3 5143 B14R2.598 CC1OC(=S)NC1c2ccccc2 Amb25077303 [0,0,0,1,0,1|1,1,0]=4 5144 B14R2.598 CC1OC(N)=NC1c2ccccc2 Amb24710185 [0,0,0,1,0,1|2,0,0]=4 5145 B14R2.598 CC=1NC(C(C)N1)c2ccccc2 Amb25808989 [0,0,0,1,0,1|2,0,0]=4 5146 B14R2.598 CC=1N[C@H]([C@H](C)N1)c2ccccc2 Amb25208406 [0,0,0,1,0,1|2,0,0]=4 5147 B14R2.598 CN1CC(=O)CC1c2ccccc2 Amb23437184 [0,0,0,1,0,1|2,0,0]=4 5148 B14R2.598 C[C@@H]1CC(=O)C[C@@H]1c2ccccc2 Amb25373264 [0,0,0,1,0,1|1,0,0]=3 5149 B14R2.598 C[C@@H]1CC(=O)C[C@H]1c2ccccc2 Amb24584459 [0,0,0,1,0,1|1,0,0]=3 5150 B14R2.598 C[C@@H]1CC(=O)N[C@H]1c2ccccc2 Amb24585758 [0,0,0,1,0,1|2,0,0]=4 5151 B14R2.598 C[C@@H]1NC(=O)O[C@@H]1c2ccccc2 Amb10068685 [0,0,0,1,0,1|2,0,0]=4 5152 B14R2.598 C[C@@H]1NC(=O)O[C@H]1c2ccccc2 Amb17617584 [0,0,0,1,0,1|2,0,0]=4 5153 B14R2.598 C[C@@H]1OC(=O)N[C@@H]1c2ccccc2 Amb25226668 [0,0,0,1,0,1|1,0,0]=3 5154 B14R2.598 C[C@@H]1OC(=O)N[C@H]1c2ccccc2 Amb25220629 [0,0,0,1,0,1|1,0,0]=3 5155 B14R2.598 C[C@H]1CC(=O)C[C@H]1c2ccccc2 Amb24583010 [0,0,0,1,0,1|1,0,0]=3 5156 B14R2.598 C[C@H]1CC(=O)N[C@@H]1c2ccccc2 Amb25231239 [0,0,0,1,0,1|2,0,0]=4 5157 B14R2.598 C[C@H]1NC(=O)OC1c2ccccc2 Amb24534608 [0,0,0,1,0,1|2,0,0]=4 5158 B14R2.598 C[C@H]1NC(=O)S[C@@H]1c2ccccc2 Amb24599009 [0,0,0,1,0,1|2,0,0]=4 5159 B14R2.598 C[C@H]1NC(=O)S[C@H]1c2ccccc2 Amb24610222 [0,0,0,1,0,1|2,0,0]=4 5160 B14R2.598 C[n]1oc(=O)cc1-c2ccccc2 Amb24065754 [0,0,0,1,0,1|1,0,1]=4 5161 B14R2.598 O=C1OC(=O)CN1c2ccccc2 Amb25084575 [0,0,0,1,0,1|1,0,1]=4 5162 B14R2.598 O=C1OC(=O)C[C@@H]1c2ccccc2 Amb23401547 [0,0,0,1,0,1|1,0,1]=4 5163 B14R2.598 OC1CC(=O)CC1c2ccccc2 Amb24545651 [0,0,0,1,0,1|2,0,0]=4 5164 B14R2.598 OC1OC(=O)CC1c2ccccc2 Amb25058513 [0,0,0,1,0,1|1,0,0]=3 5165 B14R2.598 OC1OC(=O)C[C@H]1c2ccccc2 Amb24748335 [0,0,0,1,0,1|1,0,0]=3 5166 B14R2.598 OC1OC(=O)OC1c2ccccc2 Amb25788943 [0,0,0,1,0,1|2,0,0]=4 5167 B14R2.642 CC(=O)c1c(C)sc2c1cccc2 Amb10607613 [0,0,0,1,0,1|1,0,1]=4 5168 B14R2.642 CC(=O)c1c2ccccc2[n][n]1C Amb25158432 [0,0,0,1,0,1|2,0,0]=4 5169 B14R2.642 CC1Cc2ccccc2C1C(O)=O Amb18127734 [0,0,0,1,0,1|2,0,0]=4 5170 B14R2.642 CC1Oc2ccccc2C1C(O)=O Amb25287233 [0,0,0,1,0,1|2,0,0]=4 5171 B14R2.642 CC=1Cc2ccccc2C1C(C)=O Amb24492413 [0,0,0,1,0,1|1,0,1]=4 5172 B14R2.642 C[C@H]1Cc2ccccc2[C@H]1C(O)=O Amb24558175 [0,0,0,1,0,1|2,0,0]=4 5173 B14R2.738 CC1=CC(=O)Cc2ccccc2O1 Amb24646596 [0,0,0,1,0,1|1,0,1]=4 5174 B14R2.738 CC1CC(=O)Nc2c(N1)cccc2 Amb1649573 [0,0,0,1,0,1|2,0,0]=4 5175 B14R2.738 CC1Cc2ccccc2NC(=O)C1 Amb24490332 [0,0,0,1,0,1|2,0,0]=4 5176 B14R2.738 CC=1CC(C)Nc2ccccc2N1 Amb25798137 [0,0,0,1,0,1|2,0,0]=4 5177 B14R2.738 C[C@@H]1CC(=O)Nc2ccccc2S1 Amb25309651 [0,0,0,1,0,1|2,0,0]=4 5178 B14R2.738 C[C@@H]1Cc2ccccc2NC(=O)C1 Amb24490233 [0,0,0,1,0,1|2,0,0]=4 5179 B14R2.738 C[C@H]1CC(=O)Nc2ccccc2O1 Amb24419821 [0,0,0,1,0,1|2,0,0]=4 5180 B14R2.738 C[C@H]1CC(=O)Nc2ccccc2S1 Amb25190429 [0,0,0,1,0,1|2,0,0]=4 5181 B14R2.764 CC(=O)C/1C\C1=C\c2ccccc2 Amb25034284 [0,0,0,1,0,1|1,0,1]=4 5182 B14R2.764 CC(=O)C1CC1Oc2ccccc2 Amb24408342 [0,0,0,1,0,1|1,0,0]=3 5183 B14R2.764 CC(=O)C1OC1Cc2ccccc2 Amb24706975 [0,0,0,1,0,1|2,0,0]=4 5184 B14R2.764 CC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb24655035 [0,0,0,1,0,1|1,0,0]=3 5185 B14R2.764 CC(=O)[C@@H]1O[C@H]1Cc2ccccc2 Amb24512629 [0,0,0,1,0,1|2,0,0]=4 5186 B14R2.764 NC(=O)C1CC1Cc2ccccc2 Amb25802442 [0,0,0,1,0,1|2,0,0]=4 5187 B14R2.764 NC(=O)C1CC1Oc2ccccc2 Amb25702314 [0,0,0,1,0,1|2,0,0]=4 5188 B14R2.764 NC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb24649972 [0,0,0,1,0,1|2,0,0]=4 5189 B14R2.764 OC(=O)C1CC1Cc2ccccc2 Amb18990227 [0,0,0,1,0,1|2,0,0]=4 5190 B14R2.764 OC(=O)[C@@H]1C[C@H]1Cc2ccccc2 Amb25179092 [0,0,0,1,0,1|2,0,0]=4 5191 B14R2.764 OC(=O)[C@@H]1C[C@H]1Oc2ccccc2 Amb25173187 [0,0,0,1,0,1|2,0,0]=4 5192 B14R2.768 CC(=O)C=C1Cc2ccccc2C1 Amb24490905 [0,0,0,1,0,1|1,0,1]=4 5193 B14R2.768 CC(=O)CC1Oc2ccccc2O1 Amb24736389 [0,0,0,1,0,1|2,0,0]=4 5194 B14R2.768 CC(=O)CN1Cc2ccccc2C1 Amb18185903 [0,0,0,1,0,1|2,0,0]=4 5195 B14R2.768 CC(=O)NC1Cc2c(C1)cccc2 Amb2031411 [0,0,0,1,0,1|1,0,0]=3 5196 B14R2.768 CC(=O)N[C@@H]1Cc2ccc[n]c2C1 Amb24473031 [0,0,0,1,0,1|2,0,0]=4 5197 B14R2.768 CC(=O)OC1Cc2ccccc2C1 Amb22234649 [0,0,0,1,0,1|0,0,0]=2 5198 B14R2.768 CC(=O)Oc1cc2ccccc2o1 Amb24586556 [0,0,0,1,0,1|0,0,2]=4 5199 B14R2.768 CC(=O)SC1Cc2ccccc2C1 Amb24590122 [0,0,0,1,0,1|0,1,0]=3 5200 B14R2.768 CC(C)=CC1Cc2ccccc2N1 Amb24488854 [0,0,0,1,0,1|2,0,0]=4 5201 B14R2.768 NC(=O)OC1Cc2ccccc2C1 Amb25775009 [0,0,0,1,0,1|1,0,0]=3 5202 B14R2.768 O=C(Cl)CC1Cc2ccccc2C1 Amb25694239 [0,0,0,1,0,1|2,0,0]=4 5203 B14R2.768 OC(=O)CC1Cc2c(O1)cccc2 Amb17606149 [0,0,0,1,0,1|2,0,0]=4 5204 B14R2.768 OC(=O)CC1Cc2ccccc2S1 Amb18189899 [0,0,0,1,0,1|2,0,0]=4 5205 B14R2.4586 CC1C(C1C(O)=O)c2ccccc2 Amb24440802 [0,0,0,1,0,1|2,0,0]=4 5206 B14R2.4586 C[C@@H]1[C@@H]([C@@H]1C(O)=O)c2ccccc2 Amb25209963 [0,0,0,1,0,1|2,0,0]=4 5207 B14R2.4586 C[C@@H]1[C@H]([C@@H]1C(O)=O)c2ccccc2 Amb25274087 [0,0,0,1,0,1|2,0,0]=4 5208 B14R2.4586 C[C@H]1[C@H]([C@H]1C(O)=O)c2ccccc2 Amb24591205 [0,0,0,1,0,1|2,0,0]=4 5209 B14R2.8189 CC1Nc2ccccc2C(C)(C)O1 Amb24488850 [0,0,0,1,0,1|1,0,1]=4 5210 B14R2.4359 O=C1CC(CN1)C=2C=CC=CNC2 Amb25086856 [0,0,0,1,0,1|2,0,0]=4 5211 B14R2.8 CNC=1CC(CN1)c2ccccc2 Amb24375653 [0,1,0,1,0,0|2,0,0]=4 5212 B14R2.8 COC1CCC(O1)c2ccccc2 Amb24572881 [0,1,0,1,0,0|0,0,2]=4 5213 B14R2.8 ClCC1=N[C@H](CO1)c2ccccc2 Amb25331175 [0,1,0,1,0,0|1,0,1]=4 5214 B14R2.8 Cl\C=C/1\CCC(O1)c2ccccc2 Amb24626654 [0,1,0,1,0,0|1,0,0]=3 5215 B14R2.8 ICC1CCC(O1)c2ccccc2 Amb24744199 [0,1,0,1,0,0|1,0,1]=4 5216 B14R2.8 NCC1CCC(O1)c2ccccc2 Amb25060147 [0,1,0,1,0,0|1,0,1]=4 5217 B14R2.8 NCC1OCC(O1)c2ccccc2 Amb17470594 [0,1,0,1,0,0|0,0,2]=4 5218 B14R2.8 O=CC1=CCC(S1)c2ccccc2 Amb24570871 [0,1,0,1,0,0|0,1,1]=4 5219 B14R2.8 O=CC1=CC[C@H](S1)c2ccccc2 Amb24614767 [0,1,0,1,0,0|0,1,1]=4 5220 B14R2.8 O=CC1CC(CC1)c2ccccc2 Amb24364116 [0,1,0,1,0,0|1,0,1]=4 5221 B14R2.8 O=CC1CCC(O1)c2cc[n]cc2 Amb25830192 [0,1,0,1,0,0|1,0,1]=4 5222 B14R2.8 O=CC=1CCN(N1)c2ccccc2 Amb24356723 [0,1,0,1,0,0|2,0,0]=4 5223 B14R2.8 O=CC=1COC(C1)c2ccccc2 Amb24582493 [0,1,0,1,0,0|2,0,0]=4 5224 B14R2.8 O=CN1CC(CC1)c2ccccc2 Amb24685502 [0,1,0,1,0,0|2,0,0]=4 5225 B14R2.8 O=C[C@@H]1COC(O1)c2ccccc2 Amb24416692 [0,1,0,1,0,0|1,0,1]=4 5226 B14R2.8 O=C[C@@H]1OC[C@H](O1)c2ccccc2 Amb24512918 [0,1,0,1,0,0|1,0,1]=4 5227 B14R2.8 O=C[C@H]1COC(O1)c2ccccc2 Amb25857402 [0,1,0,1,0,0|1,0,1]=4 5228 B14R2.8 OCC1CCC(O1)c2ccccc2 Amb24593841 [0,1,0,1,0,0|0,0,2]=4 5229 B14R2.8 OC[C@H]1CC[C@H](O1)c2ccccc2 Amb25246550 [0,1,0,1,0,0|0,0,2]=4 5230 B14R2.21 CC=1CC(NCC1)c2ccccc2 Amb25046867 [0,1,0,1,0,0|2,0,0]=4 5231 B14R2.21 CC=1CC(OCC1)c2ccccc2 Amb24066155 [0,1,0,1,0,0|2,0,0]=4 5232 B14R2.21 C[C@@H]1CNC[C@H](O1)c2ccccc2 Amb25377011 [0,1,0,1,0,0|1,0,1]=4 5233 B14R2.21 C[C@H]1CNCC(O1)c2ccccc2 Amb24534407 [0,1,0,1,0,0|1,0,1]=4 5234 B14R2.21 NC1=NC(CCS1)c2ccccc2 Amb25774997 [0,1,0,1,0,0|2,0,0]=4 5235 B14R2.21 NC=1CCCC(N1)c2ccccc2 Amb25138745 [0,1,0,1,0,0|2,0,0]=4 5236 B14R2.21 NC=1COCC(N1)c2ccccc2 Amb25245328 [0,1,0,1,0,0|2,0,0]=4 5237 B14R2.21 NC=1NCCC(N1)c2ccccc2 Amb18127516 [0,1,0,1,0,0|2,0,0]=4 5238 B14R2.21 O=C1C=CCC(N1)c2ccccc2 Amb25309660 [0,1,0,1,0,0|1,0,1]=4 5239 B14R2.21 O=C1C=CC[C@@H](N1)c2ccccc2 Amb25201635 [0,1,0,1,0,0|1,0,1]=4 5240 B14R2.21 O=C1C=CC[C@@H](O1)c2ccccc2 Amb25157497 [0,1,0,1,0,0|0,0,1]=3 5241 B14R2.21 O=C1CC(CC=C1)c2ccccc2 Amb23443331 [0,1,0,1,0,0|1,0,1]=4 5242 B14R2.21 O=C1CC(CCC1)c2cc[n]cc2 Amb25044331 [0,1,0,1,0,0|2,0,0]=4 5243 B14R2.21 O=C1CC(CCC1)c2ccc[n]c2 Amb24553703 [0,1,0,1,0,0|2,0,0]=4 5244 B14R2.21 O=C1CC(CCC1)c2cccc[n]2 Amb21961938 [0,1,0,1,0,0|2,0,0]=4 5245 B14R2.21 O=C1CC(CCC1)c2ccccc2 Amb18065540 [0,1,0,1,0,0|1,0,0]=3 5246 B14R2.21 O=C1CC(CCN1)c2ccccc2 Amb20171612 [0,1,0,1,0,0|1,0,0]=3 5247 B14R2.21 O=C1CC(CCO1)c2ccccc2 Amb22499444 [0,1,0,1,0,0|1,0,0]=3 5248 B14R2.21 O=C1CC(NCC1)c2cc[n]cc2 Amb18196727 [0,1,0,1,0,0|2,0,0]=4 5249 B14R2.21 O=C1CC(NCC1)c2cccc[n]2 Amb18196728 [0,1,0,1,0,0|2,0,0]=4 5250 B14R2.21 O=C1CC(NCC1)c2ccccc2 Amb22274020 [0,1,0,1,0,0|1,0,0]=3 5251 B14R2.21 O=C1CC(OCC1)c2cc[n]cc2 Amb23586180 [0,1,0,1,0,0|2,0,0]=4 5252 B14R2.21 O=C1CC(OCC1)c2ccc[n]c2 Amb23586184 [0,1,0,1,0,0|2,0,0]=4 5253 B14R2.21 O=C1CC(OCC1)c2ccccc2 Amb19957821 [0,1,0,1,0,0|1,0,0]=3 5254 B14R2.21 O=C1CC=C[C@@H](N1)c2ccccc2 Amb24490247 [0,1,0,1,0,0|1,0,1]=4 5255 B14R2.21 O=C1CCCC(N1)c2cccc[n]2 Amb23569074 [0,1,0,1,0,0|2,0,0]=4 5256 B14R2.21 O=C1CCCC(O1)c2ccccc2 Amb24118032 [0,1,0,1,0,0|0,0,0]=2 5257 B14R2.21 O=C1CCC[C@@H](N1)c2ccccc2 Amb24759096 [0,1,0,1,0,0|1,0,0]=3 5258 B14R2.21 O=C1CCC[C@@H](O1)c2ccccc2 Amb25097059 [0,1,0,1,0,0|0,0,0]=2 5259 B14R2.21 O=C1CCC[C@H](N1)c2ccccc2 Amb25131134 [0,1,0,1,0,0|1,0,0]=3 5260 B14R2.21 O=C1CCC[C@H](O1)c2ccccc2 Amb25100832 [0,1,0,1,0,0|0,0,0]=2 5261 B14R2.21 O=C1CCNC(=N1)c2ccccc2 Amb25053953 [0,1,0,1,0,0|1,0,1]=4 5262 B14R2.21 O=C1CCNC(C1)c2ccccc2 Amb17233086 [0,1,0,1,0,0|1,0,0]=3 5263 B14R2.21 O=C1CCNC(C1)c2cccnc2 Amb17233193 [0,1,0,1,0,0|2,0,0]=4 5264 B14R2.21 O=C1CCOC(=C1)c2ccccc2 Amb22750040 [0,1,0,1,0,0|1,0,1]=4 5265 B14R2.21 O=C1CCOC(N1)c2ccccc2 Amb24757545 [0,1,0,1,0,0|1,0,0]=3 5266 B14R2.21 O=C1CN(CCC1)c2ccccc2 Amb19958729 [0,1,0,1,0,0|2,0,0]=4 5267 B14R2.21 O=C1CNCC(N1)c2cc[n]cc2 Amb25705188 [0,1,0,1,0,0|2,0,0]=4 5268 B14R2.21 O=C1CNCC(O1)c2ccccc2 Amb23536463 [0,1,0,1,0,0|0,0,0]=2 5269 B14R2.21 O=C1COCC(N1)c2cc[n]cc2 Amb25782968 [0,1,0,1,0,0|2,0,0]=4 5270 B14R2.21 O=C1COCC(N1)c2ccc[n]c2 Amb25125963 [0,1,0,1,0,0|2,0,0]=4 5271 B14R2.21 O=C1COCC(N1)c2cccc[n]2 Amb24494857 [0,1,0,1,0,0|2,0,0]=4 5272 B14R2.21 O=C1COCC(N1)c2ccccc2 Amb21864800 [0,1,0,1,0,0|1,0,0]=3 5273 B14R2.21 O=C1COC[C@@H](N1)c2ccc[n]c2 Amb25704205 [0,1,0,1,0,0|2,0,0]=4 5274 B14R2.21 O=C1COC[C@@H](N1)c2ccccc2 Amb24181880 [0,1,0,1,0,0|1,0,0]=3 5275 B14R2.21 O=C1COC[C@H](N1)c2cc[n]cc2 Amb25140157 [0,1,0,1,0,0|2,0,0]=4 5276 B14R2.21 O=C1COC[C@H](N1)c2ccc[n]c2 Amb25687602 [0,1,0,1,0,0|2,0,0]=4 5277 B14R2.21 O=C1COC[C@H](N1)c2ccccc2 Amb24654701 [0,1,0,1,0,0|1,0,0]=3 5278 B14R2.21 O=C1CP(CCN1)c2ccccc2 Amb25105493 [0,1,0,1,0,0|2,0,0]=4 5279 B14R2.21 O=C1C[C@@H](CC=C1)c2ccccc2 Amb24492589 [0,1,0,1,0,0|1,0,1]=4 5280 B14R2.21 O=C1C[C@@H](CCC1)c2ccccc2 Amb22745610 [0,1,0,1,0,0|1,0,0]=3 5281 B14R2.21 O=C1C[C@@H](CCO1)c2ccccc2 Amb25113432 [0,1,0,1,0,0|1,0,0]=3 5282 B14R2.21 O=C1C[C@@H](OCC1)c2ccccc2 Amb22748229 [0,1,0,1,0,0|1,0,0]=3 5283 B14R2.21 O=C1C[C@H](CC=C1)c2ccccc2 Amb25373085 [0,1,0,1,0,0|1,0,1]=4 5284 B14R2.21 O=C1C[C@H](CCN1)c2ccccc2 Amb25191711 [0,1,0,1,0,0|1,0,0]=3 5285 B14R2.21 O=C1C[C@H](OCC1)c2ccccc2 Amb24408429 [0,1,0,1,0,0|1,0,0]=3 5286 B14R2.21 O=C1NC(CCN1)c2cccc[n]2 Amb24358813 [0,1,0,1,0,0|2,0,0]=4 5287 B14R2.21 O=C1NC(CCN1)c2ccccc2 Amb25733512 [0,1,0,1,0,0|1,0,0]=3 5288 B14R2.21 O=C1NC(CCO1)c2cc[n]cc2 Amb25795538 [0,1,0,1,0,0|2,0,0]=4 5289 B14R2.21 O=C1NCC=C(O1)c2ccccc2 Amb23596887 [0,1,0,1,0,0|0,0,2]=4 5290 B14R2.21 O=C1NCCC(O1)c2ccccc2 Amb25081073 [0,1,0,1,0,0|0,0,0]=2 5291 B14R2.21 O=C1NN(CCN1)c2ccccc2 Amb25190360 [0,1,0,1,0,0|2,0,0]=4 5292 B14R2.21 O=C1N[C@@H](CCN1)c2ccccc2 Amb25288289 [0,1,0,1,0,0|1,0,0]=3 5293 B14R2.21 O=C1N[C@@H](CCO1)c2ccccc2 Amb25153780 [0,1,0,1,0,0|1,0,0]=3 5294 B14R2.21 O=C1N[C@H](CCN1)c2ccccc2 Amb24441525 [0,1,0,1,0,0|1,0,0]=3 5295 B14R2.21 O=C1N[C@H](CCO1)c2cc[n]cc2 Amb25156414 [0,1,0,1,0,0|2,0,0]=4 5296 B14R2.21 O=C1N[C@H](CCO1)c2ccc[n]c2 Amb25156419 [0,1,0,1,0,0|2,0,0]=4 5297 B14R2.21 O=C1N[C@H](CCO1)c2cccc[n]2 Amb25153779 [0,1,0,1,0,0|2,0,0]=4 5298 B14R2.21 O=C1N[C@H](CCO1)c2ccccc2 Amb24427391 [0,1,0,1,0,0|1,0,0]=3 5299 B14R2.21 O=S1CC(NCC1)c2ccccc2 Amb19374300 [0,1,0,1,0,0|2,0,0]=4 5300 B14R2.21 OC1CCCC(O1)c2ccccc2 Amb25687927 [0,1,0,1,0,0|0,0,2]=4 5301 B14R2.21 OC1CCC[C@H](O1)c2ccccc2 Amb25832744 [0,1,0,1,0,0|0,0,2]=4 5302 B14R2.21 S=C1NCCC(O1)c2ccccc2 Amb25840970 [0,1,0,1,0,0|0,1,0]=3 5303 B14R2.52 CC1=CC(=O)CCc2ccccc21 Amb24492363 [0,1,0,1,0,0|1,0,1]=4 5304 B14R2.52 CN1CC(=O)COc2ccccc12 Amb25056781 [0,1,0,1,0,0|2,0,0]=4 5305 B14R2.52 O=C1CCc2c(C(=O)O1)cccc2 Amb17470546 [0,1,0,1,0,0|1,0,1]=4 5306 B14R2.52 O=C1COc2ccccc2C(Cl)C1 Amb24711287 [0,1,0,1,0,0|2,0,0]=4 5307 B14R2.260 C=C1CC(NC1=O)c2ccccc2 Amb24529607 [0,1,0,1,0,0|1,0,1]=4 5308 B14R2.260 C=C1CC(OC1=O)c2ccccc2 Amb24534660 [0,1,0,1,0,0|0,0,1]=3 5309 B14R2.260 C=C1C[C@@H](NC1=O)c2ccccc2 Amb25857087 [0,1,0,1,0,0|1,0,1]=4 5310 B14R2.260 CC1CC(NC1=O)c2c[n]ccc2 Amb25324477 [0,1,0,1,0,0|2,0,0]=4 5311 B14R2.260 CC1CC(NC1=O)c2ccccc2 Amb25250684 [0,1,0,1,0,0|1,0,0]=3 5312 B14R2.260 CC1CC(OC1O)c2ccccc2 Amb25381394 [0,1,0,1,0,0|0,0,2]=4 5313 B14R2.260 CC1NC(NC1=O)c2ccccc2 Amb24636264 [0,1,0,1,0,0|2,0,0]=4 5314 B14R2.260 CC1OC(NC1=O)c2ccccc2 Amb10562255 [0,1,0,1,0,0|1,0,1]=4 5315 B14R2.260 CC1SC(NC1=O)c2ccccc2 Amb2223062 [0,1,0,1,0,0|2,0,0]=4 5316 B14R2.260 CN1CC(OC1=N)c2ccccc2 Amb25160668 [0,1,0,1,0,0|1,0,0]=3 5317 B14R2.260 CN1C[C@@H](NC1=O)c2ccccc2 Amb25191937 [0,1,0,1,0,0|1,0,0]=3 5318 B14R2.260 CN1C[C@H](NC1=O)c2ccccc2 Amb24418415 [0,1,0,1,0,0|1,0,0]=3 5319 B14R2.260 C[C@@H]1C[C@@H](CC1=O)c2ccccc2 Amb24631132 [0,1,0,1,0,0|1,0,0]=3 5320 B14R2.260 C[C@@H]1NC(OC1=O)c2ccccc2 Amb25238712 [0,1,0,1,0,0|1,0,0]=3 5321 B14R2.260 C[C@@H]1O[C@@H](C[C@H]1O)c2ccccc2 Amb24564416 [0,1,0,1,0,0|0,0,2]=4 5322 B14R2.260 C[C@@H]1O[C@@H](NC1=O)c2ccccc2 Amb24513100 [0,1,0,1,0,0|1,0,1]=4 5323 B14R2.260 Cl[C@@H]1O[C@H](C[C@@H]1Cl)c2ccccc2 Amb24757601 [0,1,0,1,0,0|1,0,1]=4 5324 B14R2.260 NC1CC(NC1=O)c2ccccc2 Amb23590809 [0,1,0,1,0,0|1,0,0]=3 5325 B14R2.260 NC1CC(OC1=O)c2ccccc2 Amb17470561 [0,1,0,1,0,0|0,0,0]=2 5326 B14R2.260 O=C1CC(CC1=O)c2ccccc2 Amb24590974 [0,1,0,1,0,0|1,0,1]=4 5327 B14R2.260 O=C1N[C@H](C[C@@H]1O)c2cccnc2 Amb17615657 [0,1,0,1,0,0|2,0,0]=4 5328 B14R2.260 O=C1OC(CC1=O)c2ccccc2 Amb25718939 [0,1,0,1,0,0|0,0,1]=3 5329 B14R2.260 O=C1OC(CC1Cl)c2ccccc2 Amb24710095 [0,1,0,1,0,0|0,0,0]=2 5330 B14R2.260 O=C1OC(CN1C)c2cccnc2 Amb17233392 [0,1,0,1,0,0|1,0,0]=3 5331 B14R2.260 O=C1O[C@@H](CC1=O)c2ccccc2 Amb25833624 [0,1,0,1,0,0|0,0,1]=3 5332 B14R2.260 OC1=CC(CC1=O)c2ccccc2 Amb24662315 [0,1,0,1,0,0|2,0,0]=4 5333 B14R2.260 OC1=CC(OC1=O)c2ccccc2 Amb23571856 [0,1,0,1,0,0|0,0,2]=4 5334 B14R2.260 OC1CC(=NC1=O)c2ccccc2 Amb25357649 [0,1,0,1,0,0|1,0,1]=4 5335 B14R2.260 OC1CC(NC1=O)c2ccccc2 Amb25325087 [0,1,0,1,0,0|1,0,0]=3 5336 B14R2.260 OC1CC(OC1=O)c2ccccc2 Amb24414844 [0,1,0,1,0,0|0,0,0]=2 5337 B14R2.260 OC1OC(CC1Cl)c2ccccc2 Amb24664084 [0,1,0,1,0,0|0,0,2]=4 5338 B14R2.260 OC1OC(CC1O)c2ccccc2 Amb25846975 [0,1,0,1,0,0|0,0,2]=4 5339 B14R2.260 O[C@@H]1CC(OC1=O)c2ccccc2 Amb25846190 [0,1,0,1,0,0|0,0,0]=2 5340 B14R2.260 O[C@@H]1C[C@H](NC1=O)c2c[n]ccc2 Amb19132678 [0,1,0,1,0,0|2,0,0]=4 5341 B14R2.260 O[C@@H]1C[C@H](OC1=O)c2ccccc2 Amb25176996 [0,1,0,1,0,0|0,0,0]=2 5342 B14R2.260 O[C@@H]1O[C@@H](C[C@H]1Cl)c2ccccc2 Amb24621940 [0,1,0,1,0,0|0,0,2]=4 5343 B14R2.260 O[C@H]1C[C@@H](OC1=O)c2ccccc2 Amb24520002 [0,1,0,1,0,0|0,0,0]=2 5344 B14R2.335 CN(C1CCC1=O)c2ccccc2 Amb25371762 [0,1,0,1,0,0|2,0,0]=4 5345 B14R2.335 O[C@@H]([C@H]1OCC1=O)c2ccccc2 Amb25261807 [0,1,0,1,0,0|2,0,0]=4 5346 B14R2.335 O[C@H]([C@H]1CNC1=O)c2ccccc2 Amb25302360 [0,1,0,1,0,0|2,0,0]=4 5347 B14R2.657 CC1(CC(=O)C1C)c2ccccc2 Amb24667993 [0,1,0,1,0,0|1,0,0]=3 5348 B14R2.657 CC1(NC(=O)C1C)c2ccccc2 Amb24341426 [0,1,0,1,0,0|1,0,0]=3 5349 B14R2.657 CC1(NC(=O)C1O)c2ccccc2 Amb24682163 [0,1,0,1,0,0|1,0,0]=3 5350 B14R2.657 CC1=CC(C)(C1=O)c2ccccc2 Amb25112606 [0,1,0,1,0,0|1,0,0]=3 5351 B14R2.794 CC(C=C1CNC1)c2ccccc2 Amb24738278 [0,1,0,1,0,0|2,0,0]=4 5352 B14R2.794 CC(OC1CNC1)c2ccccc2 Amb25695212 [0,1,0,1,0,0|1,0,1]=4 5353 B14R2.958 C=CC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24633398 [0,1,0,1,0,0|1,0,1]=4 5354 B14R2.958 CCC(=O)C1CC1c2ccccc2 Amb24534293 [0,1,0,1,0,0|1,0,0]=3 5355 B14R2.958 CCC(=O)[C@H]1C[C@H]1c2ccccc2 Amb25322800 [0,1,0,1,0,0|1,0,0]=3 5356 B14R2.958 CCC(=O)[C@H]1O[C@@H]1c2ccccc2 Amb24612438 [0,1,0,1,0,0|2,0,0]=4 5357 B14R2.958 CNC(=O)C1CC1c2cc[n]cc2 Amb25132180 [0,1,0,1,0,0|2,0,0]=4 5358 B14R2.958 CNC(=O)[C@@H]1C[C@@H]1c2cc[n]cc2 Amb24617709 [0,1,0,1,0,0|2,0,0]=4 5359 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccc[n]c2 Amb25355670 [0,1,0,1,0,0|2,0,0]=4 5360 B14R2.958 CNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb25226125 [0,1,0,1,0,0|1,0,0]=3 5361 B14R2.958 CNC(=O)[C@@H]1O[C@H]1c2ccccc2 Amb25317578 [0,1,0,1,0,0|2,0,0]=4 5362 B14R2.958 CNC(=O)[C@H]1C[C@@H]1c2cc[n]cc2 Amb24610051 [0,1,0,1,0,0|2,0,0]=4 5363 B14R2.958 CNC(=O)[C@H]1C[C@@H]1c2ccccc2 Amb24605065 [0,1,0,1,0,0|1,0,0]=3 5364 B14R2.958 CNC(=S)C1CC1c2ccccc2 Amb24428152 [0,1,0,1,0,0|1,1,0]=4 5365 B14R2.958 CNC(=S)[C@H]1C[C@@H]1c2ccccc2 Amb25324077 [0,1,0,1,0,0|1,1,0]=4 5366 B14R2.958 COC(=O)C1CC1c2cc[n]cc2 Amb25355787 [0,1,0,1,0,0|2,0,0]=4 5367 B14R2.958 COC(=O)C1CC1c2ccc[n]c2 Amb25852071 [0,1,0,1,0,0|2,0,0]=4 5368 B14R2.958 COC(=O)N1CC1c2ccccc2 Amb1039317 [0,1,0,1,0,0|1,0,0]=3 5369 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2cccc[n]2 Amb24617301 [0,1,0,1,0,0|2,0,0]=4 5370 B14R2.958 COC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb24526297 [0,1,0,1,0,0|1,0,0]=3 5371 B14R2.958 C\C(=N\N)\[C@@H]1C[C@H]1c2ccccc2 Amb25031668 [0,1,0,1,0,0|2,0,0]=4 5372 B14R2.958 NNC(=O)C1CC1c2ccccc2 Amb1799991 [0,1,0,1,0,0|2,0,0]=4 5373 B14R2.958 NNC(=O)[C@@H]1C[C@H]1c2ccccc2 Amb17939352 [0,1,0,1,0,0|2,0,0]=4 5374 B14R2.958 NNC(=O)[C@H]1C[C@H]1c2ccccc2 Amb24501421 [0,1,0,1,0,0|2,0,0]=4 5375 B14R2.958 O=C(CBr)C1CC1c2ccccc2 Amb25220775 [0,1,0,1,0,0|1,0,0]=3 5376 B14R2.958 ONC(=O)C1CC1c2ccccc2 Amb25332697 [0,1,0,1,0,0|2,0,0]=4 5377 B14R2.1019 CNC=1NC(C)c2ccccc2N1 Amb25765737 [0,1,0,1,0,0|2,0,0]=4 5378 B14R2.1019 CSC=1NC(C)c2ccccc2N1 Amb25742880 [0,1,0,1,0,0|2,0,0]=4 5379 B14R2.1161 C[C@@H]([C@@H]1C[C@H]1C=O)c2ccccc2 Amb25365236 [0,1,0,1,0,0|1,0,1]=4 5380 B14R2.1161 C[C@H]([C@@H]1C[C@H]1C=O)c2ccccc2 Amb24666775 [0,1,0,1,0,0|1,0,1]=4 5381 B14R2.3486 CC1(CC1(C)C=O)c2ccccc2 Amb25373153 [0,1,0,1,0,0|1,0,1]=4 5382 B14R2.7724 CC1=CC(=O)N(C)c2ccccc12 Amb19653965 [0,1,0,1,0,0|1,0,1]=4 5383 B14R2.7724 CC1=CC(O)c2ccccc2C1=O Amb24633554 [0,1,0,1,0,0|2,0,0]=4 5384 B14R2.7724 CC1=CN(C)c2ccccc2C1=O Amb22750754 [0,1,0,1,0,0|2,0,0]=4 5385 B14R2.7724 CC1=NN(C)c2ccccc2C1=O Amb24662434 [0,1,0,1,0,0|2,0,0]=4 5386 B14R2.7724 CC1C(=O)CC(C)c2ccccc21 Amb25718436 [0,1,0,1,0,0|1,0,0]=3 5387 B14R2.7724 CC1CC(=O)N(C)c2ccccc21 Amb18061648 [0,1,0,1,0,0|1,0,0]=3 5388 B14R2.7724 CC1CC(C)c2ccccc2C1=O Amb25271005 [0,1,0,1,0,0|1,0,1]=4 5389 B14R2.7724 CC1SC(C)c2ccccc2C1=O Amb24643632 [0,1,0,1,0,0|0,1,1]=4 5390 B14R2.7724 CC1c2ccccc2C(=O)OC1=O Amb23580671 [0,1,0,1,0,0|1,0,1]=4 5391 B14R2.7724 CN1C(=O)CN(C)c2ccccc12 Amb20462941 [0,1,0,1,0,0|2,0,0]=4 5392 B14R2.7724 CN1c2ccccc2C(=O)OC1=O Amb17933878 [0,1,0,1,0,0|1,0,1]=4 5393 B14R2.7724 C[C@@H]1C[C@@H](C)c2ccccc2C1=O Amb25347549 [0,1,0,1,0,0|1,0,1]=4 5394 B14R2.35816 C=CC(=O)CC1Cc2ccccc21 Amb24685567 [0,1,0,1,0,0|1,0,1]=4 5395 B14R2.35816 CCC(=O)NC1Cc2ccccc21 Amb24404446 [0,1,0,1,0,0|1,0,0]=3 5396 B14R2.35816 CNC(=S)NC1Cc2ccccc21 Amb24529944 [0,1,0,1,0,0|1,1,0]=4 5397 B14R2.35816 COC(=O)NC1Cc2ccccc21 Amb25725896 [0,1,0,1,0,0|1,0,0]=3 5398 B14R2.35816 OCC(=O)NC1Cc2ccccc21 Amb25749238 [0,1,0,1,0,0|1,0,0]=3 5399 B14R2.20 Cc1ccc(c[n]1)C2CCC(=O)C2 Amb24386451 [0,1,0,1,0,0|2,0,0]=4 5400 B14R2.20 Cc1ccc(cc1)C2=CCC(=O)O2 Amb24094628 [0,1,0,1,0,0|0,0,2]=4 5401 B14R2.20 Cc1ccc(cc1)C2CCC(O)O2 Amb24344674 [0,1,0,1,0,0|0,0,2]=4 5402 B14R2.20 Cc1ccc(cc1)C2CNC(=O)N2 Amb24463831 [0,1,0,1,0,0|2,0,0]=4 5403 B14R2.20 Cc1ccc(cc1)C2COC(=O)N2 Amb25082390 [0,1,0,1,0,0|2,0,0]=4 5404 B14R2.20 Cc1ccc(cc1)[C@@H]2CC(=O)CC2 Amb25712929 [0,1,0,1,0,0|1,0,0]=3 5405 B14R2.20 Cc1ccc(cc1)[C@@H]2CCC(=O)N2 Amb25302890 [0,1,0,1,0,0|1,0,0]=3 5406 B14R2.20 Cc1ccc(cc1)[C@@H]2CCC(=O)O2 Amb24607301 [0,1,0,1,0,0|0,0,0]=2 5407 B14R2.20 Cc1ccc(cc1)[C@@H]2CNC(=O)N2 Amb25352370 [0,1,0,1,0,0|2,0,0]=4 5408 B14R2.20 Cc1ccc(cc1)[C@H]2CCC(=O)N2 Amb24360807 [0,1,0,1,0,0|1,0,0]=3 5409 B14R2.20 Cc1ccc(cc1)[C@H]2CNC(=O)C2 Amb24591261 [0,1,0,1,0,0|2,0,0]=4 5410 B14R2.20 Cc1ccc(cc1)[C@H]2CNC(=O)N2 Amb24462995 [0,1,0,1,0,0|2,0,0]=4 5411 B14R2.20 NC1=NCC(O1)c2ccc(Br)cc2 Amb19894994 [0,1,0,1,0,0|2,0,0]=4 5412 B14R2.20 NC1=NCC(O1)c2ccc(cc2)C Amb17617189 [0,1,0,1,0,0|2,0,0]=4 5413 B14R2.20 Nc1ccc([n]c1)C2CC(=O)CC2 Amb24491326 [0,1,0,1,0,0|2,0,0]=4 5414 B14R2.20 Nc1ccc(cc1)C2CC(=O)CC2 Amb24730827 [0,1,0,1,0,0|1,0,0]=3 5415 B14R2.20 Nc1ccc(cc1)C2CCC(=O)N2 Amb23399888 [0,1,0,1,0,0|1,0,0]=3 5416 B14R2.20 Nc1ccc(cc1)C2CNC(=O)O2 Amb18639383 [0,1,0,1,0,0|1,0,0]=3 5417 B14R2.20 Nc1ccc(cc1)N2CCC(=O)N2 Amb24102506 [0,1,0,1,0,0|2,0,0]=4 5418 B14R2.20 Nc1ccc(cc1)[C@H]2CCC(=O)N2 Amb25692493 [0,1,0,1,0,0|1,0,0]=3 5419 B14R2.20 O=C1C=CC(O1)c2ccc(F)cc2 Amb25083419 [0,1,0,1,0,0|0,0,2]=4 5420 B14R2.20 O=C1CC(CC1)C2=CNC(=O)C=C2 Amb24462886 [0,1,0,1,0,0|2,0,0]=4 5421 B14R2.20 O=C1CC(CC1)c2ccc(Br)[n]c2 Amb24384311 [0,1,0,1,0,0|2,0,0]=4 5422 B14R2.20 O=C1CC(CC1)c2ccc(Br)c[n]2 Amb24455581 [0,1,0,1,0,0|2,0,0]=4 5423 B14R2.20 O=C1CC(CC1)c2ccc(Cl)[n]c2 Amb25342256 [0,1,0,1,0,0|2,0,0]=4 5424 B14R2.20 O=C1CC(CC1)c2ccc(Cl)c[n]2 Amb25198715 [0,1,0,1,0,0|2,0,0]=4 5425 B14R2.20 O=C1CC(CC1)c2ccc(F)[n]c2 Amb24690764 [0,1,0,1,0,0|2,0,0]=4 5426 B14R2.20 O=C1CC(CN1)c2ccc(S)cc2 Amb24438360 [0,1,0,1,0,0|2,0,0]=4 5427 B14R2.20 O=C1CC(CO1)c2ccc(Cl)cc2 Amb24097675 [0,1,0,1,0,0|2,0,0]=4 5428 B14R2.20 O=C1CCC(=C1)c2ccc(cc2)Br Amb17158297 [0,1,0,1,0,0|1,0,1]=4 5429 B14R2.20 O=C1CCC(=C1)c2ccc(cc2)C Amb17138689 [0,1,0,1,0,0|1,0,1]=4 5430 B14R2.20 O=C1CCC(=C1)c2ccc(cc2)Cl Amb17139382 [0,1,0,1,0,0|1,0,1]=4 5431 B14R2.20 O=C1CCC(=C1)c2ccc(cc2)F Amb17138772 [0,1,0,1,0,0|1,0,1]=4 5432 B14R2.20 O=C1CCC(C1)c2ccc(cc2)Br Amb17158701 [0,1,0,1,0,0|1,0,0]=3 5433 B14R2.20 O=C1CCC(C1)c2ccc(cc2)C Amb17138725 [0,1,0,1,0,0|1,0,0]=3 5434 B14R2.20 O=C1CCC(C1)c2ccc(cc2)Cl Amb17139525 [0,1,0,1,0,0|1,0,0]=3 5435 B14R2.20 O=C1CCC(C1)c2ccc(cc2)F Amb17138847 [0,1,0,1,0,0|1,0,0]=3 5436 B14R2.20 O=C1CCC(N1)c2ccc(I)cc2 Amb25709111 [0,1,0,1,0,0|1,0,0]=3 5437 B14R2.20 O=C1CCC(N1)c2ccc(cc2)Br Amb17472798 [0,1,0,1,0,0|1,0,0]=3 5438 B14R2.20 O=C1CCC(N1)c2ccc(cc2)C Amb17470517 [0,1,0,1,0,0|1,0,0]=3 5439 B14R2.20 O=C1CCC(N1)c2ccc(cc2)Cl Amb17470923 [0,1,0,1,0,0|1,0,0]=3 5440 B14R2.20 O=C1CCC(N1)c2ccc(cc2)F Amb17470590 [0,1,0,1,0,0|1,0,0]=3 5441 B14R2.20 O=C1CCC(O1)c2ccc(cc2)Br Amb1041779 [0,1,0,1,0,0|0,0,0]=2 5442 B14R2.20 O=C1CC[C@@H](N1)c2ccc(Cl)cc2 Amb25728010 [0,1,0,1,0,0|1,0,0]=3 5443 B14R2.20 O=C1CC[C@@H](N1)c2ccc(S)cc2 Amb24730084 [0,1,0,1,0,0|1,0,0]=3 5444 B14R2.20 O=C1CC[C@@H](O1)c2ccc(Br)cc2 Amb24343932 [0,1,0,1,0,0|0,0,0]=2 5445 B14R2.20 O=C1CC[C@@H](O1)c2ccc(F)cc2 Amb25736757 [0,1,0,1,0,0|0,0,0]=2 5446 B14R2.20 O=C1CC[C@H](N1)c2ccc(S)cc2 Amb24374061 [0,1,0,1,0,0|1,0,0]=3 5447 B14R2.20 O=C1CC[C@H](O1)c2ccc(Cl)cc2 Amb25349456 [0,1,0,1,0,0|0,0,0]=2 5448 B14R2.20 O=C1CNC(N1)c2ccc(F)cc2 Amb24525276 [0,1,0,1,0,0|2,0,0]=4 5449 B14R2.20 O=C1CSC(N1)c2ccc(Br)cc2 Amb23526569 [0,1,0,1,0,0|2,0,0]=4 5450 B14R2.20 O=C1CSC(N1)c2ccc(cc2)C Amb16204944 [0,1,0,1,0,0|2,0,0]=4 5451 B14R2.20 O=C1CSC(N1)c2ccc(cc2)Cl Amb2221754 [0,1,0,1,0,0|2,0,0]=4 5452 B14R2.20 O=C1C[C@@H](CC1)c2ccc(Br)cc2 Amb25848474 [0,1,0,1,0,0|1,0,0]=3 5453 B14R2.20 O=C1C[C@@H](CC1)c2ccc(F)[n]c2 Amb25706952 [0,1,0,1,0,0|2,0,0]=4 5454 B14R2.20 O=C1C[C@@H](CC1)c2ccc(F)cc2 Amb24495011 [0,1,0,1,0,0|1,0,0]=3 5455 B14R2.20 O=C1C[C@@H](CN1)c2ccc(Br)cc2 Amb25693140 [0,1,0,1,0,0|2,0,0]=4 5456 B14R2.20 O=C1C[C@@H](CN1)c2ccc(Cl)cc2 Amb25827568 [0,1,0,1,0,0|2,0,0]=4 5457 B14R2.20 O=C1C[C@@H](CN1)c2ccc(F)cc2 Amb23401453 [0,1,0,1,0,0|2,0,0]=4 5458 B14R2.20 O=C1NC(CO1)c2ccc(Br)cc2 Amb24419169 [0,1,0,1,0,0|2,0,0]=4 5459 B14R2.20 O=C1NCC(C1)c2ccc(cc2)Br Amb13783610 [0,1,0,1,0,0|2,0,0]=4 5460 B14R2.20 O=C1NCC(C1)c2ccc(cc2)C Amb17400498 [0,1,0,1,0,0|2,0,0]=4 5461 B14R2.20 O=C1NCC(O1)c2ccc(cc2)Br Amb17255947 [0,1,0,1,0,0|1,0,0]=3 5462 B14R2.20 O=C1NCC(O1)c2ccc(cc2)C Amb17233255 [0,1,0,1,0,0|1,0,0]=3 5463 B14R2.20 O=C1NCC(O1)c2ccc(cc2)Cl Amb17236665 [0,1,0,1,0,0|1,0,0]=3 5464 B14R2.20 O=C1NCC(O1)c2ccc(cc2)F Amb17233780 [0,1,0,1,0,0|1,0,0]=3 5465 B14R2.20 O=C1NC[C@@H](N1)c2ccc(F)cc2 Amb24702480 [0,1,0,1,0,0|2,0,0]=4 5466 B14R2.20 O=C1NC[C@H](N1)c2ccc(Br)cc2 Amb24534588 [0,1,0,1,0,0|2,0,0]=4 5467 B14R2.20 O=C1NC[C@H](O1)c2ccc(Cl)cc2 Amb25233123 [0,1,0,1,0,0|1,0,0]=3 5468 B14R2.20 O=C1N[C@@H](CO1)c2ccc(I)cc2 Amb25311681 [0,1,0,1,0,0|2,0,0]=4 5469 B14R2.20 O=C1N[C@H](CO1)c2ccc(Br)cc2 Amb25715338 [0,1,0,1,0,0|2,0,0]=4 5470 B14R2.20 O=C1N[C@H](CO1)c2ccc(Cl)cc2 Amb25816140 [0,1,0,1,0,0|2,0,0]=4 5471 B14R2.20 Oc1ccc([n]c1)C2CC(=O)CC2 Amb24736473 [0,1,0,1,0,0|2,0,0]=4 5472 B14R2.20 Oc1ccc(cc1)C2CC(=O)CC2 Amb25129032 [0,1,0,1,0,0|1,0,0]=3 5473 B14R2.20 Oc1ccc(cc1)C2CCC(=O)N2 Amb23412159 [0,1,0,1,0,0|1,0,0]=3 5474 B14R2.20 Oc1ccc(cc1)C2CNC(=O)C2 Amb18127880 [0,1,0,1,0,0|2,0,0]=4 5475 B14R2.20 Oc1ccc(cc1)C2COC(=O)N2 Amb24709902 [0,1,0,1,0,0|2,0,0]=4 5476 B14R2.20 Oc1ccc(cc1)C2NCC(=O)N2 Amb25225852 [0,1,0,1,0,0|2,0,0]=4 5477 B14R2.20 Oc1ccc(cc1)C=2CCC(=O)C2 Amb25373219 [0,1,0,1,0,0|1,0,1]=4 5478 B14R2.20 Oc1ccc(cc1)[C@@H]2CCC(=O)N2 Amb25274859 [0,1,0,1,0,0|1,0,0]=3 5479 B14R2.20 Oc1ccc(cc1)[C@@H]2CNC(=O)N2 Amb25153835 [0,1,0,1,0,0|2,0,0]=4 5480 B14R2.20 Oc1ccc(cc1)[C@@H]2COC(=O)N2 Amb24490125 [0,1,0,1,0,0|2,0,0]=4 5481 B14R2.20 Oc1ccc(cc1)[C@H]2CNC(=O)N2 Amb25153744 [0,1,0,1,0,0|2,0,0]=4 5482 B14R2.4402 CC(=O)C1CC1c2ccc(I)cc2 Amb24444973 [0,1,0,1,0,0|1,0,0]=3 5483 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)Cl Amb2406920 [0,1,0,1,0,0|1,0,0]=3 5484 B14R2.4402 CC(=O)C1CC1c2ccc(cc2)F Amb2415814 [0,1,0,1,0,0|1,0,0]=3 5485 B14R2.4402 CC(=O)C1OC1c2ccc(O)cc2 Amb24370156 [0,1,0,1,0,0|2,0,0]=4 5486 B14R2.4402 CC(C)=C1CC1c2ccc(O)cc2 Amb24102753 [0,1,0,1,0,0|2,0,0]=4 5487 B14R2.4402 Cc1ccc([n]c1)C2CC2C(C)=O Amb25693501 [0,1,0,1,0,0|2,0,0]=4 5488 B14R2.4402 Cc1ccc(c[n]1)C2CC2C(C)=O Amb25763189 [0,1,0,1,0,0|2,0,0]=4 5489 B14R2.4402 Cc1ccc(cc1)C2CC2C(=O)Cl Amb25670775 [0,1,0,1,0,0|2,0,0]=4 5490 B14R2.4402 Cc1ccc(cc1)C2CC2C(N)=O Amb25690823 [0,1,0,1,0,0|2,0,0]=4 5491 B14R2.4402 Cc1ccc(cc1)C2OC2C(C)=O Amb24619633 [0,1,0,1,0,0|2,0,0]=4 5492 B14R2.4402 Cc1ccc(cc1)[C@@H]2C[C@@H]2C(O)=O Amb24512171 [0,1,0,1,0,0|2,0,0]=4 5493 B14R2.4402 Cc1ccc(cc1)[C@H]2C[C@H]2C(N)=O Amb24519396 [0,1,0,1,0,0|2,0,0]=4 5494 B14R2.4402 Cc1ccc(cc1)[C@H]2O[C@@H]2C(C)=O Amb24582585 [0,1,0,1,0,0|2,0,0]=4 5495 B14R2.4402 NC(=O)C1CC1c2ccc(Cl)cc2 Amb25108306 [0,1,0,1,0,0|2,0,0]=4 5496 B14R2.4402 NC(=O)C1CC1c2ccc(F)cc2 Amb21811908 [0,1,0,1,0,0|2,0,0]=4 5497 B14R2.4402 NC(=O)[C@@H]1C[C@@H]1c2ccc(Cl)cc2 Amb25311929 [0,1,0,1,0,0|2,0,0]=4 5498 B14R2.4402 NC(=O)[C@@H]1C[C@@H]1c2ccc(F)cc2 Amb24743435 [0,1,0,1,0,0|2,0,0]=4 5499 B14R2.4402 NC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24650188 [0,1,0,1,0,0|2,0,0]=4 5500 B14R2.4402 Nc1ccc(cc1)[C@@H]2C[C@H]2C(O)=O Amb25799160 [0,1,0,1,0,0|2,0,0]=4 5501 B14R2.4402 Nc1ccc(cc1)[C@H]2C[C@@H]2C(O)=O Amb25176098 [0,1,0,1,0,0|2,0,0]=4 5502 B14R2.4402 O=C(Cl)C1CC1c2ccc(F)cc2 Amb24738452 [0,1,0,1,0,0|2,0,0]=4 5503 B14R2.4402 OC(=O)C1CC1c2ccc(I)cc2 Amb25343384 [0,1,0,1,0,0|2,0,0]=4 5504 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)Cl Amb1935060 [0,1,0,1,0,0|2,0,0]=4 5505 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)F Amb17073012 [0,1,0,1,0,0|2,0,0]=4 5506 B14R2.4402 OC(=O)C1CC1c2ccc(cc2)O Amb17568130 [0,1,0,1,0,0|2,0,0]=4 5507 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Br)cc2 Amb25175756 [0,1,0,1,0,0|2,0,0]=4 5508 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(Cl)cc2 Amb24742590 [0,1,0,1,0,0|2,0,0]=4 5509 B14R2.4402 OC(=O)[C@@H]1C[C@H]1c2ccc(F)cc2 Amb24557857 [0,1,0,1,0,0|2,0,0]=4 5510 B14R2.4402 OC(=O)[C@H]1C[C@@H]1c2ccc(F)cc2 Amb24600834 [0,1,0,1,0,0|2,0,0]=4 5511 B14R2.4402 OC(=O)[C@H]1C[C@H]1c2ccc(Cl)cc2 Amb24739770 [0,1,0,1,0,0|2,0,0]=4 5512 B14R2.4402 Oc1ccc(cc1)[C@H]2C[C@H]2C(O)=O Amb25236047 [0,1,0,1,0,0|2,0,0]=4 5513 B14R2.20678 CC1(CC(=O)N1)c2ccc(Br)cc2 Amb24659399 [0,1,0,1,0,0|1,0,0]=3 5514 B14R2.20678 CC1(CC(=O)N1)c2ccc(F)cc2 Amb25850567 [0,1,0,1,0,0|1,0,0]=3 5515 B14R2.20678 CC1(CC(=O)N1)c2ccc(I)cc2 Amb24613028 [0,1,0,1,0,0|1,0,0]=3 5516 B14R2.20678 Cc1ccc(cc1)C2(C)CC(=O)C2 Amb25053042 [0,1,0,1,0,0|1,0,0]=3 5517 B14R2.20678 Cc1ccc(cc1)C2(C)CC(=O)N2 Amb24402535 [0,1,0,1,0,0|1,0,0]=3 5518 B14R2.29365 CC1CC(=O)Nc2cc(O)ccc21 Amb24424028 [0,1,0,1,0,0|2,0,0]=4 5519 B14R2.29365 CC1CC(=O)Oc2cc(N)ccc21 Amb24424659 [0,1,0,1,0,0|2,0,0]=4 5520 B14R2.29365 CC1CC(=O)Oc2cc(O)ccc21 Amb21949861 [0,1,0,1,0,0|2,0,0]=4 5521 B14R2.29365 CN1CC(=O)Cc2cc(Br)ccc12 Amb18730949 [0,1,0,1,0,0|2,0,0]=4 5522 B14R2.29365 Cc1cc2CC(=O)OC(=O)c2cc1 Amb25270254 [0,1,0,1,0,0|1,0,1]=4 5523 B14R2.29365 O=C1OC(=O)Cc2cc(Br)ccc12 Amb24353739 [0,1,0,1,0,0|1,0,1]=4 5524 B14R2.22 Cc1cc(c[n]c1)C2CCC(=O)C2 Amb25374744 [0,1,0,1,0,0|2,0,0]=4 5525 B14R2.22 Cc1cc(ccc1)C2C=CC(=O)O2 Amb25705340 [0,1,0,1,0,0|0,0,2]=4 5526 B14R2.22 Cc1cc(ccc1)C2CN=C(N)O2 Amb25774642 [0,1,0,1,0,0|2,0,0]=4 5527 B14R2.22 Cc1cc(ccc1)C2CNC(=O)N2 Amb25191596 [0,1,0,1,0,0|2,0,0]=4 5528 B14R2.22 Cc1cc(ccc1)C2NCC(=O)N2 Amb25032967 [0,1,0,1,0,0|2,0,0]=4 5529 B14R2.22 Cc1cc(ccc1)[C@@H]2CCC(=O)N2 Amb24740618 [0,1,0,1,0,0|1,0,0]=3 5530 B14R2.22 Cc1cc(ccc1)[C@@H]2CNC(=O)N2 Amb25153942 [0,1,0,1,0,0|2,0,0]=4 5531 B14R2.22 Cc1cc(ccc1)[C@H]2CCC(=O)N2 Amb24360806 [0,1,0,1,0,0|1,0,0]=3 5532 B14R2.22 Cc1cc(ccc1)[C@H]2COC(=O)N2 Amb24472273 [0,1,0,1,0,0|2,0,0]=4 5533 B14R2.22 Cc1cccc(c1)N2CCC(=O)N2 Amb17940640 [0,1,0,1,0,0|2,0,0]=4 5534 B14R2.22 NC1=NCC(O1)c2cccc(O)c2 Amb24429107 [0,1,0,1,0,0|2,0,0]=4 5535 B14R2.22 Nc1cc(c[n]c1)C2CCC(=O)C2 Amb24453905 [0,1,0,1,0,0|2,0,0]=4 5536 B14R2.22 Nc1cc(cc[n]1)C2CCC(=O)C2 Amb25342442 [0,1,0,1,0,0|2,0,0]=4 5537 B14R2.22 Nc1cc(ccc1)C2CNC(=O)C2 Amb19894999 [0,1,0,1,0,0|2,0,0]=4 5538 B14R2.22 Nc1cc(ccc1)C2CNC(=O)C2 Amb20668391 [0,1,0,1,0,0|2,0,0]=4 5539 B14R2.22 Nc1cc(ccc1)C2CNC(=O)O2 Amb18120405 [0,1,0,1,0,0|1,0,0]=3 5540 B14R2.22 Nc1cc(ccc1)[C@H]2CCC(=O)N2 Amb24730083 [0,1,0,1,0,0|1,0,0]=3 5541 B14R2.22 Nc1cccc([n]1)C2CC(=O)CC2 Amb25341239 [0,1,0,1,0,0|2,0,0]=4 5542 B14R2.22 O=C1C=CC(O1)c2cccc(F)c2 Amb25045472 [0,1,0,1,0,0|0,0,2]=4 5543 B14R2.22 O=C1CC(CC1)c2c[n]cc(Br)c2 Amb25140036 [0,1,0,1,0,0|2,0,0]=4 5544 B14R2.22 O=C1CC(CC1)c2cc(Cl)cc[n]2 Amb25251227 [0,1,0,1,0,0|2,0,0]=4 5545 B14R2.22 O=C1CC(CC1)c2cc[n]c(Cl)c2 Amb25850014 [0,1,0,1,0,0|2,0,0]=4 5546 B14R2.22 O=C1CC(CC1)c2cccc(Cl)[n]2 Amb25859096 [0,1,0,1,0,0|2,0,0]=4 5547 B14R2.22 O=C1CC(CC1)c2cccc(F)[n]2 Amb24491959 [0,1,0,1,0,0|2,0,0]=4 5548 B14R2.22 O=C1CC(CC1)c2cccc(F)c2 Amb18065747 [0,1,0,1,0,0|1,0,0]=3 5549 B14R2.22 O=C1CCC(=C1)c2cc(F)ccc2 Amb18065607 [0,1,0,1,0,0|1,0,1]=4 5550 B14R2.22 O=C1CCC(=C1)c2cccc(c2)Br Amb17158296 [0,1,0,1,0,0|1,0,1]=4 5551 B14R2.22 O=C1CCC(=C1)c2cccc(c2)C Amb17138688 [0,1,0,1,0,0|1,0,1]=4 5552 B14R2.22 O=C1CCC(=C1)c2cccc(c2)Cl Amb17139381 [0,1,0,1,0,0|1,0,1]=4 5553 B14R2.22 O=C1CCC(C1)c2cccc(c2)Br Amb17158700 [0,1,0,1,0,0|1,0,0]=3 5554 B14R2.22 O=C1CCC(C1)c2cccc(c2)C Amb17138724 [0,1,0,1,0,0|1,0,0]=3 5555 B14R2.22 O=C1CCC(C1)c2cccc(c2)Cl Amb17139524 [0,1,0,1,0,0|1,0,0]=3 5556 B14R2.22 O=C1CCC(N1)c2ccc[n+](c2)[O-] Amb17618672 [0,1,0,1,0,0|2,0,0]=4 5557 B14R2.22 O=C1CCC(N1)c2cccc(Br)c2 Amb23399886 [0,1,0,1,0,0|1,0,0]=3 5558 B14R2.22 O=C1CCC(O1)c2cccc(Cl)c2 Amb25076781 [0,1,0,1,0,0|0,0,0]=2 5559 B14R2.22 O=C1CCN(N1)c2cccc(c2)Cl Amb1790797 [0,1,0,1,0,0|2,0,0]=4 5560 B14R2.22 O=C1CC[C@@H](N1)c2cccc(Br)c2 Amb24627938 [0,1,0,1,0,0|1,0,0]=3 5561 B14R2.22 O=C1CC[C@@H](O1)c2cccc(Br)c2 Amb24392298 [0,1,0,1,0,0|0,0,0]=2 5562 B14R2.22 O=C1CC[C@@H](O1)c2cccc(Cl)c2 Amb25829476 [0,1,0,1,0,0|0,0,0]=2 5563 B14R2.22 O=C1CC[C@@H](O1)c2cccc(F)c2 Amb25187896 [0,1,0,1,0,0|0,0,0]=2 5564 B14R2.22 O=C1CC[C@H](N1)c2cccc(Br)c2 Amb25076485 [0,1,0,1,0,0|1,0,0]=3 5565 B14R2.22 O=C1CC[C@H](O1)c2cccc(Br)c2 Amb25201651 [0,1,0,1,0,0|0,0,0]=2 5566 B14R2.22 O=C1CC[C@H](O1)c2cccc(F)c2 Amb25117495 [0,1,0,1,0,0|0,0,0]=2 5567 B14R2.22 O=C1CNC(N1)c2cc(Cl)ccc2 Amb25333381 [0,1,0,1,0,0|2,0,0]=4 5568 B14R2.22 O=C1CSC(N1)c2cccc(c2)Br Amb1819276 [0,1,0,1,0,0|2,0,0]=4 5569 B14R2.22 O=C1C[C@@H](CN1)c2cccc(Br)c2 Amb24494891 [0,1,0,1,0,0|2,0,0]=4 5570 B14R2.22 O=C1C[C@@H](CN1)c2cccc(Cl)c2 Amb24492046 [0,1,0,1,0,0|2,0,0]=4 5571 B14R2.22 O=C1C[C@@H](CN1)c2cccc(F)c2 Amb24494663 [0,1,0,1,0,0|2,0,0]=4 5572 B14R2.22 O=C1C[C@H](CN1)c2cccc(Cl)c2 Amb24682410 [0,1,0,1,0,0|2,0,0]=4 5573 B14R2.22 O=C1C[C@H](CN1)c2cccc(F)c2 Amb25330728 [0,1,0,1,0,0|2,0,0]=4 5574 B14R2.22 O=C1NC(CO1)c2cccc(F)c2 Amb25316630 [0,1,0,1,0,0|2,0,0]=4 5575 B14R2.22 O=C1NC(CO1)c2cccc(I)c2 Amb25100583 [0,1,0,1,0,0|2,0,0]=4 5576 B14R2.22 O=C1NCC(C1)c2cccc(c2)Br Amb17410186 [0,1,0,1,0,0|2,0,0]=4 5577 B14R2.22 O=C1NCC(C1)c2cccc(c2)C Amb17400497 [0,1,0,1,0,0|2,0,0]=4 5578 B14R2.22 O=C1NCC(O1)c2cccc(F)c2 Amb25725655 [0,1,0,1,0,0|1,0,0]=3 5579 B14R2.22 O=C1NCC(O1)c2cccc(c2)Br Amb17255946 [0,1,0,1,0,0|1,0,0]=3 5580 B14R2.22 O=C1NCC(O1)c2cccc(c2)C Amb17233254 [0,1,0,1,0,0|1,0,0]=3 5581 B14R2.22 O=C1NCC(O1)c2cccc(c2)Cl Amb17236664 [0,1,0,1,0,0|1,0,0]=3 5582 B14R2.22 O=C1NC[C@@H](N1)c2cc(Br)ccc2 Amb25156465 [0,1,0,1,0,0|2,0,0]=4 5583 B14R2.22 O=C1NC[C@@H](N1)c2cc(F)ccc2 Amb25156409 [0,1,0,1,0,0|2,0,0]=4 5584 B14R2.22 O=C1NC[C@H](N1)c2cc(Cl)ccc2 Amb24447723 [0,1,0,1,0,0|2,0,0]=4 5585 B14R2.22 O=C1NC[C@H](N1)c2cc(F)ccc2 Amb24385190 [0,1,0,1,0,0|2,0,0]=4 5586 B14R2.22 O=C1N[C@@H](CO1)c2cccc(Br)c2 Amb24513687 [0,1,0,1,0,0|2,0,0]=4 5587 B14R2.22 O=C1N[C@@H](CO1)c2cccc(F)c2 Amb25153939 [0,1,0,1,0,0|2,0,0]=4 5588 B14R2.22 O=C1N[C@H](CO1)c2cccc(Br)c2 Amb24730803 [0,1,0,1,0,0|2,0,0]=4 5589 B14R2.22 OC1CCC(O1)c2cc(Cl)ccc2 Amb25846198 [0,1,0,1,0,0|0,0,2]=4 5590 B14R2.22 Oc1cc(cc[n]1)C2CCC(=O)C2 Amb25244095 [0,1,0,1,0,0|2,0,0]=4 5591 B14R2.22 Oc1cc(ccc1)C2CCC(=O)N2 Amb22295872 [0,1,0,1,0,0|1,0,0]=3 5592 B14R2.22 Oc1cc(ccc1)C2CCC(=O)O2 Amb25724360 [0,1,0,1,0,0|0,0,0]=2 5593 B14R2.22 Oc1cc(ccc1)C2COC(=O)N2 Amb25283568 [0,1,0,1,0,0|2,0,0]=4 5594 B14R2.22 Oc1cc(ccc1)[C@H]2CCC(=O)O2 Amb25667716 [0,1,0,1,0,0|0,0,0]=2 5595 B14R2.22 Oc1cc(ccc1)[C@H]2COC(=O)N2 Amb24462997 [0,1,0,1,0,0|2,0,0]=4 5596 B14R2.4476 CC(=O)C1CC1c2cc(Br)c[n]c2 Amb24351846 [0,1,0,1,0,0|2,0,0]=4 5597 B14R2.4476 Cc1cc(ccc1)C2CC2C(N)=O Amb24490097 [0,1,0,1,0,0|2,0,0]=4 5598 B14R2.4476 Cc1cc(ccc1)[C@H]2C[C@@H]2C(N)=O Amb24648756 [0,1,0,1,0,0|2,0,0]=4 5599 B14R2.4476 Cc1cc(ccc1)[C@H]2C[C@@H]2C(O)=O Amb24567212 [0,1,0,1,0,0|2,0,0]=4 5600 B14R2.4476 Cc1cccc(c1)[C@@H]2C[C@H]2C(C)=O Amb25262717 [0,1,0,1,0,0|1,0,0]=3 5601 B14R2.4476 NC(=O)C1CC1c2cc(Cl)ccc2 Amb25738001 [0,1,0,1,0,0|2,0,0]=4 5602 B14R2.4476 NC(=O)C1CC1c2cc(F)ccc2 Amb24677885 [0,1,0,1,0,0|2,0,0]=4 5603 B14R2.4476 NC(=O)C1CC1c2cccc(c2)Br Amb13322380 [0,1,0,1,0,0|2,0,0]=4 5604 B14R2.4476 Nc1cc(ccc1)C2CC2C(O)=O Amb25238282 [0,1,0,1,0,0|2,0,0]=4 5605 B14R2.4476 OC(=O)C1CC1c2cccc(c2)O Amb17568185 [0,1,0,1,0,0|2,0,0]=4 5606 B14R2.4476 OC(=O)[C@@H]1CC1c2cc(Br)ccc2 Amb24058242 [0,1,0,1,0,0|2,0,0]=4 5607 B14R2.4476 OC(=O)[C@@H]1C[C@H]1c2cc(F)ccc2 Amb25322492 [0,1,0,1,0,0|2,0,0]=4 5608 B14R2.4476 OC(=O)[C@H]1C[C@@H]1c2cc(Cl)ccc2 Amb25322133 [0,1,0,1,0,0|2,0,0]=4 5609 B14R2.4476 Oc1cccc(c1)[C@H]2C[C@@H]2C(O)=O Amb24738654 [0,1,0,1,0,0|2,0,0]=4 5610 B14R2.8045 CC1NC(=O)Cc2c(O)cccc21 Amb18127883 [0,1,0,1,0,0|1,0,0]=3 5611 B14R2.8045 O=C1OC(=O)Cc2c(Br)cccc12 Amb24490937 [0,1,0,1,0,0|1,0,1]=4 5612 B14R2.8045 O=C1OC(=O)c2c(C1)c(C)ccc2 Amb17470545 [0,1,0,1,0,0|1,0,1]=4 5613 B14R2.8045 O=C1OC(=O)c2c(C1)c(Cl)ccc2 Amb17470944 [0,1,0,1,0,0|1,0,1]=4 5614 B14R2.8045 O=C1OC(=O)c2c(C1)c(F)ccc2 Amb17470618 [0,1,0,1,0,0|1,0,1]=4 5615 B14R2.8235 CC1CC(=O)Cc2ccc(Cl)cc21 Amb25715387 [0,1,0,1,0,0|1,0,0]=3 5616 B14R2.8235 CC1CC(=O)Cc2ccc(O)cc21 Amb24551479 [0,1,0,1,0,0|1,0,0]=3 5617 B14R2.8235 CC1CC(=O)Nc2ccc(Br)cc21 Amb18559266 [0,1,0,1,0,0|2,0,0]=4 5618 B14R2.8235 CC1CC(=O)Nc2ccc(C)cc12 Amb17836213 [0,1,0,1,0,0|2,0,0]=4 5619 B14R2.8235 CC1CC(=O)Nc2ccc(Cl)cc21 Amb25087879 [0,1,0,1,0,0|2,0,0]=4 5620 B14R2.8235 CC1CC(=O)Nc2ccc(N)cc21 Amb18559264 [0,1,0,1,0,0|2,0,0]=4 5621 B14R2.8235 CC1NC(=O)Cc2ccc(O)cc21 Amb18127882 [0,1,0,1,0,0|1,0,0]=3 5622 B14R2.8235 CC1OC(C)Oc2ccc(O)cc21 Amb25034485 [0,1,0,1,0,0|0,0,2]=4 5623 B14R2.8235 CC=1NC(C)c2cc(Cl)ccc2N1 Amb25093821 [0,1,0,1,0,0|2,0,0]=4 5624 B14R2.8235 C[C@@H]1O[C@@H](C)Oc2ccc(O)cc21 Amb24662490 [0,1,0,1,0,0|0,0,2]=4 5625 B14R2.8235 O=C1OC(=O)c2c(C1)ccc(c2)C Amb17470544 [0,1,0,1,0,0|1,0,1]=4 5626 B14R2.8235 O=C1OC(=O)c2c(C1)ccc(c2)Cl Amb17470943 [0,1,0,1,0,0|1,0,1]=4 5627 B14R2.8235 O=C1OC(=O)c2c(C1)ccc(c2)F Amb17470617 [0,1,0,1,0,0|1,0,1]=4 5628 B14R2.8235 Oc1cc2c(CC(=O)OC2=O)cc1 Amb24676761 [0,1,0,1,0,0|1,0,1]=4 5629 B14R2.20875 CC1(CC(=O)N1)c2c[n]cc(F)c2 Amb24362058 [0,1,0,1,0,0|2,0,0]=4 5630 B14R2.20875 CC1(CC(=O)N1)c2cccc(Br)c2 Amb24702200 [0,1,0,1,0,0|1,0,0]=3 5631 B14R2.450 CC(=C)C1Nc2ccccc2C1C Amb24756845 [0,1,0,1,0,0|2,0,0]=4 5632 B14R2.450 CC(=O)C1Oc2ccccc2C1O Amb25767041 [0,1,0,1,0,0|2,0,0]=4 5633 B14R2.450 CC(=O)c1[nH]c2c(c1C)cccc2 Amb1810670 [0,1,0,1,0,0|1,0,1]=4 5634 B14R2.450 CC(=O)c1cc2c(n1C)cccc2 Amb10808756 [0,1,0,1,0,0|2,0,0]=4 5635 B14R2.450 CC(=O)c1nc2c(n1C)cccc2 Amb1655600 [0,1,0,1,0,0|2,0,0]=4 5636 B14R2.450 CC(=O)c1sc2c(c1C)cccc2 Amb1663934 [0,1,0,1,0,0|1,0,1]=4 5637 B14R2.450 CC1C(Cc2ccccc21)C(N)=O Amb24452453 [0,1,0,1,0,0|2,0,0]=4 5638 B14R2.450 CC1C(Cc2ccccc21)C(O)=O Amb18127727 [0,1,0,1,0,0|2,0,0]=4 5639 B14R2.450 CC1C(Sc2ccccc21)C(O)=O Amb25331829 [0,1,0,1,0,0|2,0,0]=4 5640 B14R2.450 CC1c2ccccc2CN1C(N)=O Amb24363238 [0,1,0,1,0,0|2,0,0]=4 5641 B14R2.450 C[C@@H]1[C@H](Cc2ccccc21)C(O)=O Amb24655063 [0,1,0,1,0,0|2,0,0]=4 5642 B14R2.450 C[C@H]1C(Cc2ccccc21)C(N)=O Amb24417733 [0,1,0,1,0,0|2,0,0]=4 5643 B14R2.450 C[C@H]1[C@@H](Cc2ccccc21)C(N)=O Amb24601809 [0,1,0,1,0,0|2,0,0]=4 5644 B14R2.780 CC(=O)C1CCC1c2ccccc2 Amb24548830 [0,1,0,1,0,0|1,0,0]=3 5645 B14R2.780 CC(=O)N1CCC1c2ccccc2 Amb24352925 [0,1,0,1,0,0|1,0,0]=3 5646 B14R2.780 CC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24724006 [0,1,0,1,0,0|1,0,0]=3 5647 B14R2.780 OC(=O)C1CSC1c2ccccc2 Amb24624933 [0,1,0,1,0,0|2,0,0]=4 5648 B14R2.780 OC(=O)[C@@H]1CC[C@@H]1c2ccccc2 Amb24550645 [0,1,0,1,0,0|2,0,0]=4 5649 B14R2.780 OC(=O)[C@@H]1CC[C@H]1c2ccccc2 Amb24622779 [0,1,0,1,0,0|2,0,0]=4 5650 B14R2.780 OC(=O)[C@@H]1NC[C@H]1c2ccccc2 Amb24552426 [0,1,0,1,0,0|2,0,0]=4 5651 B14R2.780 OC(=O)[C@H]1NC[C@@H]1c2ccccc2 Amb24550614 [0,1,0,1,0,0|2,0,0]=4 5652 B14R2.786 CC(=O)C1(C)CC1c2ccccc2 Amb25231294 [0,1,0,1,0,0|1,0,0]=3 5653 B14R2.786 CC(=O)[C@]1(C)C[C@@H]1c2ccccc2 Amb24617250 [0,1,0,1,0,0|1,0,0]=3 5654 B14R2.786 CC1(C[C@@H]1c2ccccc2)C(O)=O Amb25684837 [0,1,0,1,0,0|2,0,0]=4 5655 B14R2.786 C[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb24552946 [0,1,0,1,0,0|2,0,0]=4 5656 B14R2.786 C[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb25179070 [0,1,0,1,0,0|2,0,0]=4 5657 B14R2.786 C[C@]1(C[C@H]1c2ccccc2)C(N)=O Amb24512281 [0,1,0,1,0,0|2,0,0]=4 5658 B14R2.786 C[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb25022674 [0,1,0,1,0,0|2,0,0]=4 5659 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb19374730 [0,1,0,1,0,0|2,0,0]=4 5660 B14R2.786 NC1(CC1c2ccccc2)C(O)=O Amb22546302 [0,1,0,1,0,0|2,0,0]=4 5661 B14R2.786 N[C@@]1(C[C@@H]1c2ccccc2)C(O)=O Amb25359928 [0,1,0,1,0,0|2,0,0]=4 5662 B14R2.786 N[C@@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519858 [0,1,0,1,0,0|2,0,0]=4 5663 B14R2.786 N[C@]1(C[C@H]1c2ccccc2)C(O)=O Amb24519225 [0,1,0,1,0,0|2,0,0]=4 5664 B14R2.786 OC(=O)C1(C)CC1c2ccccc2 Amb17335110 [0,1,0,1,0,0|2,0,0]=4 5665 B14R2.786 OC(=O)[C@@]1(F)C[C@@H]1c2ccccc2 Amb24538836 [0,1,0,1,0,0|2,0,0]=4 5666 B14R2.4514 C=C1C(COC1=O)c2ccccc2 Amb24417074 [0,1,0,1,0,0|2,0,0]=4 5667 B14R2.4514 CC1C(CCC1=O)c2ccccc2 Amb24051457 [0,1,0,1,0,0|1,0,0]=3 5668 B14R2.4514 CC1C(CNC1=O)c2ccccc2 Amb24312552 [0,1,0,1,0,0|2,0,0]=4 5669 B14R2.4514 CC1C(OCC1=O)c2ccccc2 Amb25370856 [0,1,0,1,0,0|2,0,0]=4 5670 B14R2.4514 CC=1C(=O)CCC1c2ccccc2 Amb24408335 [0,1,0,1,0,0|1,0,1]=4 5671 B14R2.4514 CN1C(CCC1=O)c2cccc[n]2 Amb22054764 [0,1,0,1,0,0|2,0,0]=4 5672 B14R2.4514 CN1C(CCC1=O)c2cccc[n]2 Amb24064826 [0,1,0,1,0,0|2,0,0]=4 5673 B14R2.4514 CN1C(CNC1=O)c2ccccc2 Amb25218843 [0,1,0,1,0,0|2,0,0]=4 5674 B14R2.4514 CN1C(COC1=O)c2ccccc2 Amb25191541 [0,1,0,1,0,0|2,0,0]=4 5675 B14R2.4514 CN1[C@@H](NCC1=O)c2ccccc2 Amb25232599 [0,1,0,1,0,0|2,0,0]=4 5676 B14R2.4514 CN1[C@H](COC1=O)c2ccccc2 Amb24362005 [0,1,0,1,0,0|2,0,0]=4 5677 B14R2.4514 C[C@H]1[C@@H](CCC1=O)c2ccccc2 Amb25327910 [0,1,0,1,0,0|1,0,0]=3 5678 B14R2.4514 C[C@H]1[C@@H](OCC1=O)c2ccccc2 Amb24512682 [0,1,0,1,0,0|2,0,0]=4 5679 B14R2.4514 O=C1CCC(C1Cl)c2ccccc2 Amb25300341 [0,1,0,1,0,0|1,0,0]=3 5680 B14R2.4514 O=C1CCC(N1C)c2ccccn2 Amb10069450 [0,1,0,1,0,0|2,0,0]=4 5681 B14R2.4514 O=C1CCC(N1C)c2cccnc2 Amb10845303 [0,1,0,1,0,0|2,0,0]=4 5682 B14R2.4514 O=C1CCN(c2ccccc2)C1=O Amb18795566 [0,1,0,1,0,0|2,0,0]=4 5683 B14R2.4514 O=C1CC[C@@H](N1C)c2cccnc2 Amb10071651 [0,1,0,1,0,0|2,0,0]=4 5684 B14R2.4514 OC1C(CNC1=O)c2ccccc2 Amb24490122 [0,1,0,1,0,0|2,0,0]=4 5685 B14R2.4514 OC=1C(=O)CCC1c2ccccc2 Amb25754959 [0,1,0,1,0,0|1,0,1]=4 5686 B14R2.8188 CC1C(C)c2ccccc2NC1=O Amb25131133 [0,1,0,1,0,0|2,0,0]=4 5687 B14R2.8188 CN1c2ccccc2CC(=O)C1=O Amb24492727 [0,1,0,1,0,0|2,0,0]=4 5688 B14R2.8188 C[C@@H]1[C@@H](C)c2ccccc2NC1=O Amb24661172 [0,1,0,1,0,0|2,0,0]=4 5689 B14R2.8188 C[C@@H]1[C@H](N)C(=O)Nc2ccccc21 Amb24649017 [0,1,0,1,0,0|2,0,0]=4 5690 B14R2.45467 CC(=C)C(N)C1Cc2ccccc21 Amb25679342 [0,1,0,1,0,0|2,0,0]=4 5691 B14R2.2 CC(=C)CC1NCc2ccccc21 Amb24689726 [0,1,0,1,0,0|2,0,0]=4 5692 B14R2.2 CC(=O)CC1CNc2ccccc21 Amb25155675 [0,1,0,1,0,0|1,0,0]=3 5693 B14R2.2 CC(=O)C[C@H]1CCc2ccccc21 Amb24495028 [0,1,0,1,0,0|1,0,0]=3 5694 B14R2.2 CC(=O)NC1=CCc2ccccc12 Amb22270448 [0,1,0,1,0,0|1,0,1]=4 5695 B14R2.2 CC(=O)NC1COc2ccccc21 Amb25369926 [0,1,0,1,0,0|1,0,0]=3 5696 B14R2.2 CC(=O)NN1CCc2ccccc12 Amb21951336 [0,1,0,1,0,0|2,0,0]=4 5697 B14R2.2 CC(=O)N[C@H]1CCc2ccc[n]c21 Amb24343851 [0,1,0,1,0,0|2,0,0]=4 5698 B14R2.2 CC(=O)OC1CCc2ccc[n]c21 Amb22497182 [0,1,0,1,0,0|1,0,0]=3 5699 B14R2.2 CC(=O)OC1CCc2ccccc21 Amb24323359 [0,1,0,1,0,0|0,0,0]=2 5700 B14R2.2 CC(=O)OC1COc2cc[n]cc21 Amb24400622 [0,1,0,1,0,0|1,0,0]=3 5701 B14R2.2 CC(=O)OC1COc2ccccc21 Amb24393757 [0,1,0,1,0,0|0,0,0]=2 5702 B14R2.2 CC(=O)O[n]1ccc2ccccc12 Amb25760121 [0,1,0,1,0,0|1,0,1]=4 5703 B14R2.2 CC(=O)Oc1[n][nH]c2ccccc21 Amb25850315 [0,1,0,1,0,0|1,0,1]=4 5704 B14R2.2 CC(=O)Oc1c[nH]c2c1cccc2 Amb1229160 [0,1,0,1,0,0|0,0,2]=4 5705 B14R2.2 CC(=O)Oc1c[s]c2ccccc21 Amb24066373 [0,1,0,1,0,0|0,0,2]=4 5706 B14R2.2 CC(=O)\C=C\1/CCc2ccccc12 Amb25116540 [0,1,0,1,0,0|1,0,1]=4 5707 B14R2.2 CC(=O)\C=C\1/OCc2ccccc12 Amb19651458 [0,1,0,1,0,0|1,0,1]=4 5708 B14R2.2 NC(=O)CC1CCc2c1cccc2 Amb17233113 [0,1,0,1,0,0|2,0,0]=4 5709 B14R2.2 NC(=O)CC1CNc2ccccc21 Amb22371342 [0,1,0,1,0,0|2,0,0]=4 5710 B14R2.2 NC(=O)CC1SCc2ccccc21 Amb24489016 [0,1,0,1,0,0|2,0,0]=4 5711 B14R2.2 NC(=O)NC1COc2ccccc21 Amb24455414 [0,1,0,1,0,0|2,0,0]=4 5712 B14R2.2 OC(=O)CC1CNc2ccccc21 Amb19429209 [0,1,0,1,0,0|2,0,0]=4 5713 B14R2.2 OC(=O)CC1NCc2ccccc21 Amb18196180 [0,1,0,1,0,0|2,0,0]=4 5714 B14R2.2 OC(=O)CC1OCc2ccccc21 Amb18195570 [0,1,0,1,0,0|2,0,0]=4 5715 B14R2.2 OC(=O)C[C@H]1CCc2ccccc21 Amb25337786 [0,1,0,1,0,0|2,0,0]=4 5716 B14R2.256 Cc1[n]cccc1C2CC(=O)CC2 Amb25091094 [0,1,0,1,0,0|2,0,0]=4 5717 B14R2.256 Cc1c[n]ccc1C2CC(=O)CC2 Amb24378212 [0,1,0,1,0,0|2,0,0]=4 5718 B14R2.256 Cc1cc[n]cc1C2CC(=O)CC2 Amb25293574 [0,1,0,1,0,0|2,0,0]=4 5719 B14R2.256 Cc1ccccc1C2C=CC(=O)O2 Amb25702048 [0,1,0,1,0,0|0,0,2]=4 5720 B14R2.256 Cc1ccccc1C2CCC(=O)N2 Amb24753232 [0,1,0,1,0,0|1,0,0]=3 5721 B14R2.256 Cc1ccccc1[C@@H]2CC(=O)CC2 Amb25116484 [0,1,0,1,0,0|1,0,0]=3 5722 B14R2.256 Cc1ccccc1[C@@H]2CNC(=O)N2 Amb24471629 [0,1,0,1,0,0|2,0,0]=4 5723 B14R2.256 Cc1ccccc1[C@@H]2COC(=O)N2 Amb25153778 [0,1,0,1,0,0|2,0,0]=4 5724 B14R2.256 Cc1ccccc1[C@H]2CC(=O)CC2 Amb24492532 [0,1,0,1,0,0|1,0,0]=3 5725 B14R2.256 Cc1ccccc1[C@H]2CCC(=O)O2 Amb25299215 [0,1,0,1,0,0|0,0,0]=2 5726 B14R2.256 Cc1ccccc1[C@H]2COC(=O)N2 Amb25341207 [0,1,0,1,0,0|2,0,0]=4 5727 B14R2.256 NC1=NCC(O1)c2ccccc2Cl Amb25780023 [0,1,0,1,0,0|2,0,0]=4 5728 B14R2.256 NC1=NCC(O1)c2ccccc2F Amb25821951 [0,1,0,1,0,0|2,0,0]=4 5729 B14R2.256 Nc1ccc[n]c1C2CC(=O)CC2 Amb24494871 [0,1,0,1,0,0|2,0,0]=4 5730 B14R2.256 Nc1ccccc1C2=NCC(=O)O2 Amb24344180 [0,1,0,1,0,0|1,0,1]=4 5731 B14R2.256 Nc1ccccc1C2CCC(=O)N2 Amb25839783 [0,1,0,1,0,0|1,0,0]=3 5732 B14R2.256 Nc1ccccc1C2COC(=O)N2 Amb24679539 [0,1,0,1,0,0|2,0,0]=4 5733 B14R2.256 O=C1CC(CC1)c2[n]cccc2Br Amb25255997 [0,1,0,1,0,0|2,0,0]=4 5734 B14R2.256 O=C1CC(CC1)c2cc[n]cc2Br Amb24491960 [0,1,0,1,0,0|2,0,0]=4 5735 B14R2.256 O=C1CC(CC1)c2cc[n]cc2Cl Amb24658646 [0,1,0,1,0,0|2,0,0]=4 5736 B14R2.256 O=C1CC(CC1)c2cc[n]cc2F Amb25325884 [0,1,0,1,0,0|2,0,0]=4 5737 B14R2.256 O=C1CC(CC1)c2ccc[n]c2Cl Amb24368710 [0,1,0,1,0,0|2,0,0]=4 5738 B14R2.256 O=C1CC(CC1)c2ccccc2Br Amb18071277 [0,1,0,1,0,0|1,0,0]=3 5739 B14R2.256 O=C1CC(CC1)c2ccccc2I Amb25225737 [0,1,0,1,0,0|1,0,0]=3 5740 B14R2.256 O=C1CCC(=C1)c2ccccc2Br Amb18071045 [0,1,0,1,0,0|1,0,1]=4 5741 B14R2.256 O=C1CCC(=C1)c2ccccc2C Amb17138687 [0,1,0,1,0,0|1,0,1]=4 5742 B14R2.256 O=C1CCC(=C1)c2ccccc2Cl Amb17139380 [0,1,0,1,0,0|1,0,1]=4 5743 B14R2.256 O=C1CCC(=C1)c2ccccc2F Amb17138771 [0,1,0,1,0,0|1,0,1]=4 5744 B14R2.256 O=C1CCC(C1)c2ccccc2C Amb17138723 [0,1,0,1,0,0|1,0,0]=3 5745 B14R2.256 O=C1CCC(C1)c2ccccc2Cl Amb17139523 [0,1,0,1,0,0|1,0,0]=3 5746 B14R2.256 O=C1CCC(C1)c2ccccc2F Amb17138846 [0,1,0,1,0,0|1,0,0]=3 5747 B14R2.256 O=C1CCC(N1)c2ccccc2Br Amb23399885 [0,1,0,1,0,0|1,0,0]=3 5748 B14R2.256 O=C1CCC(O1)c2ccccc2Cl Amb25114151 [0,1,0,1,0,0|0,0,0]=2 5749 B14R2.256 O=C1CCN(N1)c2ccccc2Br Amb1779601 [0,1,0,1,0,0|2,0,0]=4 5750 B14R2.256 O=C1CCN(N1)c2ccccc2Cl Amb1798485 [0,1,0,1,0,0|2,0,0]=4 5751 B14R2.256 O=C1CC[C@@H](N1)c2ccccc2F Amb25133136 [0,1,0,1,0,0|1,0,0]=3 5752 B14R2.256 O=C1CC[C@@H](N1)c2ccccc2I Amb24375696 [0,1,0,1,0,0|1,0,0]=3 5753 B14R2.256 O=C1CC[C@@H](N1)c2ccccc2S Amb25190015 [0,1,0,1,0,0|1,0,0]=3 5754 B14R2.256 O=C1CC[C@@H](O1)c2ccccc2Cl Amb25831173 [0,1,0,1,0,0|0,0,0]=2 5755 B14R2.256 O=C1CC[C@H](N1)c2ccccc2Br Amb25730658 [0,1,0,1,0,0|1,0,0]=3 5756 B14R2.256 O=C1CC[C@H](O1)c2ccccc2I Amb24400408 [0,1,0,1,0,0|0,0,0]=2 5757 B14R2.256 O=C1CNC(N1)c2ccccc2I Amb24473454 [0,1,0,1,0,0|2,0,0]=4 5758 B14R2.256 O=C1CSC(N1)c2ccccc2Cl Amb2221758 [0,1,0,1,0,0|2,0,0]=4 5759 B14R2.256 O=C1C[C@@H](CN1)c2ccccc2F Amb25682493 [0,1,0,1,0,0|2,0,0]=4 5760 B14R2.256 O=C1NC(CO1)c2ccccc2Br Amb25061795 [0,1,0,1,0,0|2,0,0]=4 5761 B14R2.256 O=C1NC(CO1)c2ccccc2Cl Amb24714277 [0,1,0,1,0,0|2,0,0]=4 5762 B14R2.256 O=C1NC(CO1)c2ccccc2F Amb24642133 [0,1,0,1,0,0|2,0,0]=4 5763 B14R2.256 O=C1NCC(C1)c2ccccc2C Amb13952157 [0,1,0,1,0,0|2,0,0]=4 5764 B14R2.256 O=C1NCC(N1)c2ccccc2Br Amb25697820 [0,1,0,1,0,0|2,0,0]=4 5765 B14R2.256 O=C1NCC(N1)c2ccccc2Cl Amb25700117 [0,1,0,1,0,0|2,0,0]=4 5766 B14R2.256 O=C1NCC(N1)c2ccccc2F Amb24402152 [0,1,0,1,0,0|2,0,0]=4 5767 B14R2.256 O=C1NCC(N1)c2ccccc2I Amb24721517 [0,1,0,1,0,0|2,0,0]=4 5768 B14R2.256 O=C1NCC(O1)c2ccccc2C Amb17233253 [0,1,0,1,0,0|1,0,0]=3 5769 B14R2.256 O=C1NCC(O1)c2ccccc2Cl Amb17236663 [0,1,0,1,0,0|1,0,0]=3 5770 B14R2.256 O=C1NCC(O1)c2ccccc2F Amb17233779 [0,1,0,1,0,0|1,0,0]=3 5771 B14R2.256 O=C1NC[C@@H](N1)c2ccccc2Cl Amb24698141 [0,1,0,1,0,0|2,0,0]=4 5772 B14R2.256 O=C1NC[C@@H](N1)c2ccccc2F Amb25260788 [0,1,0,1,0,0|2,0,0]=4 5773 B14R2.256 O=C1NC[C@H](N1)c2ccccc2Br Amb25783144 [0,1,0,1,0,0|2,0,0]=4 5774 B14R2.256 O=C1NC[C@H](N1)c2ccccc2Cl Amb24701384 [0,1,0,1,0,0|2,0,0]=4 5775 B14R2.256 O=C1N[C@@H](CO1)c2ccccc2Br Amb24447521 [0,1,0,1,0,0|2,0,0]=4 5776 B14R2.256 O=C1N[C@@H](CO1)c2ccccc2Cl Amb25328280 [0,1,0,1,0,0|2,0,0]=4 5777 B14R2.256 O=C1N[C@H](CO1)c2ccccc2Br Amb25050168 [0,1,0,1,0,0|2,0,0]=4 5778 B14R2.256 O=C1N[C@H](CO1)c2ccccc2F Amb25085105 [0,1,0,1,0,0|2,0,0]=4 5779 B14R2.256 Oc1ccccc1C2CC(=O)CC2 Amb25710427 [0,1,0,1,0,0|1,0,0]=3 5780 B14R2.256 Oc1ccccc1C2CCC(=O)N2 Amb18127874 [0,1,0,1,0,0|1,0,0]=3 5781 B14R2.256 Oc1ccccc1C2CCC(=O)O2 Amb24534534 [0,1,0,1,0,0|0,0,0]=2 5782 B14R2.256 Oc1ccccc1C2CCC(O)O2 Amb24456694 [0,1,0,1,0,0|0,0,2]=4 5783 B14R2.256 Oc1ccccc1N2CCC(=O)N2 Amb24492507 [0,1,0,1,0,0|2,0,0]=4 5784 B14R2.5443 CC(=O)[C@H]1C[C@@H]1c2ccccc2F Amb24617571 [0,1,0,1,0,0|1,0,0]=3 5785 B14R2.5443 Cc1c[n]ccc1C2CC2C(C)=O Amb24735937 [0,1,0,1,0,0|2,0,0]=4 5786 B14R2.5443 Cc1cc[n]cc1C2CC2C(C)=O Amb24444026 [0,1,0,1,0,0|2,0,0]=4 5787 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(C)=O Amb24761426 [0,1,0,1,0,0|1,0,0]=3 5788 B14R2.5443 Cc1ccccc1[C@H]2C[C@@H]2C(O)=O Amb25367196 [0,1,0,1,0,0|2,0,0]=4 5789 B14R2.5443 NC(=O)C1CC1c2ccccc2Br Amb25854838 [0,1,0,1,0,0|2,0,0]=4 5790 B14R2.5443 NC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24519397 [0,1,0,1,0,0|2,0,0]=4 5791 B14R2.5443 OC(=O)C1CC1c2ccccc2Cl Amb17073010 [0,1,0,1,0,0|2,0,0]=4 5792 B14R2.5443 OC(=O)C1CC1c2ccccc2F Amb17073011 [0,1,0,1,0,0|2,0,0]=4 5793 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2C Amb16233255 [0,1,0,1,0,0|2,0,0]=4 5794 B14R2.5443 OC(=O)[C@@H]1C[C@H]1c2ccccc2Cl Amb24571313 [0,1,0,1,0,0|2,0,0]=4 5795 B14R2.5443 Oc1ccccc1C2CC2C(O)=O Amb24455728 [0,1,0,1,0,0|2,0,0]=4 5796 B14R2.8052 C[C@@H]1OC(C)(C)c2cccc(N)c21 Amb25312168 [0,1,0,1,0,0|1,0,1]=4 5797 B14R2.23821 CC1(CC(=O)C1)c2ccccc2O Amb25713560 [0,1,0,1,0,0|1,0,0]=3 5798 B14R2.23821 CC1(CC(=O)N1)c2ccccc2Br Amb25050001 [0,1,0,1,0,0|1,0,0]=3 5799 B14R2.23821 CC1(CC(=O)N1)c2ccccc2Cl Amb25190041 [0,1,0,1,0,0|1,0,0]=3 5800 B14R2.23821 Cc1ccccc1C2(C)CC(=O)N2 Amb24454147 [0,1,0,1,0,0|1,0,0]=3 5801 B14R2.28480 CC1Cc2cccc(O)c2C(C)O1 Amb24379019 [0,1,0,1,0,0|1,0,1]=4 5802 B14R2.28480 C[C@H]1Cc2cccc(O)c2[C@@H](C)O1 Amb24744761 [0,1,0,1,0,0|1,0,1]=4 5803 B14R2.28480 Oc1cccc2CC(=O)OC(=O)c21 Amb24118046 [0,1,0,1,0,0|1,0,1]=4 5804 B14R2.1014 CC(=O)OC1(CC1)c2ccccc2 Amb24673541 [0,1,0,1,0,0|0,0,0]=2 5805 B14R2.1014 NC(=O)NC1(CC1)c2ccccc2 Amb25722888 [0,1,0,1,0,0|2,0,0]=4 5806 B14R2.1014 O=C(Cl)CC1(CC1)c2ccccc2 Amb25249769 [0,1,0,1,0,0|2,0,0]=4 5807 B14R2.1014 OC(=O)CC1(CC1)c2ccccc2 Amb17233182 [0,1,0,1,0,0|2,0,0]=4 5808 B14R2.55357 CC1(C)OC(C)(C)c2ccccc12 Amb22547238 [0,1,0,1,0,0|1,0,1]=4 5809 B14R2.1146 CCC1NC(=O)Cc2ccccc21 Amb24341183 [0,1,0,1,0,0|1,0,0]=3 5810 B14R2.1146 CCC1NC(=O)Oc2ccccc21 Amb25123913 [0,1,0,1,0,0|2,0,0]=4 5811 B14R2.1146 CCC1OC(=S)Nc2ccccc21 Amb25046206 [0,1,0,1,0,0|1,1,0]=4 5812 B14R2.1146 CCC1OC(N)=Nc2ccccc21 Amb24358774 [0,1,0,1,0,0|2,0,0]=4 5813 B14R2.1146 NCC1CC(=O)Nc2c1cccc2 Amb17470548 [0,1,0,1,0,0|2,0,0]=4 5814 B14R2.1146 OCC1CC(=O)Nc2c1cccc2 Amb17138809 [0,1,0,1,0,0|2,0,0]=4 5815 B14R2.1146 OCC1OC(=O)Nc2ccccc21 Amb25757992 [0,1,0,1,0,0|1,0,0]=3 5816 B14R2.3449 N#CC1(CC(=O)C1)c2ccccc2 Amb20623087 [0,1,0,1,0,0|1,0,1]=4 5817 B14R2.3449 N#CC1(CC(=O)N1)c2ccccc2 Amb24490264 [0,1,0,1,0,0|1,0,1]=4 5818 B14R2.3449 NCC1(CC(=O)C1)c2ccccc2 Amb19374360 [0,1,0,1,0,0|1,0,0]=3 5819 B14R2.3499 CC1(C)OC1(OC)c2ccccc2 Amb25071461 [0,1,0,1,0,0|1,0,1]=4 5820 B14R2.45179 CC1(C)OC(CO)c2ccccc12 Amb25077986 [0,1,0,1,0,0|1,0,1]=4 5821 B14R3.358 O=C1CCC2C1c3ccccc32 Amb25319986 [0,0,0,2,0,0|1,0,0]=3 5822 B14R3.608 CC1=CC2CC1c3ccccc32 Amb22356900 [0,0,0,2,0,0|2,0,0]=4 5823 B14R3.608 O=C1CC2CC1c3cc[n]cc32 Amb24537936 [0,0,0,2,0,0|2,0,0]=4 5824 B14R3.608 O=C1CC2CC1c3ccccc32 Amb22356924 [0,0,0,2,0,0|1,0,0]=3 5825 B14R3.608 O=C1CC2OC1c3ccccc32 Amb24388623 [0,0,0,2,0,0|2,0,0]=4 5826 B14R3.608 O=C1C[C@@H]2C[C@H]1c3cc[n]cc32 Amb24629734 [0,0,0,2,0,0|2,0,0]=4 5827 B10R0.75 CC=CC=CC=C(C)C(C)=O Amb24706923 [0,0,1,0,1,0|0,0,2]=4 5828 B10R1.11 CC(CC=O)c1c[s]cc1 Amb18644679 [1,0,0,0,1,0|2,0,0]=4 5829 B10R1.11 CC(CC=O)c1ccc[s]1 Amb18644676 [1,0,0,0,1,0|2,0,0]=4 5830 B10R1.11 CC(NC=O)c1ccco1 Amb24462226 [1,0,0,0,1,0|2,0,0]=4 5831 B10R1.11 C[C@@H](CC=O)c1c[s]cc1 Amb24633645 [1,0,0,0,1,0|2,0,0]=4 5832 B10R1.11 C[C@H](NC=O)c1ccc[s]1 Amb24363901 [1,0,0,0,1,0|2,0,0]=4 5833 B10R1.11 C[C@H](NC=O)c1ccco1 Amb24630915 [1,0,0,0,1,0|2,0,0]=4 5834 B10R1.11 O=CCC(c1ccco1)C Amb17593491 [1,0,0,0,1,0|2,0,0]=4 5835 B10R1.18 CC(=C)Nc1ccccc1 Amb25269461 [1,0,0,0,1,0|2,0,0]=4 5836 B10R1.18 CC(=C)Oc1cccc[n]1 Amb24101320 [1,0,0,0,1,0|2,0,0]=4 5837 B10R1.18 CC(=N)Cc1cccc[n]1 Amb25315666 [1,0,0,0,1,0|2,0,0]=4 5838 B10R1.18 CC(=N)Nc1ccccc1 Amb1086198 [1,0,0,0,1,0|2,0,0]=4 5839 B10R1.18 CC(=O)CN1C=COC=C1 Amb25100926 [1,0,0,0,1,0|2,0,0]=4 5840 B10R1.18 CC(=O)C[n+]1ccccc1 Amb1102043 [1,0,0,0,1,0|1,0,0]=3 5841 B10R1.18 CC(=O)Cc1[n]ccc[n]1 Amb21864927 [1,0,0,0,1,0|2,0,0]=4 5842 B10R1.18 CC(=O)Cc1c[n]c[n]c1 Amb25328576 [1,0,0,0,1,0|2,0,0]=4 5843 B10R1.18 CC(=O)Cc1cc[n][n]c1 Amb22008576 [1,0,0,0,1,0|2,0,0]=4 5844 B10R1.18 CC(=O)Cc1ccc[n]c1 Amb22587708 [1,0,0,0,1,0|1,0,0]=3 5845 B10R1.18 CC(=O)Cc1ccccn1 Amb1995147 [1,0,0,0,1,0|1,0,0]=3 5846 B10R1.18 CC(=O)Cc1cccnc1 Amb10608569 [1,0,0,0,1,0|1,0,0]=3 5847 B10R1.18 CC(=O)Cc1ccncc1 Amb17935754 [1,0,0,0,1,0|1,0,0]=3 5848 B10R1.18 CC(=O)Cc1cnccn1 Amb1995176 [1,0,0,0,1,0|2,0,0]=4 5849 B10R1.18 CC(=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb17607311 [1,0,0,0,1,0|1,0,0]=3 5850 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552800 [1,0,0,0,1,0|2,0,0]=4 5851 B10R1.18 CC(=O)N[n+]1ccccc1 Amb10552804 [1,0,0,0,1,0|2,0,0]=4 5852 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb22451374 [1,0,0,0,1,0|2,0,0]=4 5853 B10R1.18 CC(=O)Nc1cc[n]cc1 Amb24086636 [1,0,0,0,1,0|2,0,0]=4 5854 B10R1.18 CC(=O)Oc1cc[n]c[n]1 Amb25357546 [1,0,0,0,1,0|2,0,0]=4 5855 B10R1.18 CC(=O)Oc1cc[n]cc1 Amb22522585 [1,0,0,0,1,0|1,0,0]=3 5856 B10R1.18 CC(=O)Oc1ccccc1 Amb22367025 [1,0,0,0,1,0|0,0,0]=2 5857 B10R1.18 CC(=O)Oc1ccccn1 Amb17619694 [1,0,0,0,1,0|1,0,0]=3 5858 B10R1.18 CC(=O)Sc1ccccc1 Amb10575810 [1,0,0,0,1,0|0,1,0]=3 5859 B10R1.18 CC(=O)[15NH]c1ccccc1 Amb22338649 [1,0,0,0,1,0|1,0,0]=3 5860 B10R1.18 CC(=O)\C=C\1/C=CC=CS1 Amb24610243 [1,0,0,0,1,0|1,0,1]=4 5861 B10R1.18 CC(Cc1ccccc1)N Amb17608372 [1,0,0,0,1,0|1,0,1]=4 5862 B10R1.18 CC(Cl)Cc1ccccc1 Amb18787554 [1,0,0,0,1,0|1,0,1]=4 5863 B10R1.18 CC(Cl)Oc1ccccc1 Amb17689404 [1,0,0,0,1,0|1,0,1]=4 5864 B10R1.18 CC(I)Cc1ccccc1 Amb24616287 [1,0,0,0,1,0|1,0,1]=4 5865 B10R1.18 CC(N)=Pc1ccccc1 Amb25351589 [1,0,0,0,1,0|2,0,0]=4 5866 B10R1.18 CC(N)Cc1ccccc1 Amb22346639 [1,0,0,0,1,0|1,0,1]=4 5867 B10R1.18 CC(N)Cc1ccccc1 Amb22352196 [1,0,0,0,1,0|1,0,1]=4 5868 B10R1.18 CC(N)Oc1ccccc1 Amb25830517 [1,0,0,0,1,0|1,0,1]=4 5869 B10R1.18 CC(S)Cc1ccccc1 Amb18177239 [1,0,0,0,1,0|0,1,1]=4 5870 B10R1.18 CN(C)Cc1ccccc1 Amb22359464 [1,0,0,0,1,0|2,0,0]=4 5871 B10R1.18 CS(=O)Cc1ccccc1 Amb10565296 [1,0,0,0,1,0|1,0,0]=3 5872 B10R1.18 C[13C](=O)N[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22367563 [1,0,0,0,1,0|1,0,0]=3 5873 B10R1.18 C[C@@H](Cc1ccccc1)O Amb10068519 [1,0,0,0,1,0|0,0,2]=4 5874 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb19130510 [1,0,0,0,1,0|1,0,1]=4 5875 B10R1.18 C[C@@H](N)Cc1ccccc1 Amb22745694 [1,0,0,0,1,0|1,0,1]=4 5876 B10R1.18 C[C@@H](O)Cc1ccccc1 Amb17938083 [1,0,0,0,1,0|0,0,2]=4 5877 B10R1.18 C[C@H](Cc1ccccc1)N Amb17608368 [1,0,0,0,1,0|1,0,1]=4 5878 B10R1.18 C[SiH](C)Cc1ccccc1 Amb19893554 [1,0,0,0,1,0|1,1,0]=4 5879 B10R1.18 C[Si](C)Cc1ccccc1 Amb24527863 [1,0,0,0,1,0|1,1,0]=4 5880 B10R1.18 C\C(\O)=C/c1ccccc1 Amb24095309 [1,0,0,0,1,0|0,0,2]=4 5881 B10R1.18 NC(=N)Oc1ccccc1 Amb24432258 [1,0,0,0,1,0|2,0,0]=4 5882 B10R1.18 NC(=O)Cc1ccc[n]c1 Amb21856113 [1,0,0,0,1,0|2,0,0]=4 5883 B10R1.18 NC(=O)Cc1ccccc1 Amb1224937 [1,0,0,0,1,0|1,0,0]=3 5884 B10R1.18 NC(=O)Nc1ccccc1 Amb2373965 [1,0,0,0,1,0|2,0,0]=4 5885 B10R1.18 NC(=O)Oc1cccc[n]1 Amb25772133 [1,0,0,0,1,0|2,0,0]=4 5886 B10R1.18 NC(=S)Cc1ccccc1 Amb1646714 [1,0,0,0,1,0|1,1,0]=4 5887 B10R1.18 O=C(Br)Oc1ccccc1 Amb25174288 [1,0,0,0,1,0|1,0,0]=3 5888 B10R1.18 O=C(Cl)Cc1cc[n]cc1 Amb24446208 [1,0,0,0,1,0|2,0,0]=4 5889 B10R1.18 O=C(Cl)Cc1ccc[n]c1 Amb24605722 [1,0,0,0,1,0|2,0,0]=4 5890 B10R1.18 O=C(Cl)Nc1ccccc1 Amb24425698 [1,0,0,0,1,0|2,0,0]=4 5891 B10R1.18 O=C(F)Nc1ccccc1 Amb22731751 [1,0,0,0,1,0|2,0,0]=4 5892 B10R1.18 OC(=O)C[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22353637 [1,0,0,0,1,0|1,0,0]=3 5893 B10R1.18 OC(=O)C[N]1=CC=CC=C1 Amb17836439 [1,0,0,0,1,0|2,0,0]=4 5894 B10R1.18 OC(=O)C[n+]1ccccc1 Amb10552774 [1,0,0,0,1,0|2,0,0]=4 5895 B10R1.18 OC(=O)C[n+]1ccccc1 Amb23468426 [1,0,0,0,1,0|2,0,0]=4 5896 B10R1.18 OC(=O)Cc1cc[nH+]cc1 Amb24113836 [1,0,0,0,1,0|2,0,0]=4 5897 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb10807486 [1,0,0,0,1,0|2,0,0]=4 5898 B10R1.18 OC(=O)Cc1cccc[nH+]1 Amb24113838 [1,0,0,0,1,0|2,0,0]=4 5899 B10R1.18 OC(=O)[13CH2]c1ccccc1 Amb22351854 [1,0,0,0,1,0|1,0,0]=3 5900 B10R1.18 OC(=S)Cc1ccccc1 Amb22262974 [1,0,0,0,1,0|1,0,1]=4 5901 B10R1.18 OP(=O)Cc1ccccc1 Amb24617740 [1,0,0,0,1,0|2,0,0]=4 5902 B10R1.18 OP(=O)Oc1ccccc1 Amb24520486 [1,0,0,0,1,0|2,0,0]=4 5903 B10R1.18 O[13C](=O)Cc1ccccc1 Amb22363120 [1,0,0,0,1,0|1,0,0]=3 5904 B10R1.18 O[13C](=O)[13CH2]c1ccccc1 Amb22351754 [1,0,0,0,1,0|1,0,0]=3 5905 B10R1.18 O[14C](=O)Cc1ccccc1 Amb22337596 [1,0,0,0,1,0|1,0,0]=3 5906 B10R1.18 SC(=O)Cc1ccccc1 Amb10561701 [1,0,0,0,1,0|1,0,0]=3 5907 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552724 [1,0,0,0,1,0|2,0,0]=4 5908 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10552757 [1,0,0,0,1,0|2,0,0]=4 5909 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb10573238 [1,0,0,0,1,0|2,0,0]=4 5910 B10R1.18 [O-]C(=O)C[n+]1ccccc1 Amb22345878 [1,0,0,0,1,0|2,0,0]=4 5911 B10R1.18 [O-]C(=O)Cc1ccc[n]c1 Amb21618883 [1,0,0,0,1,0|2,0,0]=4 5912 B10R1.18 [O-]C(=O)Cc1cccc[n]1 Amb22000882 [1,0,0,0,1,0|2,0,0]=4 5913 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20240609 [1,0,0,0,1,0|1,0,0]=3 5914 B10R1.18 [O-]C(=O)Cc1ccccc1 Amb20246797 [1,0,0,0,1,0|1,0,0]=3 5915 B10R1.18 [O-][N+](=O)Cc1ccccc1 Amb10606416 [1,0,0,0,1,0|2,0,0]=4 5916 B10R1.66 CC(=O)CC[n]1cccc1 Amb25138234 [1,0,0,0,1,0|2,0,0]=4 5917 B10R1.66 CC(=O)CCc1cc[nH]c1 Amb18223260 [1,0,0,0,1,0|2,0,0]=4 5918 B10R1.66 CC(=O)CCc1ccc[nH]1 Amb24505108 [1,0,0,0,1,0|2,0,0]=4 5919 B10R1.66 CC(=O)CCc1ccco1 Amb1107538 [1,0,0,0,1,0|2,0,0]=4 5920 B10R1.66 CC(=O)NCc1ccco1 Amb1209246 [1,0,0,0,1,0|2,0,0]=4 5921 B10R1.66 CC(=O)NCc1cccs1 Amb1218150 [1,0,0,0,1,0|2,0,0]=4 5922 B10R1.66 CC(=O)NCc1cscc1 Amb10945323 [1,0,0,0,1,0|2,0,0]=4 5923 B10R1.66 CC(=O)OCc1c[nH]c[n]1 Amb20248319 [1,0,0,0,1,0|2,0,0]=4 5924 B10R1.66 CC(=O)OCc1c[n]c[s]1 Amb25279956 [1,0,0,0,1,0|2,0,0]=4 5925 B10R1.66 CC(=O)OCc1cc[n]o1 Amb25840725 [1,0,0,0,1,0|2,0,0]=4 5926 B10R1.66 CC(=O)OCc1cc[s]c1 Amb25369522 [1,0,0,0,1,0|1,0,0]=3 5927 B10R1.66 CC(=O)OCc1ccc[nH]1 Amb24478971 [1,0,0,0,1,0|1,0,0]=3 5928 B10R1.66 CC(=O)OCc1ccc[s]1 Amb25077698 [1,0,0,0,1,0|1,0,0]=3 5929 B10R1.66 CC(=O)OCc1cco[n]1 Amb24482875 [1,0,0,0,1,0|2,0,0]=4 5930 B10R1.66 CC(=S)OCc1ccco1 Amb10807433 [1,0,0,0,1,0|1,1,0]=4 5931 B10R1.23 CC(=O)C(C)c1cc[nH][n]1 Amb18832198 [0,0,0,0,2,0|2,0,0]=4 5932 B10R1.23 CC(=O)C(C)c1coc[n]1 Amb18832113 [0,0,0,0,2,0|2,0,0]=4 5933 B10R1.23 CC(=O)C(N)c1cc[nH]c1 Amb25042145 [0,0,0,0,2,0|2,0,0]=4 5934 B10R1.23 CC(=O)C(N)c1ccc[s]1 Amb25836886 [0,0,0,0,2,0|2,0,0]=4 5935 B10R1.23 CC(=O)C(O)c1cc[s]c1 Amb25146543 [0,0,0,0,2,0|2,0,0]=4 5936 B10R1.23 CC(=O)C(O)c1ccc[nH]1 Amb24465067 [0,0,0,0,2,0|2,0,0]=4 5937 B10R1.23 CC(=O)C(O)c1ccc[s]1 Amb25146757 [0,0,0,0,2,0|2,0,0]=4 5938 B10R1.23 CC(=O)C(c1cccs1)Cl Amb17477839 [0,0,0,0,2,0|2,0,0]=4 5939 B10R1.23 CC(=O)[C@@H](O)c1ccoc1 Amb24709030 [0,0,0,0,2,0|2,0,0]=4 5940 B10R1.23 CC(=O)[C@H](O)c1cc[s]c1 Amb25028160 [0,0,0,0,2,0|2,0,0]=4 5941 B10R1.23 CC(=O)[C@H](O)c1ccc[s]1 Amb25146548 [0,0,0,0,2,0|2,0,0]=4 5942 B10R1.23 CC(C(=O)Cl)c1ccc[s]1 Amb24638423 [0,0,0,0,2,0|2,0,0]=4 5943 B10R1.23 CC(C(N)=O)c1ccco1 Amb25106547 [0,0,0,0,2,0|2,0,0]=4 5944 B10R1.23 CC(C(O)=O)C=1CC=CC1 Amb24480439 [0,0,0,0,2,0|1,0,1]=4 5945 B10R1.23 CC(C(O)=O)c1cc[nH]c1 Amb18064932 [0,0,0,0,2,0|2,0,0]=4 5946 B10R1.23 CC(C(O)=O)c1cc[s]c1 Amb18284449 [0,0,0,0,2,0|2,0,0]=4 5947 B10R1.23 CC(C(O)=O)c1ccc[nH]1 Amb18643379 [0,0,0,0,2,0|2,0,0]=4 5948 B10R1.23 CC(n1cccc1)C(=O)O Amb1058873 [0,0,0,0,2,0|2,0,0]=4 5949 B10R1.23 C[C@H](C(O)=O)c1ccc[s]1 Amb24710020 [0,0,0,0,2,0|2,0,0]=4 5950 B10R1.23 C[C@H](n1cccc1)C(=O)O Amb2236277 [0,0,0,0,2,0|2,0,0]=4 5951 B10R1.23 OC(=O)C(c1ccco1)C Amb17087431 [0,0,0,0,2,0|2,0,0]=4 5952 B10R1.23 OC(=O)C(c1cccs1)C Amb10844027 [0,0,0,0,2,0|2,0,0]=4 5953 B10R1.23 OC(=O)[C@@H](c1cccs1)C Amb10844019 [0,0,0,0,2,0|2,0,0]=4 5954 B10R1.23 OC(=O)[C@@H](c1cscc1)C Amb10844020 [0,0,0,0,2,0|2,0,0]=4 5955 B10R1.23 OC(=O)[C@H](c1cscc1)C Amb10844030 [0,0,0,0,2,0|2,0,0]=4 5956 B12R1.32 CC#CC(C)Nc1ccccc1 Amb25040061 [1,0,0,0,0,1|1,0,1]=4 5957 B12R1.32 CC#C[C@@H](C)Oc1ccccc1 Amb24068913 [1,0,0,0,0,1|1,0,1]=4 5958 B12R1.32 CC(Cc1ccccc1)N=C=O Amb17103991 [1,0,0,0,0,1|1,0,1]=4 5959 B12R1.32 CC(Cc1ccccc1)NC=S Amb24635878 [1,0,0,0,0,1|1,1,0]=4 5960 B12R1.32 CCCC(C)Cc1ccccc1 Amb22224920 [1,0,0,0,0,1|1,0,1]=4 5961 B12R1.32 CCNC(C)Cc1ccccc1 Amb18552940 [1,0,0,0,0,1|1,0,1]=4 5962 B12R1.32 CCNC(C)Cc1ccccc1 Amb22055190 [1,0,0,0,0,1|1,0,1]=4 5963 B12R1.32 CCO/C(C)=N/c1ccccc1 Amb17939699 [1,0,0,0,0,1|0,0,2]=4 5964 B12R1.32 CCSC(C)Nc1ccccc1 Amb24585828 [1,0,0,0,0,1|0,1,1]=4 5965 B12R1.32 CN(CC=O)Cc1ccccc1 Amb18800711 [1,0,0,0,0,1|2,0,0]=4 5966 B12R1.32 CNCC(C)Oc1ccccc1 Amb19025044 [1,0,0,0,0,1|2,0,0]=4 5967 B12R1.32 COCC(C)Nc1ccccc1 Amb19024307 [1,0,0,0,0,1|2,0,0]=4 5968 B12R1.32 CSCC(C)Nc1ccccc1 Amb25674366 [1,0,0,0,0,1|2,0,0]=4 5969 B12R1.32 C[C@@H](Cc1ccccc1)NC=O Amb24637855 [1,0,0,0,0,1|1,0,0]=3 5970 B12R1.32 C\C(=C/C=O)\Nc1ccccc1 Amb18645507 [1,0,0,0,0,1|1,0,1]=4 5971 B12R1.32 C\C(=C/C=O)\Oc1ccccc1 Amb25326052 [1,0,0,0,0,1|1,0,1]=4 5972 B12R1.32 C\C(=C/C=O)\Sc1ccccc1 Amb18648150 [1,0,0,0,0,1|1,0,1]=4 5973 B12R1.32 C\C(=C\C=O)\Nc1ccccc1 Amb24611198 [1,0,0,0,0,1|1,0,1]=4 5974 B12R1.32 C\C(\CC=O)=C/c1ccccc1 Amb18126261 [1,0,0,0,0,1|1,0,1]=4 5975 B12R1.32 C\C(\Cc1ccccc1)=C/C=O Amb18645380 [1,0,0,0,0,1|1,0,1]=4 5976 B12R1.32 C\C=C\C(N)Cc1ccccc1 Amb25142747 [1,0,0,0,0,1|2,0,0]=4 5977 B12R1.32 C\C=C\[C@@H](O)Cc1ccccc1 Amb25741490 [1,0,0,0,0,1|2,0,0]=4 5978 B12R1.32 C\C=C\[C@H](O)Cc1ccccc1 Amb24353018 [1,0,0,0,0,1|2,0,0]=4 5979 B12R1.1564 CC(N=C=O)C=1CC=CC=CC1 Amb25690250 [1,0,0,0,0,1|1,0,1]=4 5980 B12R1.252 C=C(Br)COCc1ccccc1 Amb25305709 [1,0,0,0,0,1|1,0,1]=4 5981 B12R1.252 CC(=C)CCNc1ccccc1 Amb25771824 [1,0,0,0,0,1|2,0,0]=4 5982 B12R1.252 CC(=C)CNCc1ccccc1 Amb10608684 [1,0,0,0,0,1|2,0,0]=4 5983 B12R1.252 CC(=C)CNCc1ccccc1 Amb17622487 [1,0,0,0,0,1|2,0,0]=4 5984 B12R1.252 CC(=N)NCCc1ccccc1 Amb25148437 [1,0,0,0,0,1|2,0,0]=4 5985 B12R1.252 CC(=O)C#CSc1ccccc1 Amb25767013 [1,0,0,0,0,1|1,0,1]=4 5986 B12R1.252 CC(=O)CCCc1cccc[n]1 Amb22284162 [1,0,0,0,0,1|2,0,0]=4 5987 B12R1.252 CC(=O)CCCc1ccccn1 Amb1102603 [1,0,0,0,0,1|2,0,0]=4 5988 B12R1.252 CC(=O)CCCc1cccnc1 Amb17232426 [1,0,0,0,0,1|2,0,0]=4 5989 B12R1.252 CC(=O)C\C=C\c1ccccc1 Amb24740083 [1,0,0,0,0,1|1,0,1]=4 5990 B12R1.252 CC(=O)C\C=N\c1ccccc1 Amb25205414 [1,0,0,0,0,1|1,0,1]=4 5991 B12R1.252 CC(=O)NCCc1cccc[n]1 Amb22751848 [1,0,0,0,0,1|2,0,0]=4 5992 B12R1.252 CC(=O)NCCc1ccncc1 Amb1066478 [1,0,0,0,0,1|2,0,0]=4 5993 B12R1.252 CC(=O)NOCc1[n]ccc[n]1 Amb24749174 [1,0,0,0,0,1|2,0,0]=4 5994 B12R1.252 CC(=O)NOCc1ccc[n]c1 Amb24420633 [1,0,0,0,0,1|1,0,0]=3 5995 B12R1.252 CC(=O)NOCc1cccc[n]1 Amb25077790 [1,0,0,0,0,1|1,0,0]=3 5996 B12R1.252 CC(=O)NOCc1ccccc1 Amb10571914 [1,0,0,0,0,1|0,0,0]=2 5997 B12R1.252 CC(=O)OCOc1cccc[n]1 Amb24100497 [1,0,0,0,0,1|1,0,0]=3 5998 B12R1.252 CC(=O)O[Hg]Cc1ccccc1 Amb22347638 [1,0,0,0,0,1|0,0,0]=2 5999 B12R1.252 CC(=O)O\C=C\c1ccccc1 Amb25829428 [1,0,0,0,0,1|0,0,1]=3 6000 B12R1.252 CC(=O)SCCc1ccccn1 Amb17619708 [1,0,0,0,0,1|1,1,0]=4 6001 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb10565265 [1,0,0,0,0,1|1,0,1]=4 6002 B12R1.252 CC(=O)\C=C/Sc1ccccc1 Amb25735703 [1,0,0,0,0,1|1,0,1]=4 6003 B12R1.252 CC(=O)\C=C\Cc1ccccc1 Amb25179518 [1,0,0,0,0,1|1,0,0]=3 6004 B12R1.252 CC(=O)\C=C\Nc1ccccc1 Amb22266045 [1,0,0,0,0,1|1,0,1]=4 6005 B12R1.252 CC(=O)\C=C\Sc1ccccc1 Amb25179665 [1,0,0,0,0,1|1,0,1]=4 6006 B12R1.252 CC(=O)\C=N/Nc1ccccc1 Amb11012875 [1,0,0,0,0,1|2,0,0]=4 6007 B12R1.252 CC(=O)\C=N\Nc1ccccc1 Amb2425155 [1,0,0,0,0,1|2,0,0]=4 6008 B12R1.252 CC(C)=CCCc1ccccc1 Amb17843373 [1,0,0,0,0,1|2,0,0]=4 6009 B12R1.252 CC(C)=NNCc1ccccc1 Amb24421246 [1,0,0,0,0,1|2,0,0]=4 6010 B12R1.252 CC(C)NOCc1ccccc1 Amb24407142 [1,0,0,0,0,1|1,0,1]=4 6011 B12R1.252 CC(C)ONCc1ccccc1 Amb24408832 [1,0,0,0,0,1|1,0,1]=4 6012 B12R1.252 CC(COCc1ccccc1)N Amb1124568 [1,0,0,0,0,1|1,0,1]=4 6013 B12R1.252 CC(Cl)COCc1ccccc1 Amb25059141 [1,0,0,0,0,1|1,0,1]=4 6014 B12R1.252 CS(=O)CCNc1ccccc1 Amb24562694 [1,0,0,0,0,1|2,0,0]=4 6015 B12R1.252 CS(=O)NOCc1ccccc1 Amb24620390 [1,0,0,0,0,1|1,0,0]=3 6016 B12R1.252 C[C@@H](COCc1ccccc1)N Amb17061656 [1,0,0,0,0,1|1,0,1]=4 6017 B12R1.252 C[C@@H](N)COCc1ccccc1 Amb18529657 [1,0,0,0,0,1|1,0,1]=4 6018 B12R1.252 C[C@@H](O)COCc1ccccc1 Amb22169747 [1,0,0,0,0,1|0,0,2]=4 6019 B12R1.252 C[C@H](O)COCc1ccccc1 Amb22044890 [1,0,0,0,0,1|0,0,2]=4 6020 B12R1.252 ClC(=O)CCSc1ccccc1 Amb10064363 [1,0,0,0,0,1|2,0,0]=4 6021 B12R1.252 NC(=N)NOCc1ccccc1 Amb24651150 [1,0,0,0,0,1|2,0,0]=4 6022 B12R1.252 NC(=O)NCCc1ccccc1 Amb1124980 [1,0,0,0,0,1|2,0,0]=4 6023 B12R1.252 NC(=O)NNCc1ccccc1 Amb24063820 [1,0,0,0,0,1|2,0,0]=4 6024 B12R1.252 NC(=O)NOCc1cccc[n]1 Amb24343576 [1,0,0,0,0,1|2,0,0]=4 6025 B12R1.252 NC(=O)NOCc1ccccc1 Amb1199324 [1,0,0,0,0,1|1,0,0]=3 6026 B12R1.252 NC(=O)\C=C\Cc1ccccc1 Amb25148586 [1,0,0,0,0,1|2,0,0]=4 6027 B12R1.252 O=C(Cl)CNCc1ccccc1 Amb25040534 [1,0,0,0,0,1|2,0,0]=4 6028 B12R1.252 O=C(Cl)NCCc1ccccc1 Amb24619690 [1,0,0,0,0,1|2,0,0]=4 6029 B12R1.252 OC(=O)CCC[13c]1[13cH][13cH][13cH][13cH][13cH]1 Amb22056045 [1,0,0,0,0,1|2,0,0]=4 6030 B12R1.252 OC(=O)CCCc1ccccc1 Amb2388283 [1,0,0,0,0,1|2,0,0]=4 6031 B12R1.252 OC(=O)CCNc1ccccc1 Amb1207377 [1,0,0,0,0,1|2,0,0]=4 6032 B12R1.252 OC(=O)CCOc1ccccc1 Amb1206804 [1,0,0,0,0,1|2,0,0]=4 6033 B12R1.252 OC(=O)CCSc1ccccc1 Amb1036581 [1,0,0,0,0,1|2,0,0]=4 6034 B12R1.252 OC(=O)COCc1ccncc1 Amb13883046 [1,0,0,0,0,1|2,0,0]=4 6035 B12R1.252 OC(=O)C[NH2+]Cc1ccccc1 Amb24113880 [1,0,0,0,0,1|2,0,0]=4 6036 B12R1.252 OC(=O)\C=N/Cc1ccccc1 Amb24068312 [1,0,0,0,0,1|2,0,0]=4 6037 B12R1.252 [O-]C(=O)CCCc1ccccc1 Amb15690987 [1,0,0,0,0,1|2,0,0]=4 6038 B12R1.252 [O-]C(=O)CC[NH2+]c1ccccc1 Amb22499683 [1,0,0,0,0,1|2,0,0]=4 6039 B12R1.2197 CC(C(O)=O)C=1CC=CC=CC1 Amb24711216 [0,0,0,0,1,1|1,0,0]=3 6040 B12R1.54 CC(=O)NCC(C)c1c[s]cc1 Amb25154457 [0,0,0,0,1,1|2,0,0]=4 6041 B12R1.54 CC(=O)NCC(C)c1ccc[s]1 Amb24412731 [0,0,0,0,1,1|2,0,0]=4 6042 B14R1.420 CC(=O)\C=C\NC(C)c1ccccc1 Amb25324895 [0,0,0,0,0,2|1,0,0]=3 6043 B14R1.420 CC(CCCC(O)=O)c1ccccc1 Amb17844447 [0,0,0,0,0,2|2,0,0]=4 6044 B14R1.420 CC(NCCC(N)=O)c1ccccc1 Amb24273095 [0,0,0,0,0,2|2,0,0]=4 6045 B14R1.420 CC(c1ccccc1)NCCC(=O)O Amb2372473 [0,0,0,0,0,2|2,0,0]=4 6046 B14R1.420 C\C(=C\CNC(C)=O)\c1ccccc1 Amb25315136 [0,0,0,0,0,2|1,0,1]=4 6047 B14R1.420 C\C(=N/OCC(=O)O)\c1ccccc1 Amb1201326 [0,0,0,0,0,2|1,0,1]=4 6048 B14R1.420 C\C(=N\OCC(O)=O)\c1ccccc1 Amb22079254 [0,0,0,0,0,2|1,0,1]=4 6049 B14R1.420 C\C(\Cl)=C/CNC(C)c1ccccc1 Amb21953975 [0,0,0,0,0,2|2,0,0]=4 6050 B14R1.423 CC(=O)COC(=O)Cc1ccccc1 Amb24084925 [0,0,0,0,0,2|1,0,1]=4 6051 B14R1.423 CC(=O)O\N=C(/N)\Cc1ccccc1 Amb23247777 [0,0,0,0,0,2|1,0,1]=4 6052 B14R1.423 CC(C#CC(O)=O)Oc1ccccc1 Amb24601847 [0,0,0,0,0,2|2,0,0]=4 6053 B14R1.423 CC(CNC(N)=O)Nc1ccccc1 Amb24448575 [0,0,0,0,0,2|2,0,0]=4 6054 B14R1.423 CN(Cc1ccccc1)CCC(=O)C Amb17401563 [0,0,0,0,0,2|2,0,0]=4 6055 B14R1.423 C\C(\CNC(C)=O)=C/c1ccccc1 Amb24627853 [0,0,0,0,0,2|1,0,1]=4 6056 B14R1.423 O=C(Nc1ccccc1)COC(=O)C Amb1210678 [0,0,0,0,0,2|1,0,1]=4 6057 B14R1.818 CC(=CC(C)=O)NCc1ccccc1 Amb24079060 [0,0,0,0,0,2|1,0,1]=4 6058 B14R1.818 CC(=O)CC(O)OCc1ccccc1 Amb25802890 [0,0,0,0,0,2|2,0,0]=4 6059 B14R1.818 CC(=O)C[C@@H](N)C#Cc1ccccc1 Amb25664270 [0,0,0,0,0,2|2,0,0]=4 6060 B14R1.818 CC(=O)C[C@H](O)C#Cc1ccccc1 Amb25688770 [0,0,0,0,0,2|2,0,0]=4 6061 B14R1.818 CC(=O)NC(C)CNc1ccccc1 Amb25750704 [0,0,0,0,0,2|1,0,0]=3 6062 B14R1.818 CC(=O)OC(C)C#Cc1ccccc1 Amb25676953 [0,0,0,0,0,2|0,0,0]=2 6063 B14R1.818 CC(C)=CC(C)NCc1ccccc1 Amb25833857 [0,0,0,0,0,2|2,0,0]=4 6064 B14R1.818 CC(CC(=O)N)NCc1ccccc1 Amb17235456 [0,0,0,0,0,2|2,0,0]=4 6065 B14R1.818 CC(CC(N)=O)OCc1ccccc1 Amb25249681 [0,0,0,0,0,2|2,0,0]=4 6066 B14R1.818 CC(CCc1ccccc1)NC(N)=O Amb19078987 [0,0,0,0,0,2|2,0,0]=4 6067 B14R1.818 CC(CS(C)=O)NCc1ccccc1 Amb25166531 [0,0,0,0,0,2|2,0,0]=4 6068 B14R1.818 CC(OCc1ccccc1)C=C(C)C Amb17844386 [0,0,0,0,0,2|2,0,0]=4 6069 B14R1.818 C[C@@H](CC(N)=O)NCc1ccccc1 Amb24566940 [0,0,0,0,0,2|2,0,0]=4 6070 B14R1.818 C[C@@H](CC(N)=O)OCc1ccccc1 Amb24498301 [0,0,0,0,0,2|2,0,0]=4 6071 B14R1.818 C[C@@H](CC(O)=O)NCc1ccccc1 Amb25124067 [0,0,0,0,0,2|2,0,0]=4 6072 B14R1.818 C[C@@H](CC(O)=O)OCc1ccccc1 Amb24335959 [0,0,0,0,0,2|2,0,0]=4