0 B13R1.3801 C=C(C)c1cccc(C(C)C)c1O Amb22055570 [0,0,0,0,0,0|0,0,2]=2 1 B13R1.3801 CC(=O)c1cccc(C(C)C)c1O Amb17233424 [0,0,0,0,0,0|1,0,1]=2 2 B13R1.3801 CC(=O)c1cccc(C(F)F)c1O Amb27438155 [0,0,0,0,0,0|3,0,1]=4 3 B13R1.3801 CC(=O)c1cccc(N(C)C)c1F Amb27267265 [0,0,0,0,0,0|3,0,1]=4 4 B13R1.3801 CC(C)c1cccc(C(=O)O)c1Cl Amb27644097 [0,0,0,0,0,0|3,0,1]=4 5 B13R1.3801 CC(C)c1cccc(C(=O)O)c1F Amb26955188 [0,0,0,0,0,0|3,0,1]=4 6 B13R1.3801 CC(C)c1cccc(C(=O)O)c1N Amb33531447 [0,0,0,0,0,0|3,0,1]=4 7 B13R1.3801 CC(C)c1cccc(C(=O)O)c1O Amb7764645 [0,0,0,0,0,0|2,0,1]=3 8 B13R1.3801 CC(C)c1cccc(C(=O)O)c1S Amb27983800 [0,0,0,0,0,0|2,1,1]=4 9 B13R1.3801 CC(C)c1cccc(C(C)C)c1Br Amb22728022 [0,0,0,0,0,0|1,0,0]=1 10 B13R1.3801 CC(C)c1cccc(C(C)C)c1I Amb19888207 [0,0,0,0,0,0|1,0,0]=1 11 B13R1.3801 CC(C)c1cccc(C(C)C)c1N Amb4605985 [0,0,0,0,0,0|1,0,0]=1 12 B13R1.3801 CC(C)c1cccc(C(C)C)c1O Amb3940485 [0,0,0,0,0,0|0,0,0]=0 13 B13R1.3801 CC(C)c1cccc(C(C)N)c1O Amb27587074 [0,0,0,0,0,0|1,0,0]=1 14 B13R1.3801 CC(C)c1cccc(C(N)=O)c1O Amb27180429 [0,0,0,0,0,0|2,0,1]=3 15 B13R1.3801 CC(C)c1cccc([N+](=O)[O-])c1N Amb16191965 [0,0,0,0,0,0|4,0,0]=4 16 B13R1.3801 CC(C)c1cccc([N+](=O)[O-])c1O Amb3429066 [0,0,0,0,0,0|3,0,0]=3 17 B13R1.3801 CC(C)c1ccnc(C(C)C)c1N Amb27771351 [0,0,0,0,0,0|2,0,0]=2 18 B13R1.3801 CC(C)c1ccnc(C(C)O)c1F Amb27665540 [0,0,0,0,0,0|3,0,0]=3 19 B13R1.3801 CC(N)c1cccc(N(C)C)c1F Amb28317465 [0,0,0,0,0,0|3,0,0]=3 20 B13R1.3801 CC(N)c1cccc([N+](=O)[O-])c1O Amb27828182 [0,0,0,0,0,0|4,0,0]=4 21 B13R1.3801 CN(C)c1cccc(C(=O)O)c1O Amb27180478 [0,0,0,0,0,0|3,0,1]=4 22 B13R1.3801 C[C@H](N)c1cccc(C(=O)O)c1O Amb28346282 [0,0,0,0,0,0|3,0,1]=4 23 B13R1.3801 C[C@H](N)c1cccc([N+](=O)[O-])c1O Amb28457252 [0,0,0,0,0,0|4,0,0]=4 24 B13R1.3801 Cc1c(C(C)C)cccc1[N+](=O)[O-] Amb27622850 [0,0,0,0,0,0|4,0,0]=4 25 B13R1.3801 Cc1c(C(C)O)cncc1C(C)O Amb28138690 [0,0,0,0,0,0|4,0,0]=4 26 B12R1.258 C=C(C)c1cccc(C(C)C)c1 Amb25762570 [1,0,0,0,0,0|0,0,2]=3 27 B12R1.258 C=C(C)c1cccc(C(C)O)c1 Amb27638267 [1,0,0,0,0,0|1,0,2]=4 28 B12R1.258 C=C(C)c1cccc(N(C)C)c1 Amb27954270 [1,0,0,0,0,0|1,0,2]=4 29 B12R1.258 CC(=O)c1cccc(C(C)C)c1 Amb22001971 [1,0,0,0,0,0|1,0,1]=3 30 B12R1.258 CC(=O)c1cccc(C(C)C)n1 Amb25768938 [1,0,0,0,0,0|2,0,1]=4 31 B12R1.258 CC(=O)c1cccc(C(C)N)c1 Amb27178051 [1,0,0,0,0,0|2,0,1]=4 32 B12R1.258 CC(=O)c1cccc(C(C)O)c1 Amb27607795 [1,0,0,0,0,0|2,0,1]=4 33 B12R1.258 CC(=O)c1cccc(N(C)C)c1 Amb6297300 [1,0,0,0,0,0|2,0,1]=4 34 B12R1.258 CC(=O)c1cccc([C@@H](C)O)c1 Amb26586292 [1,0,0,0,0,0|2,0,1]=4 35 B12R1.258 CC(=O)c1cccc([C@H](C)N)c1 Amb33872246 [1,0,0,0,0,0|2,0,1]=4 36 B12R1.258 CC(=O)c1ccnc(C(C)C)c1 Amb26546973 [1,0,0,0,0,0|2,0,1]=4 37 B12R1.258 CC(=O)c1cncc(C(C)C)c1 Amb25724847 [1,0,0,0,0,0|2,0,1]=4 38 B12R1.258 CC(C)c1cccc(B(O)O)c1 Amb2447050 [1,0,0,0,0,0|3,0,0]=4 39 B12R1.258 CC(C)c1cccc(C(=N)N)c1 Amb32876782 [1,0,0,0,0,0|2,0,1]=4 40 B12R1.258 CC(C)c1cccc(C(=O)O)c1 Amb8439095 [1,0,0,0,0,0|2,0,1]=4 41 B12R1.258 CC(C)c1cccc(C(C)C)c1 Amb6357185 [1,0,0,0,0,0|0,0,0]=1 42 B12R1.258 CC(C)c1cccc(C(C)N)c1 Amb18829126 [1,0,0,0,0,0|1,0,0]=2 43 B12R1.258 CC(C)c1cccc(C(C)O)c1 Amb25064309 [1,0,0,0,0,0|1,0,0]=2 44 B12R1.258 CC(C)c1cccc(C(N)=O)c1 Amb27658980 [1,0,0,0,0,0|2,0,1]=4 45 B12R1.258 CC(C)c1cccc(C(N)=S)c1 Amb32875451 [1,0,0,0,0,0|2,0,1]=4 46 B12R1.258 CC(C)c1cccc(S(=O)[O-])c1 Amb32754506 [1,0,0,0,0,0|3,0,0]=4 47 B12R1.258 CC(C)c1cccc([C@@H](C)N)c1 Amb28040847 [1,0,0,0,0,0|1,0,0]=2 48 B12R1.258 CC(C)c1cccc([C@@H](C)O)c1 Amb33148957 [1,0,0,0,0,0|1,0,0]=2 49 B12R1.258 CC(C)c1cccc([C@H](C)N)c1 Amb24488600 [1,0,0,0,0,0|1,0,0]=2 50 B12R1.258 CC(C)c1cccc([C@H](C)O)c1 Amb33149412 [1,0,0,0,0,0|1,0,0]=2 51 B12R1.258 CC(C)c1cccc([N+](=O)[O-])c1 Amb4477460 [1,0,0,0,0,0|3,0,0]=4 52 B12R1.258 CC(C)c1ccnc(C(C)N)n1 Amb18862641 [1,0,0,0,0,0|3,0,0]=4 53 B12R1.258 CC(C)c1ccnc(C(C)O)c1 Amb27178483 [1,0,0,0,0,0|2,0,0]=3 54 B12R1.258 CC(C)c1ccnc(N(C)C)n1 Amb28205253 [1,0,0,0,0,0|3,0,0]=4 55 B12R1.258 CC(N)c1cccc(C(F)F)c1 Amb25090408 [1,0,0,0,0,0|3,0,0]=4 56 B12R1.258 CC(N)c1cccc(C(F)F)c1 Amb35752352 [1,0,0,0,0,0|3,0,0]=4 57 B12R1.258 CC(N)c1cccc(N(C)C)c1 Amb24085106 [1,0,0,0,0,0|2,0,0]=3 58 B12R1.258 CC(N)c1cccc(N(C)C)n1 Amb30007848 [1,0,0,0,0,0|3,0,0]=4 59 B12R1.258 CC(O)c1cc(N(C)C)ccn1 Amb27642049 [1,0,0,0,0,0|3,0,0]=4 60 B12R1.258 CC(O)c1cccc(C(C)F)c1 Amb27429094 [1,0,0,0,0,0|2,0,0]=3 61 B12R1.258 CC(O)c1cccc(C(C)O)c1 Amb17594130 [1,0,0,0,0,0|2,0,0]=3 62 B12R1.258 CC(O)c1cccc(N(C)C)c1 Amb22732103 [1,0,0,0,0,0|2,0,0]=3 63 B12R1.258 CC(O)c1cccc(N(C)C)n1 Amb29864973 [1,0,0,0,0,0|3,0,0]=4 64 B12R1.258 CC(O)c1cncc(C(C)O)c1 Amb27662260 [1,0,0,0,0,0|3,0,0]=4 65 B12R1.258 CN(C)c1cccc(N(C)C)c1 Amb18269361 [1,0,0,0,0,0|2,0,0]=3 66 B12R1.258 CN(C)c1ccnc(N(C)C)c1 Amb2609689 [1,0,0,0,0,0|3,0,0]=4 67 B12R1.258 C[C@@H](N)c1cccc(C(F)F)c1 Amb24351626 [1,0,0,0,0,0|3,0,0]=4 68 B12R1.258 C[C@@H](N)c1cccc(N(C)C)c1 Amb26317942 [1,0,0,0,0,0|2,0,0]=3 69 B12R1.258 C[C@@H](N)c1cccc(N(C)C)n1 Amb35733696 [1,0,0,0,0,0|3,0,0]=4 70 B12R1.258 C[C@@H](O)c1cc(N(C)C)ccn1 Amb28345482 [1,0,0,0,0,0|3,0,0]=4 71 B12R1.258 C[C@@H](O)c1cccc(N(C)C)c1 Amb27394743 [1,0,0,0,0,0|2,0,0]=3 72 B12R1.258 C[C@@H](O)c1cccc(N(C)C)n1 Amb29858208 [1,0,0,0,0,0|3,0,0]=4 73 B12R1.258 C[C@@H](O)c1cccc([C@@H](C)O)c1 Amb27470107 [1,0,0,0,0,0|2,0,0]=3 74 B12R1.258 C[C@H](N)c1cccc(C(F)F)c1 Amb24377652 [1,0,0,0,0,0|3,0,0]=4 75 B12R1.258 C[C@H](N)c1cccc(N(C)C)n1 Amb35726230 [1,0,0,0,0,0|3,0,0]=4 76 B12R1.258 C[C@H](N)c1ccnc(N(C)C)c1 Amb27770228 [1,0,0,0,0,0|3,0,0]=4 77 B12R1.258 C[C@H](O)c1cc(N(C)C)ccn1 Amb27766601 [1,0,0,0,0,0|3,0,0]=4 78 B12R1.258 C[C@H](O)c1cccc(N(C)C)c1 Amb28453486 [1,0,0,0,0,0|2,0,0]=3 79 B12R1.258 C[C@H](O)c1cccc(N(C)C)n1 Amb29858215 [1,0,0,0,0,0|3,0,0]=4 80 B12R1.258 C[C@H](O)c1cccc([C@@H](C)O)n1 Amb28244413 [1,0,0,0,0,0|3,0,0]=4 81 B12R1.258 C[C@H](O)c1cccc([C@H](C)O)c1 Amb27219822 [1,0,0,0,0,0|2,0,0]=3 82 B12R1.258 C[C@H](O)c1ccnc(N(C)C)c1 Amb27800355 [1,0,0,0,0,0|3,0,0]=4 83 B12R1.440 CC(=O)c1cccc(CF)c1O Amb28208648 [1,0,0,0,0,0|2,0,1]=4 84 B12R1.440 CC(C)c1cccc(C#N)c1N Amb25094876 [1,0,0,0,0,0|2,0,1]=4 85 B12R1.440 CC(C)c1cccc(C#N)c1O Amb28137753 [1,0,0,0,0,0|1,0,1]=3 86 B12R1.440 CC(C)c1cccc(C=O)c1O Amb18646062 [1,0,0,0,0,0|1,0,1]=3 87 B12R1.440 CC(C)c1cccc(CN)c1F Amb27658202 [1,0,0,0,0,0|2,0,0]=3 88 B12R1.440 CC(F)c1cccc(C=O)c1O Amb27437984 [1,0,0,0,0,0|2,0,1]=4 89 B12R1.440 CC(F)c1cccc(CN)c1O Amb27429071 [1,0,0,0,0,0|2,0,0]=3 90 B12R1.440 CC(N)c1cccc(CF)c1Cl Amb28411707 [1,0,0,0,0,0|3,0,0]=4 91 B12R1.440 CC(N)c1cccc(CF)c1O Amb27879102 [1,0,0,0,0,0|2,0,0]=3 92 B12R1.440 CCc1cccc(B(O)O)c1O Amb25834562 [1,0,0,0,0,0|3,0,0]=4 93 B12R1.440 CCc1cccc(C(=O)O)c1O Amb7807388 [1,0,0,0,0,0|2,0,1]=4 94 B12R1.440 CCc1cccc(C(C)=O)c1O Amb17232473 [1,0,0,0,0,0|1,0,1]=3 95 B12R1.440 CCc1cccc(C(C)Br)c1F Amb27971029 [1,0,0,0,0,0|2,0,0]=3 96 B12R1.440 CCc1cccc(C(C)C)c1O Amb27453449 [1,0,0,0,0,0|0,0,0]=1 97 B12R1.440 CCc1cccc(C(C)N)c1Br Amb27410241 [1,0,0,0,0,0|2,0,0]=3 98 B12R1.440 CCc1cccc(C(C)N)c1C Amb27249351 [1,0,0,0,0,0|2,0,0]=3 99 B12R1.440 CCc1cccc(C(C)N)c1O Amb27828018 [1,0,0,0,0,0|1,0,0]=2 100 B12R1.440 CCc1cccc(C(C)O)c1O Amb27438186 [1,0,0,0,0,0|1,0,0]=2 101 B12R1.440 CCc1cccc(C(N)=S)c1O Amb26518921 [1,0,0,0,0,0|2,0,1]=4 102 B12R1.440 CCc1cccc([N+](=O)[O-])c1O Amb26349813 [1,0,0,0,0,0|3,0,0]=4 103 B12R1.440 CN(C)c1cccc(C=O)c1O Amb28144976 [1,0,0,0,0,0|2,0,1]=4 104 B12R1.440 CN(C)c1cccc(CN)c1O Amb27175603 [1,0,0,0,0,0|2,0,0]=3 105 B12R1.440 CNc1cccc(C(C)C)c1N Amb27438227 [1,0,0,0,0,0|2,0,0]=3 106 B12R1.440 CNc1cccc(C(C)F)c1O Amb27777422 [1,0,0,0,0,0|2,0,0]=3 107 B12R1.440 COc1cccc(C(C)=O)c1O Amb10603308 [1,0,0,0,0,0|2,0,1]=4 108 B12R1.440 COc1cccc(C(C)C)c1Br Amb27791298 [1,0,0,0,0,0|2,0,0]=3 109 B12R1.440 COc1cccc(C(C)C)c1N Amb24431981 [1,0,0,0,0,0|2,0,0]=3 110 B12R1.440 COc1cccc(C(C)Cl)c1F Amb28435958 [1,0,0,0,0,0|3,0,0]=4 111 B12R1.440 COc1cccc(C(C)N)c1Br Amb24439270 [1,0,0,0,0,0|3,0,0]=4 112 B12R1.440 COc1cccc(C(C)N)c1C Amb25082687 [1,0,0,0,0,0|3,0,0]=4 113 B12R1.440 COc1cccc(C(C)N)c1Cl Amb27408435 [1,0,0,0,0,0|3,0,0]=4 114 B12R1.440 COc1cccc(C(C)N)c1F Amb24487312 [1,0,0,0,0,0|3,0,0]=4 115 B12R1.440 COc1cccc(C(C)N)c1O Amb25211786 [1,0,0,0,0,0|2,0,0]=3 116 B12R1.440 COc1cccc(C(C)O)c1Cl Amb27146488 [1,0,0,0,0,0|3,0,0]=4 117 B12R1.440 COc1cccc([C@@H](C)N)c1Br Amb26477345 [1,0,0,0,0,0|3,0,0]=4 118 B12R1.440 COc1cccc([C@@H](C)N)c1C Amb27620305 [1,0,0,0,0,0|3,0,0]=4 119 B12R1.440 COc1cccc([C@@H](C)N)c1Cl Amb27227975 [1,0,0,0,0,0|3,0,0]=4 120 B12R1.440 COc1cccc([C@@H](C)N)c1F Amb22298517 [1,0,0,0,0,0|3,0,0]=4 121 B12R1.440 COc1cccc([C@@H](C)N)c1F Amb25992368 [1,0,0,0,0,0|3,0,0]=4 122 B12R1.440 COc1cccc([C@@H](C)N)c1O Amb28044329 [1,0,0,0,0,0|2,0,0]=3 123 B12R1.440 COc1cccc([C@@H](C)O)c1Br Amb33334210 [1,0,0,0,0,0|3,0,0]=4 124 B12R1.440 COc1cccc([C@@H](C)O)c1C Amb33269558 [1,0,0,0,0,0|3,0,0]=4 125 B12R1.440 COc1cccc([C@@H](C)O)c1O Amb24716929 [1,0,0,0,0,0|2,0,0]=3 126 B12R1.440 COc1cccc([C@H](C)N)c1Br Amb28341112 [1,0,0,0,0,0|3,0,0]=4 127 B12R1.440 COc1cccc([C@H](C)N)c1C Amb26588404 [1,0,0,0,0,0|3,0,0]=4 128 B12R1.440 COc1cccc([C@H](C)N)c1F Amb27425331 [1,0,0,0,0,0|3,0,0]=4 129 B12R1.440 COc1cccc([C@H](C)N)c1O Amb25091345 [1,0,0,0,0,0|2,0,0]=3 130 B12R1.440 COc1cccc([C@H](C)O)c1Br Amb33334216 [1,0,0,0,0,0|3,0,0]=4 131 B12R1.440 COc1cccc([C@H](C)O)c1C Amb33226022 [1,0,0,0,0,0|3,0,0]=4 132 B12R1.440 COc1cccc([C@H](C)O)c1F Amb27784504 [1,0,0,0,0,0|3,0,0]=4 133 B12R1.440 COc1cccc([C@H](C)O)c1O Amb25969051 [1,0,0,0,0,0|2,0,0]=3 134 B12R1.440 CSc1cccc([C@H](C)N)c1O Amb27596225 [1,0,0,0,0,0|2,0,0]=3 135 B12R1.440 C[C@@H](N)c1cccc(CO)c1O Amb27860356 [1,0,0,0,0,0|2,0,0]=3 136 B12R1.440 C[C@H](N)c1cccc(CO)c1O Amb27413505 [1,0,0,0,0,0|2,0,0]=3 137 B14R1.112 CC(C)c1cccc(C(C)C)c1C#N Amb19892478 [0,1,0,0,0,0|1,0,0]=2 138 B14R1.112 CC(C)c1cccc(C(C)C)c1C=O Amb28190889 [0,1,0,0,0,0|0,0,1]=2 139 B14R1.112 CC(C)c1cccc(C(C)C)c1NN Amb24117249 [0,1,0,0,0,0|1,0,0]=2 140 B14R1.112 CN(C)c1cccc(N(C)C)c1C#N Amb2724190 [0,1,0,0,0,0|3,0,0]=4 141 B14R1.112 CN(C)c1cccc(N(C)C)c1CN Amb24734177 [0,1,0,0,0,0|3,0,0]=4 142 B14R1.112 COc1c(C(=O)O)cccc1C(C)C Amb2227375 [0,1,0,0,0,0|2,0,1]=4 143 B14R1.112 COc1c(C(C)C)cccc1[N+](=O)[O-] Amb6308497 [0,1,0,0,0,0|3,0,0]=4 144 B14R1.112 [C-]#[N+]c1c(C(C)C)cccc1C(C)C Amb3973132 [0,1,0,0,0,0|1,0,0]=2 145 B14R1.736 C=CC(C)c1cccc(C(C)C)c1O Amb26625024 [0,1,0,0,0,0|0,0,1]=2 146 B14R1.736 CC(C)c1cccc(C(C)CF)c1O Amb27859391 [0,1,0,0,0,0|0,0,0]=1 147 B14R1.736 CC(C)c1cccc(C(N)CN)c1O Amb27387986 [0,1,0,0,0,0|1,0,0]=2 148 B14R1.736 CC(F)c1cccc(C(C)CN)c1O Amb28071353 [0,1,0,0,0,0|1,0,0]=2 149 B14R1.736 CCC(=O)c1cccc(C(C)C)c1O Amb17235427 [0,1,0,0,0,0|1,0,1]=3 150 B14R1.736 CCC(C)c1cccc(B(O)O)c1O Amb27172758 [0,1,0,0,0,0|3,0,0]=4 151 B14R1.736 CC[C@H](N)c1cccc(C(C)C)c1O Amb27800855 [0,1,0,0,0,0|1,0,0]=2 152 B14R1.736 CNC(=O)c1cccc(C(C)C)c1O Amb28145943 [0,1,0,0,0,0|1,0,1]=3 153 B14R1.736 CNC(C)c1cccc(C(C)F)c1O Amb27964216 [0,1,0,0,0,0|1,0,0]=2 154 B14R1.736 CNC(C)c1cccc(C(F)F)c1O Amb27229200 [0,1,0,0,0,0|2,0,0]=3 155 B14R1.736 CNC(C)c1cccc([N+](=O)[O-])c1O Amb27877432 [0,1,0,0,0,0|3,0,0]=4 156 B14R1.736 COC(=O)c1cccc(C(C)C)c1N Amb18968686 [0,1,0,0,0,0|2,0,1]=4 157 B14R1.736 COC(=O)c1cccc(C(C)C)c1O Amb26497577 [0,1,0,0,0,0|1,0,1]=3 158 B14R1.3145 CC(=O)c1cc(Br)cc(C(C)C)c1O Amb25734668 [0,1,0,0,0,0|1,0,1]=3 159 B14R1.3145 CC(=O)c1cc(Cl)cc(C(C)C)c1O Amb18056367 [0,1,0,0,0,0|1,0,1]=3 160 B14R1.3145 CC(C)C1=CC(=O)C=C(C(C)C)C1=O Amb17613112 [0,1,0,0,0,0|0,0,1]=2 161 B14R1.3145 CC(C)c1cc(Br)cc(C(C)C)c1N Amb10602626 [0,1,0,0,0,0|1,0,0]=2 162 B14R1.3145 CC(C)c1cc(Br)cc(C(C)C)c1O Amb20620460 [0,1,0,0,0,0|0,0,0]=1 163 B14R1.3145 CC(C)c1cc(Br)cc(C(C)N)c1O Amb33192282 [0,1,0,0,0,0|1,0,0]=2 164 B14R1.3145 CC(C)c1cc(Cl)cc(C(=O)O)c1O Amb18555092 [0,1,0,0,0,0|2,0,1]=4 165 B14R1.3145 CC(C)c1cc(Cl)cc(C(C)C)c1Br Amb33875481 [0,1,0,0,0,0|1,0,0]=2 166 B14R1.3145 CC(C)c1cc(Cl)cc(C(C)C)c1N Amb26382693 [0,1,0,0,0,0|1,0,0]=2 167 B14R1.3145 CC(C)c1cc(Cl)cc(C(C)C)c1O Amb25860012 [0,1,0,0,0,0|0,0,0]=1 168 B14R1.3145 CC(C)c1cc(Cl)cc(C(C)N)c1O Amb18056366 [0,1,0,0,0,0|1,0,0]=2 169 B14R1.3145 CC(C)c1cc(I)cc(C(C)C)c1O Amb19895170 [0,1,0,0,0,0|0,0,0]=1 170 B14R1.3145 CC(C)c1cc(N)cc(C(C)C)c1N Amb27749348 [0,1,0,0,0,0|1,0,0]=2 171 B14R1.3145 CC(C)c1cc(N)cc(C(C)C)c1O Amb4460648 [0,1,0,0,0,0|0,0,0]=1 172 B14R1.3145 CC(C)c1cc(O)cc(C(C)C)c1F Amb27612676 [0,1,0,0,0,0|1,0,0]=2 173 B14R1.3145 CC(C)c1cc(O)cc(C(C)C)c1I Amb8388187 [0,1,0,0,0,0|1,0,0]=2 174 B14R1.3145 CC(C)c1cc(O)cc(C(C)C)c1N Amb27165677 [0,1,0,0,0,0|1,0,0]=2 175 B14R1.3145 CC(C)c1cc(S)cc(C(C)C)c1O Amb27189254 [0,1,0,0,0,0|0,0,0]=1 176 B14R1.3145 Cc1c(C(C)C)cc(N)cc1C(C)C Amb25744575 [0,1,0,0,0,0|1,0,0]=2 177 B14R1.3145 Cc1cc(C(C)C)c(N)c(C(C)C)c1 Amb27484038 [0,1,0,0,0,0|1,0,0]=2 178 B14R1.3145 Cc1cc(C(C)C)c(O)c(C(C)C)c1 Amb24710547 [0,1,0,0,0,0|0,0,0]=1 179 B14R1.4939 C=C(C)c1cccc(C(C)(C)C)c1O Amb28365208 [0,1,0,0,0,0|0,0,2]=3 180 B14R1.4939 CC(=O)c1cccc(C(C)(F)F)c1O Amb28053255 [0,1,0,0,0,0|2,0,1]=4 181 B14R1.4939 CC(C)(C)c1cccc(B(O)O)c1O Amb25946272 [0,1,0,0,0,0|3,0,0]=4 182 B14R1.4939 CC(C)(C)c1cccc(C(=O)O)c1O Amb7807411 [0,1,0,0,0,0|2,0,1]=4 183 B14R1.4939 CC(C)(C)c1cccc([N+](=O)[O-])c1O Amb28246122 [0,1,0,0,0,0|3,0,0]=4 184 B14R1.4939 CC(C)c1cccc(C(C)(C)C)c1O Amb27243893 [0,1,0,0,0,0|0,0,0]=1 185 B14R1.4939 CC(C)c1cncc(C(F)(F)F)c1O Amb27848671 [0,1,0,0,0,0|3,0,0]=4 186 B14R1.4939 CC(N)c1cccc(C(C)(C)C)c1O Amb27957634 [0,1,0,0,0,0|1,0,0]=2 187 B14R1.4939 CC(N)c1cccc(C(C)(C)F)c1O Amb27842369 [0,1,0,0,0,0|1,0,0]=2 188 B14R1.4939 CN(C)c1cccc(C(C)(C)O)c1F Amb28280805 [0,1,0,0,0,0|2,0,0]=3 189 B14R1.4939 CN(C)c1cccc([Si](C)(C)C)c1F Amb22641559 [0,1,0,0,0,0|2,1,0]=4 190 B14R1.4939 C[C@@H](N)c1cccc(C(F)(F)F)c1O Amb27412536 [0,1,0,0,0,0|3,0,0]=4 191 B14R1.6045 CC(=O)c1c(C)ccc(C(C)C)c1O Amb27972956 [0,1,0,0,0,0|1,0,1]=3 192 B14R1.6045 CC(=O)c1c(O)ccc(C(C)C)c1C Amb28321991 [0,1,0,0,0,0|2,0,1]=4 193 B14R1.6045 CC(=O)c1ccc(O)c(C(C)C)c1O Amb28202389 [0,1,0,0,0,0|1,0,1]=3 194 B14R1.6045 CC(C)c1ccc(F)c(C(C)C)c1N Amb27476155 [0,1,0,0,0,0|1,0,0]=2 195 B14R1.6045 CC(C)c1ccc(O)c(C(C)C)c1O Amb8385819 [0,1,0,0,0,0|0,0,0]=1 196 B14R1.6045 Cc1c(C(C)C)ccc(O)c1C(C)C Amb28202388 [0,1,0,0,0,0|1,0,0]=2 197 B14R1.6045 Cc1ccc(C(C)C)c(O)c1C(=O)O Amb3940601 [0,1,0,0,0,0|2,0,1]=4 198 B14R1.6045 Cc1ccc(C(C)C)c(O)c1C(C)N Amb27164009 [0,1,0,0,0,0|1,0,0]=2 199 B14R1.6045 Cc1ccc(C(C)C)c(O)c1C(N)=O Amb27471771 [0,1,0,0,0,0|2,0,1]=4 200 B14R1.6045 Cc1ccc(C(C)C)c(O)c1[N+](=O)[O-] Amb32410905 [0,1,0,0,0,0|3,0,0]=4 201 B14R2.4 CC(C)c1cccc2c1CCC2=O Amb27759538 [0,0,0,1,0,0|2,0,1]=4 202 B14R2.4 CC(C)c1cccc2c1CC[C@@H]2O Amb28289425 [0,0,0,1,0,0|2,0,0]=3 203 B14R2.4 CC(C)c1cccc2c1CN[C@H]2C Amb28252852 [0,0,0,1,0,0|2,0,0]=3 204 B14R2.4 CC(C)c1cccc2c1NCC2C Amb17040664 [0,0,0,1,0,0|1,0,0]=2 205 B14R2.4 CC1COc2c(C(=O)O)cccc21 Amb33547910 [0,0,0,1,0,0|2,0,1]=4 206 B14R2.4 CN(C)c1cccc2c1CCC2N Amb28316411 [0,0,0,1,0,0|3,0,0]=4 207 B14R2.4 CN(C)c1cccc2c1CC[C@@H]2N Amb28048594 [0,0,0,1,0,0|3,0,0]=4 208 B14R2.4 CN(C)c1cccc2c1CC[C@H]2N Amb27468575 [0,0,0,1,0,0|3,0,0]=4 209 B14R2.4 CN(C)c1cccc2c1OCC2N Amb27175298 [0,0,0,1,0,0|2,0,0]=3 210 B14R2.4 C[C@@H]1COc2c(C(=O)O)cccc21 Amb27231762 [0,0,0,1,0,0|2,0,1]=4 211 B14R2.4 NC1COc2c(C(F)F)cccc21 Amb24386082 [0,0,0,1,0,0|3,0,0]=4 212 B14R2.4 N[C@@H]1COc2c(C(F)F)cccc21 Amb27168234 [0,0,0,1,0,0|3,0,0]=4 213 B14R2.23681 CC(C)c1cccc(C2CC2)c1O Amb25339415 [0,0,0,1,0,0|0,0,0]=1 214 B12R1.901 CC(C)=C1C=CC(=C(C)C)C1=O Amb26979761 [0,0,0,0,1,0|0,0,3]=4 215 B12R1.901 CC(C)=C1CC=C(C(C)C)C1=O Amb27954051 [0,0,0,0,1,0|0,0,3]=4 216 B12R1.901 CC(C)c1ccc(C(C)C)n1C Amb27793788 [0,0,0,0,1,0|2,0,0]=3 217 B12R1.901 CC(C)c1csc(C(C)C)c1N Amb27635367 [0,0,0,0,1,0|2,0,0]=3 218 B12R1.901 CC(C)c1noc(C(C)C)c1N Amb25751271 [0,0,0,0,1,0|3,0,0]=4 219 B14R1.4450 CC(=O)Nc1cccc(C(C)C)c1C Amb27469689 [0,0,0,0,0,1|2,0,1]=4 220 B14R1.4450 CC(C)Cc1cccc(C(=O)O)c1O Amb27765397 [0,0,0,0,0,1|2,0,1]=4 221 B14R1.4450 CC(C)Cc1cccc(C(C)C)c1N Amb27386915 [0,0,0,0,0,1|1,0,0]=2 222 B14R1.4450 CC(C)Oc1cccc(C(C)C)c1O Amb27611647 [0,0,0,0,0,1|0,0,0]=1 223 B14R1.4450 CC(C)Oc1cccc(N(C)C)c1O Amb27251518 [0,0,0,0,0,1|1,0,0]=2 224 B14R1.4450 CC(C)Sc1cccc(C(=O)O)c1O Amb27588177 [0,0,0,0,0,1|2,0,1]=4 225 B14R1.4450 CC(C)c1cccc(CN(C)C)c1O Amb28461301 [0,0,0,0,0,1|1,0,0]=2 226 B14R1.4450 CC(C)c1cccc(CS(C)=O)c1N Amb28072934 [0,0,0,0,0,1|3,0,0]=4 227 B14R1.4450 CC(N)Cc1cccc(C(C)C)c1O Amb27659386 [0,0,0,0,0,1|1,0,0]=2 228 B14R1.4450 CN(C)Cc1cccc(N(C)C)c1I Amb27225895 [0,0,0,0,0,1|3,0,0]=4 229 B11R1.266 C#Cc1cccc(C(C)C)c1 Amb25726085 [2,0,0,0,0,0|0,0,2]=4 230 B11R1.266 C=Cc1cccc(C(C)C)c1 Amb32682043 [2,0,0,0,0,0|0,0,2]=4 231 B11R1.266 CC(C)c1cc(CCl)ccn1 Amb25152760 [2,0,0,0,0,0|2,0,0]=4 232 B11R1.266 CC(C)c1cc(CN)ccn1 Amb25683814 [2,0,0,0,0,0|2,0,0]=4 233 B11R1.266 CC(C)c1cccc(C#N)c1 Amb24423599 [2,0,0,0,0,0|1,0,1]=4 234 B11R1.266 CC(C)c1cccc(C=O)c1 Amb2694400 [2,0,0,0,0,0|1,0,1]=4 235 B11R1.266 CC(C)c1cccc(CBr)c1 Amb23439885 [2,0,0,0,0,0|1,0,0]=3 236 B11R1.266 CC(C)c1cccc(CBr)n1 Amb23450338 [2,0,0,0,0,0|2,0,0]=4 237 B11R1.266 CC(C)c1cccc(CCl)c1 Amb26318577 [2,0,0,0,0,0|1,0,0]=3 238 B11R1.266 CC(C)c1cccc(CCl)n1 Amb25279458 [2,0,0,0,0,0|2,0,0]=4 239 B11R1.266 CC(C)c1cccc(CN)c1 Amb27825820 [2,0,0,0,0,0|1,0,0]=3 240 B11R1.266 CC(C)c1cccc(CN)n1 Amb18201874 [2,0,0,0,0,0|2,0,0]=4 241 B11R1.266 CC(C)c1cccc(CO)c1 Amb21964321 [2,0,0,0,0,0|1,0,0]=3 242 B11R1.266 CC(C)c1cccc(CO)n1 Amb20669198 [2,0,0,0,0,0|2,0,0]=4 243 B11R1.266 CC(C)c1cccc(CS)c1 Amb24068386 [2,0,0,0,0,0|1,0,0]=3 244 B11R1.266 CC(C)c1cccc(NN)c1 Amb4477461 [2,0,0,0,0,0|2,0,0]=4 245 B11R1.266 CC(C)c1cccc(ON)c1 Amb26373242 [2,0,0,0,0,0|2,0,0]=4 246 B11R1.266 CC(C)c1ccnc(CBr)c1 Amb24684909 [2,0,0,0,0,0|2,0,0]=4 247 B11R1.266 CC(C)c1ccnc(CCl)c1 Amb26364062 [2,0,0,0,0,0|2,0,0]=4 248 B11R1.266 CC(C)c1ccnc(CN)c1 Amb18831283 [2,0,0,0,0,0|2,0,0]=4 249 B11R1.266 CC(C)c1ccnc(CO)c1 Amb25126869 [2,0,0,0,0,0|2,0,0]=4 250 B11R1.266 CC(C)c1cncc(CCl)c1 Amb25724841 [2,0,0,0,0,0|2,0,0]=4 251 B11R1.266 CC(C)c1cncc(CN)c1 Amb26968197 [2,0,0,0,0,0|2,0,0]=4 252 B11R1.266 CC(C)c1cncc(CO)c1 Amb25028169 [2,0,0,0,0,0|2,0,0]=4 253 B11R1.266 CC(N)c1cccc(CF)c1 Amb28280776 [2,0,0,0,0,0|2,0,0]=4 254 B11R1.266 CC(O)c1cccc(CO)c1 Amb25149561 [2,0,0,0,0,0|2,0,0]=4 255 B11R1.266 CCc1cccc(C(C)=O)c1 Amb2726208 [2,0,0,0,0,0|1,0,1]=4 256 B11R1.266 CCc1cccc(C(C)C)c1 Amb22227945 [2,0,0,0,0,0|0,0,0]=2 257 B11R1.266 CCc1cccc(C(C)C)n1 Amb10807412 [2,0,0,0,0,0|1,0,0]=3 258 B11R1.266 CCc1cccc(C(C)N)c1 Amb24484480 [2,0,0,0,0,0|1,0,0]=3 259 B11R1.266 CCc1cccc(C(C)O)c1 Amb17593741 [2,0,0,0,0,0|1,0,0]=3 260 B11R1.266 CCc1cccc(N(C)C)c1 Amb27872466 [2,0,0,0,0,0|1,0,0]=3 261 B11R1.266 CCc1cccc([C@@H](C)N)c1 Amb25145683 [2,0,0,0,0,0|1,0,0]=3 262 B11R1.266 CCc1cccc([C@@H](C)O)c1 Amb32876479 [2,0,0,0,0,0|1,0,0]=3 263 B11R1.266 CCc1cccc([C@H](C)N)c1 Amb24460784 [2,0,0,0,0,0|1,0,0]=3 264 B11R1.266 CCc1cccc([C@H](C)O)c1 Amb32876471 [2,0,0,0,0,0|1,0,0]=3 265 B11R1.266 CCc1ccnc(C(C)O)c1 Amb27486453 [2,0,0,0,0,0|2,0,0]=4 266 B11R1.266 CCc1ccnc([C@@H](C)O)c1 Amb28294225 [2,0,0,0,0,0|2,0,0]=4 267 B11R1.266 CN(C)c1cccc(CBr)c1 Amb22899606 [2,0,0,0,0,0|2,0,0]=4 268 B11R1.266 CN(C)c1cccc(CBr)c1 Amb24088437 [2,0,0,0,0,0|2,0,0]=4 269 B11R1.266 CN(C)c1cccc(CCl)c1 Amb19374961 [2,0,0,0,0,0|2,0,0]=4 270 B11R1.266 CN(C)c1cccc(CCl)c1 Amb8860564 [2,0,0,0,0,0|2,0,0]=4 271 B11R1.266 CN(C)c1cccc(CN)c1 Amb2691277 [2,0,0,0,0,0|2,0,0]=4 272 B11R1.266 CN(C)c1cccc(CO)c1 Amb2687443 [2,0,0,0,0,0|2,0,0]=4 273 B11R1.266 CN(C)c1cccc(CS)c1 Amb26872221 [2,0,0,0,0,0|2,0,0]=4 274 B11R1.266 CNc1cc(C(C)C)ccn1 Amb27445846 [2,0,0,0,0,0|2,0,0]=4 275 B11R1.266 CNc1cccc(C(C)C)c1 Amb7760458 [2,0,0,0,0,0|1,0,0]=3 276 B11R1.266 CNc1cccc(C(C)F)c1 Amb27851752 [2,0,0,0,0,0|2,0,0]=4 277 B11R1.266 CNc1cccc(C(C)N)c1 Amb27454884 [2,0,0,0,0,0|2,0,0]=4 278 B11R1.266 CNc1cccc(C(C)O)c1 Amb27823357 [2,0,0,0,0,0|2,0,0]=4 279 B11R1.266 CNc1cccc(N(C)C)c1 Amb18933643 [2,0,0,0,0,0|2,0,0]=4 280 B11R1.266 CNc1cccc(N(C)C)c1 Amb20668194 [2,0,0,0,0,0|2,0,0]=4 281 B11R1.266 CNc1cccc([C@H](C)N)c1 Amb28282560 [2,0,0,0,0,0|2,0,0]=4 282 B11R1.266 COc1cc(C(C)C)ccn1 Amb28050828 [2,0,0,0,0,0|2,0,0]=4 283 B11R1.266 COc1cccc(C(C)Br)c1 Amb8835387 [2,0,0,0,0,0|2,0,0]=4 284 B11R1.266 COc1cccc(C(C)C)c1 Amb24105022 [2,0,0,0,0,0|1,0,0]=3 285 B11R1.266 COc1cccc(C(C)Cl)c1 Amb7766799 [2,0,0,0,0,0|2,0,0]=4 286 B11R1.266 COc1cccc(C(C)N)c1 Amb17935767 [2,0,0,0,0,0|2,0,0]=4 287 B11R1.266 COc1cccc(C(C)N)c1 Amb9703882 [2,0,0,0,0,0|2,0,0]=4 288 B11R1.266 COc1cccc(C(C)O)c1 Amb9703330 [2,0,0,0,0,0|2,0,0]=4 289 B11R1.266 COc1cccc(C(C)S)c1 Amb9208020 [2,0,0,0,0,0|2,0,0]=4 290 B11R1.266 COc1cccc(N(C)C)c1 Amb2782333 [2,0,0,0,0,0|2,0,0]=4 291 B11R1.266 COc1cccc([C@@H](C)N)c1 Amb3941455 [2,0,0,0,0,0|2,0,0]=4 292 B11R1.266 COc1cccc([C@@H](C)O)c1 Amb6893490 [2,0,0,0,0,0|2,0,0]=4 293 B11R1.266 COc1cccc([C@H](C)N)c1 Amb22406370 [2,0,0,0,0,0|2,0,0]=4 294 B11R1.266 COc1cccc([C@H](C)N)c1 Amb3939829 [2,0,0,0,0,0|2,0,0]=4 295 B11R1.266 COc1cccc([C@H](C)O)c1 Amb6893491 [2,0,0,0,0,0|2,0,0]=4 296 B11R1.266 COc1ccnc(C(C)C)c1 Amb26653867 [2,0,0,0,0,0|2,0,0]=4 297 B11R1.266 CSc1cccc(C(C)C)c1 Amb26046359 [2,0,0,0,0,0|1,0,0]=3 298 B11R1.266 CSc1cccc(C(C)Cl)c1 Amb27863413 [2,0,0,0,0,0|2,0,0]=4 299 B11R1.266 CSc1cccc(C(C)N)c1 Amb24411428 [2,0,0,0,0,0|2,0,0]=4 300 B11R1.266 CSc1cccc(C(C)O)c1 Amb24615637 [2,0,0,0,0,0|2,0,0]=4 301 B11R1.266 CSc1cccc([C@@H](C)N)c1 Amb24585701 [2,0,0,0,0,0|2,0,0]=4 302 B11R1.266 CSc1cccc([C@@H](C)O)c1 Amb33143794 [2,0,0,0,0,0|2,0,0]=4 303 B11R1.266 CSc1cccc([C@H](C)N)c1 Amb27391656 [2,0,0,0,0,0|2,0,0]=4 304 B11R1.266 CSc1cccc([C@H](C)O)c1 Amb24407454 [2,0,0,0,0,0|2,0,0]=4 305 B11R1.266 C[C@H](N)c1cccc(CO)c1 Amb27268019 [2,0,0,0,0,0|2,0,0]=4 306 B11R1.266 [C-]#[N+]c1cccc(C(C)C)c1 Amb32797446 [2,0,0,0,0,0|1,0,1]=4 307 B11R1.159 CC(=O)c1cccc(C)c1O Amb1489192 [2,0,0,0,0,0|1,0,1]=4 308 B11R1.159 CC(C)C1=CC=CN(C)C1=O Amb24648824 [2,0,0,0,0,0|1,0,1]=4 309 B11R1.159 CC(C)c1cccc(Br)c1Cl Amb27237883 [2,0,0,0,0,0|2,0,0]=4 310 B11R1.159 CC(C)c1cccc(Br)c1F Amb25342266 [2,0,0,0,0,0|2,0,0]=4 311 B11R1.159 CC(C)c1cccc(Br)c1N Amb25123892 [2,0,0,0,0,0|2,0,0]=4 312 B11R1.159 CC(C)c1cccc(Br)c1O Amb24627912 [2,0,0,0,0,0|1,0,0]=3 313 B11R1.159 CC(C)c1cccc(Cl)c1Br Amb28132848 [2,0,0,0,0,0|2,0,0]=4 314 B11R1.159 CC(C)c1cccc(Cl)c1Cl Amb25290729 [2,0,0,0,0,0|2,0,0]=4 315 B11R1.159 CC(C)c1cccc(Cl)c1F Amb32695948 [2,0,0,0,0,0|2,0,0]=4 316 B11R1.159 CC(C)c1cccc(Cl)c1N Amb28118987 [2,0,0,0,0,0|2,0,0]=4 317 B11R1.159 CC(C)c1cccc(Cl)c1O Amb26360347 [2,0,0,0,0,0|1,0,0]=3 318 B11R1.159 CC(C)c1cccc(N)c1F Amb29853824 [2,0,0,0,0,0|2,0,0]=4 319 B11R1.159 CC(C)c1cccc(O)c1Br Amb24392304 [2,0,0,0,0,0|2,0,0]=4 320 B11R1.159 CC(C)c1cccc(O)c1F Amb22228824 [2,0,0,0,0,0|2,0,0]=4 321 B11R1.159 CC(C)c1cccc(O)c1I Amb24716590 [2,0,0,0,0,0|2,0,0]=4 322 B11R1.159 CC(C)c1cccc(O)c1N Amb25892529 [2,0,0,0,0,0|2,0,0]=4 323 B11R1.159 CC(C)c1cccc(O)c1O Amb6297249 [2,0,0,0,0,0|1,0,0]=3 324 B11R1.159 CC(C)c1cccc(S)c1N Amb24126270 [2,0,0,0,0,0|2,0,0]=4 325 B11R1.159 CC(N)c1cccc(Br)c1O Amb24428631 [2,0,0,0,0,0|2,0,0]=4 326 B11R1.159 CC(N)c1cccc(Cl)c1O Amb27759386 [2,0,0,0,0,0|2,0,0]=4 327 B11R1.159 CC(N)c1cccc(F)c1O Amb25843362 [2,0,0,0,0,0|2,0,0]=4 328 B11R1.159 CC(N)c1cccc(O)c1O Amb24060514 [2,0,0,0,0,0|2,0,0]=4 329 B11R1.159 CC(O)c1cccc(O)c1O Amb27262937 [2,0,0,0,0,0|2,0,0]=4 330 B11R1.159 CN(C)c1cccc(Cl)c1O Amb27597945 [2,0,0,0,0,0|2,0,0]=4 331 B11R1.159 C[C@@H](N)c1cccc(Br)c1O Amb26607198 [2,0,0,0,0,0|2,0,0]=4 332 B11R1.159 C[C@@H](N)c1cccc(Cl)c1O Amb25680105 [2,0,0,0,0,0|2,0,0]=4 333 B11R1.159 C[C@@H](N)c1cccc(F)c1O Amb26612303 [2,0,0,0,0,0|2,0,0]=4 334 B11R1.159 C[C@@H](N)c1cccc(I)c1O Amb27860476 [2,0,0,0,0,0|2,0,0]=4 335 B11R1.159 C[C@@H](N)c1cccc(O)c1O Amb27252038 [2,0,0,0,0,0|2,0,0]=4 336 B11R1.159 C[C@@H](O)c1cccc(Br)c1O Amb33332168 [2,0,0,0,0,0|2,0,0]=4 337 B11R1.159 C[C@@H](O)c1cccc(Cl)c1O Amb33223506 [2,0,0,0,0,0|2,0,0]=4 338 B11R1.159 C[C@@H](O)c1cccc(F)c1O Amb26028488 [2,0,0,0,0,0|2,0,0]=4 339 B11R1.159 C[C@@H](O)c1cccc(O)c1O Amb26871108 [2,0,0,0,0,0|2,0,0]=4 340 B11R1.159 C[C@H](N)c1cccc(Br)c1O Amb25287359 [2,0,0,0,0,0|2,0,0]=4 341 B11R1.159 C[C@H](N)c1cccc(Cl)c1O Amb25960177 [2,0,0,0,0,0|2,0,0]=4 342 B11R1.159 C[C@H](N)c1cccc(F)c1O Amb27798227 [2,0,0,0,0,0|2,0,0]=4 343 B11R1.159 C[C@H](N)c1cccc(O)c1O Amb25887055 [2,0,0,0,0,0|2,0,0]=4 344 B11R1.159 C[C@H](N)c1cccc(S)c1O Amb28188275 [2,0,0,0,0,0|2,0,0]=4 345 B11R1.159 C[C@H](O)c1cccc(Br)c1O Amb33332224 [2,0,0,0,0,0|2,0,0]=4 346 B11R1.159 C[C@H](O)c1cccc(Cl)c1O Amb33223509 [2,0,0,0,0,0|2,0,0]=4 347 B11R1.159 C[C@H](O)c1cccc(F)c1O Amb26506408 [2,0,0,0,0,0|2,0,0]=4 348 B11R1.159 C[C@H](O)c1cccc(O)c1O Amb25860088 [2,0,0,0,0,0|2,0,0]=4 349 B11R1.159 Cc1c(Br)cccc1C(C)C Amb27635637 [2,0,0,0,0,0|2,0,0]=4 350 B11R1.159 Cc1cccc(C(C)C)c1Br Amb17339934 [2,0,0,0,0,0|1,0,0]=3 351 B11R1.159 Cc1cccc(C(C)C)c1I Amb19888199 [2,0,0,0,0,0|1,0,0]=3 352 B11R1.159 Cc1cccc(C(C)C)c1N Amb2720285 [2,0,0,0,0,0|1,0,0]=3 353 B11R1.159 Cc1cccc(C(C)C)c1N Amb35752722 [2,0,0,0,0,0|1,0,0]=3 354 B11R1.159 Cc1cccc(C(C)C)c1O Amb15692056 [2,0,0,0,0,0|0,0,0]=2 355 B11R1.159 Cc1cccc(C(C)Cl)c1C Amb22002139 [2,0,0,0,0,0|2,0,0]=4 356 B11R1.159 Cc1cccc(C(C)Cl)c1F Amb27229300 [2,0,0,0,0,0|2,0,0]=4 357 B11R1.159 Cc1cccc(C(C)N)c1Br Amb28050931 [2,0,0,0,0,0|2,0,0]=4 358 B11R1.159 Cc1cccc(C(C)N)c1C Amb17232061 [2,0,0,0,0,0|2,0,0]=4 359 B11R1.159 Cc1cccc(C(C)N)c1Cl Amb25032364 [2,0,0,0,0,0|2,0,0]=4 360 B11R1.159 Cc1cccc(C(C)N)c1F Amb24533177 [2,0,0,0,0,0|2,0,0]=4 361 B11R1.159 Cc1cccc(C(C)O)c1C Amb16231821 [2,0,0,0,0,0|2,0,0]=4 362 B11R1.159 Cc1cccc(N(C)C)c1Br Amb28280436 [2,0,0,0,0,0|2,0,0]=4 363 B11R1.159 Cc1cccc(N(C)C)c1N Amb24060498 [2,0,0,0,0,0|2,0,0]=4 364 B11R1.159 Cc1cccc(S(C)=O)c1O Amb28128362 [2,0,0,0,0,0|2,0,0]=4 365 B11R1.159 Cc1cccc([C@@H](C)N)c1C Amb27163813 [2,0,0,0,0,0|2,0,0]=4 366 B11R1.159 Cc1cccc([C@@H](C)N)c1Cl Amb27617256 [2,0,0,0,0,0|2,0,0]=4 367 B11R1.159 Cc1cccc([C@@H](C)N)c1F Amb24487774 [2,0,0,0,0,0|2,0,0]=4 368 B11R1.159 Cc1cccc([C@@H](C)N)c1N Amb28144980 [2,0,0,0,0,0|2,0,0]=4 369 B11R1.159 Cc1cccc([C@@H](C)O)c1C Amb29856727 [2,0,0,0,0,0|2,0,0]=4 370 B11R1.159 Cc1cccc([C@@H](C)O)c1F Amb25306590 [2,0,0,0,0,0|2,0,0]=4 371 B11R1.159 Cc1cccc([C@H](C)N)c1Br Amb27823366 [2,0,0,0,0,0|2,0,0]=4 372 B11R1.159 Cc1cccc([C@H](C)N)c1C Amb27253109 [2,0,0,0,0,0|2,0,0]=4 373 B11R1.159 Cc1cccc([C@H](C)N)c1Cl Amb24444712 [2,0,0,0,0,0|2,0,0]=4 374 B11R1.159 Cc1cccc([C@H](C)N)c1F Amb25151235 [2,0,0,0,0,0|2,0,0]=4 375 B11R1.159 Cc1cccc([C@H](C)N)c1I Amb27245044 [2,0,0,0,0,0|2,0,0]=4 376 B11R1.159 Cc1cccc([C@H](C)N)c1N Amb28140690 [2,0,0,0,0,0|2,0,0]=4 377 B11R1.159 Cc1cccc([C@H](C)O)c1C Amb29856726 [2,0,0,0,0,0|2,0,0]=4 378 B11R1.159 Cc1cccc([C@H](C)O)c1F Amb26943116 [2,0,0,0,0,0|2,0,0]=4 379 B11R1.159 Cc1ccnc(C(C)C)c1N Amb24641312 [2,0,0,0,0,0|2,0,0]=4 380 B11R1.159 Cc1nccc(C(C)C)c1O Amb27945772 [2,0,0,0,0,0|1,0,0]=3 381 B11R1.267 CCc1cccc(C#N)c1O Amb25234105 [2,0,0,0,0,0|1,0,1]=4 382 B11R1.267 CCc1cccc(C=O)c1O Amb17593728 [2,0,0,0,0,0|1,0,1]=4 383 B11R1.267 CCc1cccc(CBr)c1F Amb28065206 [2,0,0,0,0,0|2,0,0]=4 384 B11R1.267 CCc1cccc(CC)c1Br Amb4011053 [2,0,0,0,0,0|1,0,0]=3 385 B11R1.267 CCc1cccc(CC)c1Cl Amb24472338 [2,0,0,0,0,0|1,0,0]=3 386 B11R1.267 CCc1cccc(CC)c1F Amb4015560 [2,0,0,0,0,0|1,0,0]=3 387 B11R1.267 CCc1cccc(CC)c1I Amb19928822 [2,0,0,0,0,0|1,0,0]=3 388 B11R1.267 CCc1cccc(CC)c1N Amb19374797 [2,0,0,0,0,0|1,0,0]=3 389 B11R1.267 CCc1cccc(CC)c1N Amb2792833 [2,0,0,0,0,0|1,0,0]=3 390 B11R1.267 CCc1cccc(CC)c1O Amb6307212 [2,0,0,0,0,0|0,0,0]=2 391 B11R1.267 CCc1cccc(CC)c1S Amb26447323 [2,0,0,0,0,0|0,1,0]=3 392 B11R1.267 CCc1cccc(CCl)c1F Amb28319903 [2,0,0,0,0,0|2,0,0]=4 393 B11R1.267 CCc1cccc(CN)c1F Amb27833719 [2,0,0,0,0,0|2,0,0]=4 394 B11R1.267 CCc1cccc(CO)c1C Amb28284819 [2,0,0,0,0,0|2,0,0]=4 395 B11R1.267 CCc1cccc(CO)c1N Amb27478376 [2,0,0,0,0,0|2,0,0]=4 396 B11R1.267 CCc1cccc(CO)c1O Amb27442184 [2,0,0,0,0,0|1,0,0]=3 397 B11R1.267 CCc1cccc(CS)c1O Amb32788211 [2,0,0,0,0,0|1,0,0]=3 398 B11R1.267 CCc1cccc(OC)c1Br Amb28062415 [2,0,0,0,0,0|2,0,0]=4 399 B11R1.267 CCc1cccc(OC)c1F Amb25891837 [2,0,0,0,0,0|2,0,0]=4 400 B11R1.267 CCc1cccc(OC)c1N Amb22898780 [2,0,0,0,0,0|2,0,0]=4 401 B11R1.267 CCc1cccc(OC)c1O Amb22752195 [2,0,0,0,0,0|1,0,0]=3 402 B11R1.267 CCc1cccc(OC)c1S Amb25244465 [2,0,0,0,0,0|1,1,0]=4 403 B11R1.267 CCc1cccc(SC)c1Br Amb24334623 [2,0,0,0,0,0|2,0,0]=4 404 B11R1.267 CCc1cccc(SC)c1C Amb25249969 [2,0,0,0,0,0|2,0,0]=4 405 B11R1.267 CCc1cccc(SC)c1Cl Amb25786394 [2,0,0,0,0,0|2,0,0]=4 406 B11R1.267 CCc1cccc(SC)c1F Amb27832605 [2,0,0,0,0,0|2,0,0]=4 407 B11R1.267 CCc1cccc(SC)c1I Amb26460990 [2,0,0,0,0,0|2,0,0]=4 408 B11R1.267 CCc1cccc(SC)c1N Amb26867473 [2,0,0,0,0,0|2,0,0]=4 409 B11R1.267 CCc1cccc(SC)c1O Amb24487760 [2,0,0,0,0,0|1,0,0]=3 410 B11R1.267 CCc1cncc(CC)c1N Amb25360837 [2,0,0,0,0,0|2,0,0]=4 411 B11R1.267 COc1cccc(CBr)c1O Amb24628541 [2,0,0,0,0,0|2,0,0]=4 412 B11R1.267 COc1cccc(CCl)c1O Amb17477802 [2,0,0,0,0,0|2,0,0]=4 413 B11R1.267 COc1cccc(CN)c1O Amb1118010 [2,0,0,0,0,0|2,0,0]=4 414 B11R1.267 COc1cccc(CN)c1O Amb19260517 [2,0,0,0,0,0|2,0,0]=4 415 B11R1.267 COc1cccc(CO)c1O Amb837343 [2,0,0,0,0,0|2,0,0]=4 416 B11R1.267 COc1cccc(CS)c1O Amb32788532 [2,0,0,0,0,0|2,0,0]=4 417 B11R1.267 COc1cccc(OC)c1O Amb3939560 [2,0,0,0,0,0|2,0,0]=4 418 B11R1.267 CSc1cccc(CN)c1O Amb28365446 [2,0,0,0,0,0|2,0,0]=4 419 B11R1.267 NCc1cccc(CF)c1O Amb28251688 [2,0,0,0,0,0|2,0,0]=4 420 B11R1.267 NCc1cccc(CN)c1O Amb24687763 [2,0,0,0,0,0|2,0,0]=4 421 B11R1.267 OCc1cccc(CO)c1O Amb18125662 [2,0,0,0,0,0|2,0,0]=4 422 B11R1.267 Oc1c(CCl)cccc1CCl Amb27645459 [2,0,0,0,0,0|2,0,0]=4 423 B13R1.13 C=C(C)c1cc(C(C)C)ccc1N Amb8392391 [1,1,0,0,0,0|0,0,2]=4 424 B13R1.13 C=C(C)c1cc(C(C)C)ccc1O Amb28194556 [1,1,0,0,0,0|0,0,2]=4 425 B13R1.13 C=C(C)c1ccc(O)c(C(C)C)c1 Amb28351628 [1,1,0,0,0,0|0,0,2]=4 426 B13R1.13 CC(=O)c1cc(C(C)C)ccc1C Amb16233239 [1,1,0,0,0,0|1,0,1]=4 427 B13R1.13 CC(=O)c1cc(C(C)C)ccc1Cl Amb27953716 [1,1,0,0,0,0|1,0,1]=4 428 B13R1.13 CC(=O)c1cc(C(C)C)ccc1N Amb24578590 [1,1,0,0,0,0|1,0,1]=4 429 B13R1.13 CC(=O)c1cc(C(C)C)ccc1O Amb6298066 [1,1,0,0,0,0|1,0,1]=4 430 B13R1.13 CC(=O)c1ccc(O)c(C(C)C)c1 Amb18555071 [1,1,0,0,0,0|1,0,1]=4 431 B13R1.13 CC(C)c1cc(C(C)N)ccc1O Amb18056350 [1,1,0,0,0,0|1,0,0]=3 432 B13R1.13 CC(C)c1cc(N(C)C)ccc1O Amb27632265 [1,1,0,0,0,0|1,0,0]=3 433 B13R1.13 CC(C)c1ccc(Cl)c(C(C)C)c1 Amb27869092 [1,1,0,0,0,0|0,0,0]=2 434 B13R1.13 CC(C)c1ccc(Cl)c(C(C)N)c1 Amb27443088 [1,1,0,0,0,0|1,0,0]=3 435 B13R1.13 CC(C)c1ccc(I)c(C(C)C)c1 Amb28185975 [1,1,0,0,0,0|0,0,0]=2 436 B13R1.13 CC(C)c1ccc(N)c(C(C)C)c1 Amb1134803 [1,1,0,0,0,0|0,0,0]=2 437 B13R1.13 CC(C)c1ccc(N)c(C(C)N)c1 Amb27798181 [1,1,0,0,0,0|1,0,0]=3 438 B13R1.13 CC(C)c1ccc(O)c(C(C)C)c1 Amb22055141 [1,1,0,0,0,0|0,0,0]=2 439 B13R1.13 CC(C)c1ccc(O)c(C(C)N)c1 Amb28071026 [1,1,0,0,0,0|1,0,0]=3 440 B13R1.13 CC(C)c1ccc(O)c(C(F)F)c1 Amb27958632 [1,1,0,0,0,0|2,0,0]=4 441 B13R1.13 CC(C)c1ccc(O)c([C@@H](C)N)c1 Amb27251943 [1,1,0,0,0,0|1,0,0]=3 442 B13R1.13 CC(N)c1ccc(O)c(C(C)F)c1 Amb27438168 [1,1,0,0,0,0|2,0,0]=4 443 B13R1.13 CC(O)c1ccc(O)c(C(C)F)c1 Amb27635432 [1,1,0,0,0,0|2,0,0]=4 444 B13R1.13 Cc1ccc(C(C)C)cc1C(C)N Amb18243701 [1,1,0,0,0,0|1,0,0]=3 445 B13R1.13 Cc1ccc(C(C)C)cc1C(C)O Amb24439313 [1,1,0,0,0,0|1,0,0]=3 446 B13R1.13 Cc1ccc(N(C)C)cc1C(C)N Amb27831902 [1,1,0,0,0,0|2,0,0]=4 447 B13R1.13 Cc1ccc(N(C)C)cc1N(C)C Amb27982639 [1,1,0,0,0,0|2,0,0]=4 448 B13R1.126 CC(=O)c1cc(Br)cc(C(C)C)c1 Amb33712081 [1,1,0,0,0,0|1,0,1]=4 449 B13R1.126 CC(C)C1=CC(=O)NC(C(C)C)=N1 Amb18805047 [1,1,0,0,0,0|2,0,0]=4 450 B13R1.126 CC(C)C1=CC(=S)NC(C(C)C)=N1 Amb27206953 [1,1,0,0,0,0|2,0,0]=4 451 B13R1.126 CC(C)C1=CC(C(C)C)=NC(=S)N1 Amb35681953 [1,1,0,0,0,0|2,0,0]=4 452 B13R1.126 CC(C)c1cc(Br)cc(C(C)C)c1 Amb19888208 [1,1,0,0,0,0|0,0,0]=2 453 B13R1.126 CC(C)c1cc(Br)cc(C(C)C)n1 Amb27409366 [1,1,0,0,0,0|1,0,0]=3 454 B13R1.126 CC(C)c1cc(Br)cc(C(C)N)c1 Amb33712082 [1,1,0,0,0,0|1,0,0]=3 455 B13R1.126 CC(C)c1cc(C(C)C)nc(Br)n1 Amb24317950 [1,1,0,0,0,0|2,0,0]=4 456 B13R1.126 CC(C)c1cc(C(C)C)nc(Cl)n1 Amb24317949 [1,1,0,0,0,0|2,0,0]=4 457 B13R1.126 CC(C)c1cc(C(C)C)nc(N)n1 Amb18128526 [1,1,0,0,0,0|2,0,0]=4 458 B13R1.126 CC(C)c1cc(C(C)C)nc(O)n1 Amb24317951 [1,1,0,0,0,0|2,0,0]=4 459 B13R1.126 CC(C)c1cc(Cl)cc(C(C)C)c1 Amb19889746 [1,1,0,0,0,0|0,0,0]=2 460 B13R1.126 CC(C)c1cc(Cl)nc(C(C)C)n1 Amb9420215 [1,1,0,0,0,0|2,0,0]=4 461 B13R1.126 CC(C)c1cc(F)cc(C(C)N)c1 Amb27864405 [1,1,0,0,0,0|1,0,0]=3 462 B13R1.126 CC(C)c1cc(F)nc(C(C)C)n1 Amb35627151 [1,1,0,0,0,0|2,0,0]=4 463 B13R1.126 CC(C)c1cc(N)cc(C(C)C)c1 Amb18602733 [1,1,0,0,0,0|0,0,0]=2 464 B13R1.126 CC(C)c1cc(N)cc(N(C)C)c1 Amb27438261 [1,1,0,0,0,0|1,0,0]=3 465 B13R1.126 CC(C)c1cc(N)nc(C(C)C)n1 Amb18956915 [1,1,0,0,0,0|2,0,0]=4 466 B13R1.126 CC(C)c1cc(O)cc(C(C)C)c1 Amb13883600 [1,1,0,0,0,0|0,0,0]=2 467 B13R1.126 CC(C)c1cc(O)nc(C(C)C)c1 Amb28251763 [1,1,0,0,0,0|1,0,0]=3 468 B13R1.126 CN(C)c1cc(O)cc(N(C)C)c1 Amb26342312 [1,1,0,0,0,0|2,0,0]=4 469 B13R1.126 Cc1cc(C(C)C)cc(C(C)C)c1 Amb4016408 [1,1,0,0,0,0|0,0,0]=2 470 B13R1.345 C=C(C)c1cccc(C(C)(C)N)c1 Amb26337975 [1,1,0,0,0,0|0,0,2]=4 471 B13R1.345 CC(=O)c1cccc(C(C)(C)C)c1 Amb20171474 [1,1,0,0,0,0|1,0,1]=4 472 B13R1.345 CC(=O)c1cccc(C(C)(C)O)c1 Amb25341715 [1,1,0,0,0,0|1,0,1]=4 473 B13R1.345 CC(C)c1cccc(C(C)(C)C)n1 Amb26948713 [1,1,0,0,0,0|1,0,0]=3 474 B13R1.345 CC(C)c1cccc(C(C)(C)N)c1 Amb24370385 [1,1,0,0,0,0|0,0,0]=2 475 B13R1.345 CC(C)c1cccc(C(C)(C)O)c1 Amb26647894 [1,1,0,0,0,0|0,0,0]=2 476 B13R1.345 CC(C)c1cccc([Si](C)(C)C)c1 Amb24671177 [1,1,0,0,0,0|0,1,0]=3 477 B13R1.345 CC(C)c1ccnc(C(C)(C)N)n1 Amb18224664 [1,1,0,0,0,0|2,0,0]=4 478 B13R1.345 CC(F)c1cccc(C(C)(C)O)c1 Amb27635635 [1,1,0,0,0,0|1,0,0]=3 479 B13R1.345 CC(N)c1cc(C(C)(C)F)ccn1 Amb27842328 [1,1,0,0,0,0|2,0,0]=4 480 B13R1.345 CC(N)c1cccc(C(C)(C)C)c1 Amb24700441 [1,1,0,0,0,0|1,0,0]=3 481 B13R1.345 CC(O)c1cc(C(C)(C)C)ccn1 Amb27835901 [1,1,0,0,0,0|2,0,0]=4 482 B13R1.345 CC(O)c1cccc(C(C)(C)C)c1 Amb17594555 [1,1,0,0,0,0|1,0,0]=3 483 B13R1.345 CC(O)c1cccc(C(C)(C)O)c1 Amb27456736 [1,1,0,0,0,0|1,0,0]=3 484 B13R1.345 CN(C)c1cc(C(C)(C)C)ccn1 Amb35665058 [1,1,0,0,0,0|2,0,0]=4 485 B13R1.345 CN(C)c1cccc(C(C)(C)N)c1 Amb17106841 [1,1,0,0,0,0|1,0,0]=3 486 B13R1.345 CN(C)c1cccc(C(C)(C)O)c1 Amb2610447 [1,1,0,0,0,0|1,0,0]=3 487 B13R1.345 C[C@@H](N)c1cccc(C(C)(C)C)c1 Amb24674124 [1,1,0,0,0,0|1,0,0]=3 488 B13R1.345 C[C@@H](O)c1cccc(C(C)(C)C)c1 Amb33269890 [1,1,0,0,0,0|1,0,0]=3 489 B13R1.345 C[C@H](N)c1cccc(C(C)(C)C)c1 Amb27203303 [1,1,0,0,0,0|1,0,0]=3 490 B13R1.345 C[C@H](O)c1cccc(C(C)(C)C)c1 Amb33269889 [1,1,0,0,0,0|1,0,0]=3 491 B13R1.543 C#CC(C)c1cccc(C(C)C)c1 Amb32876498 [1,1,0,0,0,0|0,0,1]=3 492 B13R1.543 C#CC(C)c1cccc(N(C)C)c1 Amb33376252 [1,1,0,0,0,0|1,0,1]=4 493 B13R1.543 C=C(CBr)c1cccc(C(C)C)c1 Amb33005256 [1,1,0,0,0,0|0,0,2]=4 494 B13R1.543 C=C(CCl)c1cccc(C(C)C)c1 Amb33222350 [1,1,0,0,0,0|0,0,2]=4 495 B13R1.543 C=C(CN)c1cccc(C(C)C)c1 Amb32876154 [1,1,0,0,0,0|0,0,2]=4 496 B13R1.543 C=CC(O)c1cccc(C(C)C)c1 Amb33148936 [1,1,0,0,0,0|1,0,1]=4 497 B13R1.543 CC(C#N)c1cccc(N(C)C)c1 Amb27405328 [1,1,0,0,0,0|1,0,1]=4 498 B13R1.543 CC(C)c1cccc(C(=O)CCl)c1 Amb26881969 [1,1,0,0,0,0|1,0,1]=4 499 B13R1.543 CC(C)c1cccc(C(=O)CN)c1 Amb33472904 [1,1,0,0,0,0|1,0,1]=4 500 B13R1.543 CC(C)c1cccc(C(C)C#N)c1 Amb27179427 [1,1,0,0,0,0|0,0,1]=3 501 B13R1.543 CC(C)c1cccc(C(C)C=O)c1 Amb32876493 [1,1,0,0,0,0|0,0,1]=3 502 B13R1.543 CC(C)c1cccc(C(C)CBr)c1 Amb33005263 [1,1,0,0,0,0|0,0,0]=2 503 B13R1.543 CC(C)c1cccc(C(C)CN)c1 Amb33472896 [1,1,0,0,0,0|0,0,0]=2 504 B13R1.543 CC(C)c1cccc(C(C)CO)c1 Amb26489373 [1,1,0,0,0,0|0,0,0]=2 505 B13R1.543 CC(C)c1cccc(C(C)NN)c1 Amb35637577 [1,1,0,0,0,0|1,0,0]=3 506 B13R1.543 CC(C)c1cccc(C(C)ON)c1 Amb32876505 [1,1,0,0,0,0|1,0,0]=3 507 B13R1.543 CC(C)c1cccc(C(F)CN)c1 Amb32877667 [1,1,0,0,0,0|1,0,0]=3 508 B13R1.543 CC(C)c1cccc(C(N)CO)c1 Amb27596578 [1,1,0,0,0,0|1,0,0]=3 509 B13R1.543 CC(C)c1cccc(C(O)C=O)c1 Amb35641852 [1,1,0,0,0,0|1,0,1]=4 510 B13R1.543 CC(C)c1cccc(C(O)CBr)c1 Amb33005242 [1,1,0,0,0,0|1,0,0]=3 511 B13R1.543 CC(C)c1cccc(C(O)CCl)c1 Amb33222348 [1,1,0,0,0,0|1,0,0]=3 512 B13R1.543 CC(C)c1cccc(C(O)CF)c1 Amb32876159 [1,1,0,0,0,0|1,0,0]=3 513 B13R1.543 CC(C)c1cccc(C(O)CN)c1 Amb33472899 [1,1,0,0,0,0|1,0,0]=3 514 B13R1.543 CC(C)c1cccc(C(O)CO)c1 Amb32876160 [1,1,0,0,0,0|1,0,0]=3 515 B13R1.543 CC(C)c1cccc([C@@H](C)CN)c1 Amb33729618 [1,1,0,0,0,0|0,0,0]=2 516 B13R1.543 CC(C)c1cccc([C@@H](C)CO)c1 Amb33738960 [1,1,0,0,0,0|0,0,0]=2 517 B13R1.543 CC(C)c1cccc([C@@H](N)CO)c1 Amb25702737 [1,1,0,0,0,0|1,0,0]=3 518 B13R1.543 CC(C)c1cccc([C@@H](O)CN)c1 Amb32876840 [1,1,0,0,0,0|1,0,0]=3 519 B13R1.543 CC(C)c1cccc([C@H](C)CN)c1 Amb33742831 [1,1,0,0,0,0|0,0,0]=2 520 B13R1.543 CC(C)c1cccc([C@H](C)CO)c1 Amb33748174 [1,1,0,0,0,0|0,0,0]=2 521 B13R1.543 CC(C)c1cccc([C@H](N)C#N)c1 Amb28118540 [1,1,0,0,0,0|1,0,1]=4 522 B13R1.543 CC(C)c1cccc([C@H](N)CO)c1 Amb26356904 [1,1,0,0,0,0|1,0,0]=3 523 B13R1.543 CC(C)c1cccc([C@H](O)CN)c1 Amb32876512 [1,1,0,0,0,0|1,0,0]=3 524 B13R1.543 CC(C)c1ccnc(C(C)CN)n1 Amb27949721 [1,1,0,0,0,0|2,0,0]=4 525 B13R1.543 CC(C=O)c1cccc(N(C)C)c1 Amb33376247 [1,1,0,0,0,0|1,0,1]=4 526 B13R1.543 CC(CBr)c1cccc(N(C)C)c1 Amb33387060 [1,1,0,0,0,0|1,0,0]=3 527 B13R1.543 CC(CN)c1cccc(C(F)F)c1 Amb27872690 [1,1,0,0,0,0|2,0,0]=4 528 B13R1.543 CC(CN)c1cccc(N(C)C)c1 Amb17321739 [1,1,0,0,0,0|1,0,0]=3 529 B13R1.543 CC(CO)c1cccc(C(F)F)c1 Amb33749208 [1,1,0,0,0,0|2,0,0]=4 530 B13R1.543 CC(F)c1cccc(C(C)CN)c1 Amb27229277 [1,1,0,0,0,0|1,0,0]=3 531 B13R1.543 CC(NN)c1cccc(N(C)C)c1 Amb27882713 [1,1,0,0,0,0|2,0,0]=4 532 B13R1.543 CC(ON)c1cccc(N(C)C)c1 Amb33376278 [1,1,0,0,0,0|2,0,0]=4 533 B13R1.543 CCC(=O)c1cccc(C(C)C)c1 Amb27170995 [1,1,0,0,0,0|1,0,1]=4 534 B13R1.543 CCC(C)c1cccc(C(C)O)n1 Amb27415351 [1,1,0,0,0,0|2,0,0]=4 535 B13R1.543 CCC(Cl)c1cccc(C(C)C)c1 Amb35648671 [1,1,0,0,0,0|1,0,0]=3 536 B13R1.543 CCC(N)c1cccc(C(C)C)c1 Amb24702001 [1,1,0,0,0,0|1,0,0]=3 537 B13R1.543 CCC(N)c1cccc(N(C)C)c1 Amb27259060 [1,1,0,0,0,0|2,0,0]=4 538 B13R1.543 CCC(O)c1cccc(C(C)C)c1 Amb24453677 [1,1,0,0,0,0|1,0,0]=3 539 B13R1.543 CC[C@H](N)c1cccc(N(C)C)c1 Amb28423394 [1,1,0,0,0,0|2,0,0]=4 540 B13R1.543 CN(C)c1cccc(C(F)CN)c1 Amb33376292 [1,1,0,0,0,0|2,0,0]=4 541 B13R1.543 CN(C)c1cccc(C(N)CO)c1 Amb25757388 [1,1,0,0,0,0|2,0,0]=4 542 B13R1.543 CN(C)c1cccc(C(O)CBr)c1 Amb33387064 [1,1,0,0,0,0|2,0,0]=4 543 B13R1.543 CN(C)c1cccc(C(O)CCl)c1 Amb25779180 [1,1,0,0,0,0|2,0,0]=4 544 B13R1.543 CN(C)c1cccc(C(O)CF)c1 Amb33376234 [1,1,0,0,0,0|2,0,0]=4 545 B13R1.543 CN(C)c1cccc(C(O)CN)c1 Amb27950046 [1,1,0,0,0,0|2,0,0]=4 546 B13R1.543 CN(C)c1cccc(C(O)CO)c1 Amb33376246 [1,1,0,0,0,0|2,0,0]=4 547 B13R1.543 CN(C)c1cccc([C@@H](N)CO)c1 Amb26944785 [1,1,0,0,0,0|2,0,0]=4 548 B13R1.543 CN(C)c1cccc([C@@H](O)CN)c1 Amb33376291 [1,1,0,0,0,0|2,0,0]=4 549 B13R1.543 CN(C)c1cccc([C@H](N)CN)c1 Amb27490769 [1,1,0,0,0,0|2,0,0]=4 550 B13R1.543 CN(C)c1cccc([C@H](N)CO)c1 Amb28461115 [1,1,0,0,0,0|2,0,0]=4 551 B13R1.543 CN(C)c1cccc([C@H](O)CN)c1 Amb33376290 [1,1,0,0,0,0|2,0,0]=4 552 B13R1.543 CNC(C)c1cc(N(C)C)ccn1 Amb27791910 [1,1,0,0,0,0|2,0,0]=4 553 B13R1.543 CNC(C)c1cccc(C(C)C)c1 Amb28242110 [1,1,0,0,0,0|0,0,0]=2 554 B13R1.543 CNC(C)c1cccc(N(C)C)n1 Amb35726051 [1,1,0,0,0,0|2,0,0]=4 555 B13R1.543 CNC(C)c1ccnc(C(C)C)n1 Amb27588693 [1,1,0,0,0,0|2,0,0]=4 556 B13R1.543 CNC(C)c1cncc(C(C)C)c1 Amb35702521 [1,1,0,0,0,0|1,0,0]=3 557 B13R1.543 CN[C@H](C)c1cccc(C(C)=O)c1 Amb28313791 [1,1,0,0,0,0|1,0,1]=4 558 B13R1.543 CN[C@H](C)c1cccc(C(F)F)c1 Amb28243660 [1,1,0,0,0,0|2,0,0]=4 559 B13R1.543 COC(=O)c1cccc(C(C)C)c1 Amb24454839 [1,1,0,0,0,0|1,0,1]=4 560 B13R1.543 C[C@@H](CN)c1cccc(C(F)F)c1 Amb33744956 [1,1,0,0,0,0|2,0,0]=4 561 B13R1.543 C[C@@H](CO)c1cccc(C(F)F)c1 Amb33747118 [1,1,0,0,0,0|2,0,0]=4 562 B13R1.543 C[C@H](CN)c1cccc(C(F)F)c1 Amb33748012 [1,1,0,0,0,0|2,0,0]=4 563 B13R1.543 C[C@H](CO)c1cccc(C(F)F)c1 Amb33744399 [1,1,0,0,0,0|2,0,0]=4 564 B13R1.543 [C-]#[N+]C(C)c1cccc(C(C)C)c1 Amb32876519 [1,1,0,0,0,0|0,0,1]=3 565 B13R1.543 [C-]#[N+]C(C)c1cccc(N(C)C)c1 Amb33376298 [1,1,0,0,0,0|1,0,1]=4 566 B13R1.82 C#CC(C)c1cccc(OC)c1O Amb33426290 [1,1,0,0,0,0|1,0,1]=4 567 B13R1.82 C=CC(C)c1cccc(CC)c1N Amb27831349 [1,1,0,0,0,0|1,0,1]=4 568 B13R1.82 C=CC(N)c1cccc(CC)c1O Amb27876192 [1,1,0,0,0,0|1,0,1]=4 569 B13R1.82 C=C[C@H](N)c1cccc(CC)c1O Amb27627410 [1,1,0,0,0,0|1,0,1]=4 570 B13R1.82 CCC(=O)c1cccc(CC)c1O Amb17233427 [1,1,0,0,0,0|1,0,1]=4 571 B13R1.82 CCC(N)c1cccc(OC)c1O Amb27876110 [1,1,0,0,0,0|2,0,0]=4 572 B13R1.82 CCC(N)c1cccc(SC)c1O Amb27875169 [1,1,0,0,0,0|2,0,0]=4 573 B13R1.82 CC[C@H](N)c1cccc(OC)c1O Amb28128827 [1,1,0,0,0,0|2,0,0]=4 574 B13R1.82 CCc1cccc(C(=O)OC)c1O Amb22749470 [1,1,0,0,0,0|1,0,1]=4 575 B13R1.82 CCc1cccc(C(C)CC)c1N Amb4020858 [1,1,0,0,0,0|1,0,0]=3 576 B13R1.82 CCc1cccc(C(C)CC)c1O Amb28381203 [1,1,0,0,0,0|0,0,0]=2 577 B13R1.82 CCc1cccc(C(N)C#N)c1O Amb28410795 [1,1,0,0,0,0|1,0,1]=4 578 B13R1.82 CCc1cccc(C(N)CC)c1O Amb27587075 [1,1,0,0,0,0|1,0,0]=3 579 B13R1.82 CCc1cccc([C@@H](N)CC)c1O Amb27404937 [1,1,0,0,0,0|1,0,0]=3 580 B13R1.82 CCc1cccc([C@@H](N)CF)c1O Amb27162362 [1,1,0,0,0,0|1,0,0]=3 581 B13R1.82 CCc1cccc([C@H](N)CF)c1O Amb28341598 [1,1,0,0,0,0|1,0,0]=3 582 B13R1.82 CCc1cccc([C@H](N)CO)c1O Amb27404770 [1,1,0,0,0,0|1,0,0]=3 583 B13R1.82 CNC(C)c1cccc(OC)c1C Amb35604069 [1,1,0,0,0,0|2,0,0]=4 584 B13R1.82 CNC(C)c1cccc(OC)c1F Amb27635821 [1,1,0,0,0,0|2,0,0]=4 585 B13R1.82 CNC(C)c1cccc(SC)c1O Amb28121929 [1,1,0,0,0,0|1,0,0]=3 586 B13R1.82 COc1cccc(C(C)C#N)c1O Amb33428495 [1,1,0,0,0,0|1,0,1]=4 587 B13R1.82 COc1cccc(C(C)C=O)c1O Amb33427399 [1,1,0,0,0,0|1,0,1]=4 588 B13R1.82 COc1cccc(C(C)CBr)c1C Amb33007189 [1,1,0,0,0,0|2,0,0]=4 589 B13R1.82 COc1cccc(C(C)CBr)c1O Amb33331934 [1,1,0,0,0,0|1,0,0]=3 590 B13R1.82 COc1cccc(C(C)CN)c1Br Amb27759787 [1,1,0,0,0,0|2,0,0]=4 591 B13R1.82 COc1cccc(C(C)CN)c1C Amb24555487 [1,1,0,0,0,0|2,0,0]=4 592 B13R1.82 COc1cccc(C(C)CN)c1Cl Amb25952501 [1,1,0,0,0,0|2,0,0]=4 593 B13R1.82 COc1cccc(C(C)CN)c1F Amb24492014 [1,1,0,0,0,0|2,0,0]=4 594 B13R1.82 COc1cccc(C(C)CN)c1O Amb33372441 [1,1,0,0,0,0|1,0,0]=3 595 B13R1.82 COc1cccc(C(C)ON)c1O Amb33426303 [1,1,0,0,0,0|2,0,0]=4 596 B13R1.82 COc1cccc(C(F)CN)c1O Amb24511526 [1,1,0,0,0,0|2,0,0]=4 597 B13R1.82 COc1cccc(C(N)CO)c1O Amb27491466 [1,1,0,0,0,0|2,0,0]=4 598 B13R1.82 COc1cccc(C(O)CBr)c1O Amb33331940 [1,1,0,0,0,0|2,0,0]=4 599 B13R1.82 COc1cccc(C(O)CF)c1O Amb33426285 [1,1,0,0,0,0|2,0,0]=4 600 B13R1.82 COc1cccc(C(O)CO)c1O Amb33426286 [1,1,0,0,0,0|2,0,0]=4 601 B13R1.82 COc1cccc([C@@H](C)NO)c1O Amb27648971 [1,1,0,0,0,0|2,0,0]=4 602 B13R1.82 COc1cccc([C@@H](N)CO)c1O Amb25326365 [1,1,0,0,0,0|2,0,0]=4 603 B13R1.82 COc1cccc([C@@H](O)CN)c1O Amb33426317 [1,1,0,0,0,0|2,0,0]=4 604 B13R1.82 COc1cccc([C@H](N)CO)c1O Amb25327553 [1,1,0,0,0,0|2,0,0]=4 605 B13R1.82 COc1cccc([C@H](O)CN)c1O Amb33426316 [1,1,0,0,0,0|2,0,0]=4 606 B13R1.82 CSc1cccc(C(N)CO)c1O Amb27828063 [1,1,0,0,0,0|2,0,0]=4 607 B13R1.82 NC[C@H](N)c1cccc(CO)c1O Amb28342117 [1,1,0,0,0,0|2,0,0]=4 608 B13R1.299 CC(C)c1cc(Br)cc(C=O)c1O Amb25223660 [1,1,0,0,0,0|1,0,1]=4 609 B13R1.299 CC(C)c1cc(Cl)cc(C#N)c1O Amb18056372 [1,1,0,0,0,0|1,0,1]=4 610 B13R1.299 CC(C)c1cc(Cl)cc(C=O)c1O Amb27225148 [1,1,0,0,0,0|1,0,1]=4 611 B13R1.299 CCc1cc(Br)cc(C(C)=O)c1O Amb18135965 [1,1,0,0,0,0|1,0,1]=4 612 B13R1.299 COc1cc(Br)cc(C(C)N)c1O Amb25305667 [1,1,0,0,0,0|2,0,0]=4 613 B13R1.299 COc1cc(Br)cc([C@@H](C)N)c1O Amb27618206 [1,1,0,0,0,0|2,0,0]=4 614 B13R1.299 COc1cc(Br)cc([C@@H](C)O)c1O Amb33005327 [1,1,0,0,0,0|2,0,0]=4 615 B13R1.299 COc1cc(Br)cc([C@H](C)N)c1O Amb27647557 [1,1,0,0,0,0|2,0,0]=4 616 B13R1.299 COc1cc(Br)cc([C@H](C)O)c1O Amb33005332 [1,1,0,0,0,0|2,0,0]=4 617 B13R1.299 COc1cc(C)cc(C(C)N)c1O Amb27876348 [1,1,0,0,0,0|2,0,0]=4 618 B13R1.299 COc1cc(Cl)cc(C(C)N)c1O Amb33192036 [1,1,0,0,0,0|2,0,0]=4 619 B13R1.299 COc1cc(Cl)cc([C@@H](C)N)c1O Amb33258258 [1,1,0,0,0,0|2,0,0]=4 620 B13R1.299 COc1cc(Cl)cc([C@@H](C)O)c1O Amb33258265 [1,1,0,0,0,0|2,0,0]=4 621 B13R1.299 COc1cc(Cl)cc([C@H](C)N)c1O Amb33258260 [1,1,0,0,0,0|2,0,0]=4 622 B13R1.299 COc1cc(Cl)cc([C@H](C)O)c1O Amb33258266 [1,1,0,0,0,0|2,0,0]=4 623 B13R1.299 COc1cc(F)cc(C(C)N)c1O Amb27646575 [1,1,0,0,0,0|2,0,0]=4 624 B13R1.299 COc1cc(F)cc([C@@H](C)N)c1O Amb27602186 [1,1,0,0,0,0|2,0,0]=4 625 B13R1.299 COc1cc(F)cc([C@H](C)N)c1O Amb27187179 [1,1,0,0,0,0|2,0,0]=4 626 B13R1.299 COc1cc(I)cc(C(C)N)c1O Amb28194330 [1,1,0,0,0,0|2,0,0]=4 627 B13R1.299 COc1cc(I)cc([C@H](C)N)c1O Amb27180790 [1,1,0,0,0,0|2,0,0]=4 628 B13R1.299 C[C@@H](N)c1cc(Cl)cc(CO)c1O Amb27401017 [1,1,0,0,0,0|2,0,0]=4 629 B13R1.377 C=CCc1cccc(C(C)C)c1N Amb24106005 [1,1,0,0,0,0|1,0,1]=4 630 B13R1.377 CC(C)c1ccnc(CCO)c1N Amb35744843 [1,1,0,0,0,0|2,0,0]=4 631 B13R1.377 CC(F)c1cccc(CCN)c1O Amb27791333 [1,1,0,0,0,0|1,0,0]=3 632 B13R1.377 CCCc1cccc(C(C)=O)c1O Amb28321930 [1,1,0,0,0,0|1,0,1]=4 633 B13R1.377 CCCc1cccc(C(C)C)c1N Amb27393661 [1,1,0,0,0,0|1,0,0]=3 634 B13R1.377 CCCc1cccc(C(C)C)c1O Amb17616276 [1,1,0,0,0,0|0,0,0]=2 635 B13R1.377 CCOc1cccc(C(C)=O)c1O Amb25157242 [1,1,0,0,0,0|1,0,1]=4 636 B13R1.377 CCOc1cccc(C(C)N)c1O Amb24356721 [1,1,0,0,0,0|1,0,0]=3 637 B13R1.377 CCOc1cccc(C(C)O)c1O Amb28293017 [1,1,0,0,0,0|1,0,0]=3 638 B13R1.377 CCOc1cccc([C@@H](C)N)c1O Amb25800390 [1,1,0,0,0,0|1,0,0]=3 639 B13R1.377 CCOc1cccc([C@@H](C)O)c1O Amb26330710 [1,1,0,0,0,0|1,0,0]=3 640 B13R1.377 CCOc1cccc([C@H](C)N)c1O Amb26958494 [1,1,0,0,0,0|1,0,0]=3 641 B13R1.377 CCOc1cccc([C@H](C)O)c1O Amb25896034 [1,1,0,0,0,0|1,0,0]=3 642 B13R1.377 CN(C)c1cccc(CCN)c1I Amb28280193 [1,1,0,0,0,0|2,0,0]=4 643 B13R1.377 CNCc1cccc(C(C)F)c1O Amb27199823 [1,1,0,0,0,0|1,0,0]=3 644 B13R1.377 CNCc1cccc(C(F)F)c1O Amb27208517 [1,1,0,0,0,0|2,0,0]=4 645 B13R1.645 C=Cc1cccc(C(C)(C)C)c1O Amb27486150 [1,1,0,0,0,0|0,0,2]=4 646 B13R1.645 CC(C)(C)c1cccc(C#N)c1O Amb22756203 [1,1,0,0,0,0|1,0,1]=4 647 B13R1.645 CC(C)(C)c1cccc(C=O)c1O Amb10071377 [1,1,0,0,0,0|1,0,1]=4 648 B13R1.645 CC(C)(C)c1cccc(CO)c1O Amb18128724 [1,1,0,0,0,0|1,0,0]=3 649 B13R1.645 CCc1cccc(C(C)(C)C)c1N Amb8439200 [1,1,0,0,0,0|1,0,0]=3 650 B13R1.645 CCc1cccc(C(F)(F)F)c1O Amb27954642 [1,1,0,0,0,0|2,0,0]=4 651 B13R1.645 CNc1cccc(C(C)(C)F)c1O Amb28129594 [1,1,0,0,0,0|1,0,0]=3 652 B13R1.645 COc1cccc(C(C)(C)C)c1O Amb28249979 [1,1,0,0,0,0|1,0,0]=3 653 B13R1.645 COc1cccc(C(C)(C)N)c1Br Amb25923446 [1,1,0,0,0,0|2,0,0]=4 654 B13R1.645 COc1cccc(C(C)(C)N)c1C Amb27970236 [1,1,0,0,0,0|2,0,0]=4 655 B13R1.645 COc1cccc(C(C)(C)N)c1Cl Amb26862246 [1,1,0,0,0,0|2,0,0]=4 656 B13R1.645 COc1cccc(C(C)(C)N)c1O Amb33372460 [1,1,0,0,0,0|1,0,0]=3 657 B13R1.645 COc1cccc(C(C)(C)O)c1Br Amb33387111 [1,1,0,0,0,0|2,0,0]=4 658 B13R1.645 COc1cccc(C(C)(C)O)c1C Amb25911105 [1,1,0,0,0,0|2,0,0]=4 659 B13R1.645 COc1cccc(C(C)(C)O)c1O Amb26853194 [1,1,0,0,0,0|1,0,0]=3 660 B13R1.2137 CCc1cccc(C(C)=O)c1OC Amb28386619 [1,1,0,0,0,0|1,0,1]=4 661 B13R1.2137 CCc1cccc(C(C)N)c1CC Amb28042416 [1,1,0,0,0,0|2,0,0]=4 662 B13R1.2137 CNc1cccc(C(C)F)c1OC Amb28062455 [1,1,0,0,0,0|2,0,0]=4 663 B13R1.2137 COc1c(CF)cccc1C(C)N Amb27199821 [1,1,0,0,0,0|2,0,0]=4 664 B13R1.2137 COc1c(CO)cccc1C(C)F Amb28434810 [1,1,0,0,0,0|2,0,0]=4 665 B13R1.2137 COc1cccc(C(C)C)c1OC Amb3994518 [1,1,0,0,0,0|1,0,0]=3 666 B13R1.2137 COc1cccc(C(C)N)c1OC Amb18193137 [1,1,0,0,0,0|2,0,0]=4 667 B13R1.2137 COc1cccc(C(C)O)c1OC Amb27478899 [1,1,0,0,0,0|2,0,0]=4 668 B13R1.2137 COc1cccc([C@@H](C)N)c1OC Amb25992466 [1,1,0,0,0,0|2,0,0]=4 669 B13R1.2137 COc1cccc([C@@H](C)O)c1OC Amb24658655 [1,1,0,0,0,0|2,0,0]=4 670 B13R1.2137 COc1cccc([C@H](C)N)c1OC Amb27391580 [1,1,0,0,0,0|2,0,0]=4 671 B13R1.2137 COc1cccc([C@H](C)O)c1OC Amb26840536 [1,1,0,0,0,0|2,0,0]=4 672 B13R1.3097 CC(C)c1c(O)ccc(C=O)c1O Amb27481013 [1,1,0,0,0,0|1,0,1]=4 673 B13R1.3097 COc1ccc(Br)c([C@@H](C)N)c1O Amb27585555 [1,1,0,0,0,0|2,0,0]=4 674 B13R1.3097 COc1ccc(F)c([C@H](C)N)c1O Amb27470112 [1,1,0,0,0,0|2,0,0]=4 675 B13R1.3230 COc1c(F)ccc(C(C)O)c1O Amb28132930 [1,1,0,0,0,0|2,0,0]=4 676 B13R1.3230 Cc1ccc(C(C)C)c(O)c1C=O Amb17594542 [1,1,0,0,0,0|1,0,1]=4 677 B15R1.23438 CC(C)C(=O)c1cccc(C(C)C)c1O Amb17238990 [0,1,0,0,0,1|0,0,0]=2 678 B15R1.7297 CC(C)c1cccc(C(C)C)c1N=C=O Amb2722504 [0,2,0,0,0,0|0,0,1]=3 679 B15R1.7297 CC(C)c1cccc(C(C)C)c1N=C=S Amb6860880 [0,2,0,0,0,0|0,1,0]=3 680 B15R1.9046 CC(C)c1cccc(C(C)C)c1B(O)O Amb22169591 [0,2,0,0,0,0|0,0,0]=2 681 B15R1.9046 CC(C)c1cccc(C(C)C)c1C(=O)O Amb8439167 [0,2,0,0,0,0|0,0,0]=2 682 B15R1.9046 CC(C)c1cccc(C(C)C)c1N(C)C Amb6357126 [0,2,0,0,0,0|1,0,0]=3 683 B15R1.21567 COc1c(C(C)C)cc(N)cc1C(C)C Amb2693588 [0,2,0,0,0,0|0,0,0]=2 684 B15R1.21567 COc1c(C(C)C)cc(N)cc1C(C)C Amb3439589 [0,2,0,0,0,0|0,0,0]=2 685 B15R1.801 CCCC(=O)c1cccc(C(C)C)c1O Amb17238991 [0,2,0,0,0,0|1,0,1]=4 686 B15R1.38476 CCC(=O)c1cc(Br)cc(C(C)C)c1O Amb28079399 [0,2,0,0,0,0|1,0,1]=4 687 B15R1.38476 CCC(N)c1cc(Br)cc(C(C)C)c1O Amb33192104 [0,2,0,0,0,0|1,0,0]=3 688 B15R1.688 CC(C)c1cc(C=O)cc(C(C)C)c1O Amb7102707 [0,2,0,0,0,0|0,0,0]=2 689 B15R1.3544 CC(=O)c1cc(C)cc(C(C)(C)C)c1O Amb27436124 [0,2,0,0,0,0|1,0,1]=4 690 B15R1.3544 Cc1cc(C(C)N)c(O)c(C(C)(C)C)c1 Amb18556298 [0,2,0,0,0,0|1,0,0]=3 691 B15R1.3544 Cc1cc(C(C)O)c(O)c(C(C)(C)C)c1 Amb18057705 [0,2,0,0,0,0|1,0,0]=3 692 B15R1.25705 CC(C)(C)c1cccc(C(C)(C)C)c1N Amb24308957 [0,2,0,0,0,0|1,0,0]=3 693 B15R1.25705 CC(C)(C)c1cccc(C(C)(C)C)c1O Amb264318 [0,2,0,0,0,0|0,0,0]=2 694 B13R1.585 CC(C)Nc1ccc(C(C)C)cc1 Amb6692931 [0,0,1,1,0,0|2,0,0]=4 695 B13R1.585 CC(C)Sc1ccc(C(C)C)cc1 Amb26533731 [0,0,1,1,0,0|2,0,0]=4 696 B13R1.1985 CC(C)\C=C\c1nc(C(C)C)no1 Amb28188021 [0,0,1,1,0,0|2,0,0]=4 697 B13R1.589 CC(C)Nc1ccccc1C(C)C Amb6691171 [0,0,1,1,0,0|2,0,0]=4 698 B13R1.589 CC(C)Oc1ccccc1C(C)C Amb22055578 [0,0,1,1,0,0|2,0,0]=4 699 B13R2.429 CC(=O)c1cccc(C2CC2)c1 Amb9768843 [1,0,0,1,0,0|1,0,1]=4 700 B13R2.429 CC(C)c1cccc(C2CC2)c1 Amb26045657 [1,0,0,1,0,0|0,0,0]=2 701 B13R2.429 CC(C)c1cccc(C2CO2)c1 Amb33148954 [1,0,0,1,0,0|1,0,0]=3 702 B13R2.429 CC(C)c1cccc([C@@H]2CO2)c1 Amb32874599 [1,0,0,1,0,0|1,0,0]=3 703 B13R2.429 CC(C)c1cccc([C@H]2CO2)c1 Amb32874600 [1,0,0,1,0,0|1,0,0]=3 704 B13R2.429 CC(N)c1cccc(C2CC2)c1 Amb18963843 [1,0,0,1,0,0|1,0,0]=3 705 B13R2.429 CC(N)c1cccc(C2CC2)n1 Amb27471092 [1,0,0,1,0,0|2,0,0]=4 706 B13R2.429 CC(N)c1cncc(C2CC2)c1 Amb35676748 [1,0,0,1,0,0|2,0,0]=4 707 B13R2.429 CN(C)c1cccc(C2CO2)c1 Amb25857937 [1,0,0,1,0,0|2,0,0]=4 708 B13R2.429 CN(C)c1cccc([C@@H]2CO2)c1 Amb33375874 [1,0,0,1,0,0|2,0,0]=4 709 B13R2.429 CN(C)c1cccc([C@H]2CO2)c1 Amb33375875 [1,0,0,1,0,0|2,0,0]=4 710 B13R2.429 C[C@@H](N)c1cccc(C2CC2)c1 Amb33448694 [1,0,0,1,0,0|1,0,0]=3 711 B13R2.429 C[C@@H](O)c1cccc(C2CC2)c1 Amb33341134 [1,0,0,1,0,0|1,0,0]=3 712 B13R2.429 C[C@H](N)c1cccc(C2CC2)c1 Amb27436622 [1,0,0,1,0,0|1,0,0]=3 713 B13R2.429 C[C@H](O)c1cccc(C2CC2)c1 Amb33341133 [1,0,0,1,0,0|1,0,0]=3 714 B13R2.12979 CC(C)c1ccc2c(c1)C(=O)C2 Amb25720632 [1,0,0,1,0,0|1,0,1]=4 715 B13R2.82 Cc1c(CO)cccc1C2CC2 Amb27662442 [1,0,0,1,0,0|2,0,0]=4 716 B13R2.573 CC1COc2c(C=O)cccc21 Amb28199823 [1,0,0,1,0,0|1,0,1]=4 717 B13R2.573 CCc1cccc2c1CCC2N Amb18947409 [1,0,0,1,0,0|2,0,0]=4 718 B13R2.573 CCc1cccc2c1CN[C@H]2C Amb27600217 [1,0,0,1,0,0|2,0,0]=4 719 B13R2.573 CCc1cccc2c1NCC2C Amb17040663 [1,0,0,1,0,0|1,0,0]=3 720 B13R2.573 CCc1cccc2c1OC[C@H]2N Amb27175650 [1,0,0,1,0,0|1,0,0]=3 721 B13R2.573 COc1cccc2c1NCC2C Amb17040669 [1,0,0,1,0,0|2,0,0]=4 722 B13R2.573 COc1cccc2c1OCC2N Amb22586314 [1,0,0,1,0,0|2,0,0]=4 723 B13R2.573 COc1cccc2c1OCC2N Amb9735892 [1,0,0,1,0,0|2,0,0]=4 724 B13R2.573 COc1cccc2c1OC[C@@H]2N Amb28122892 [1,0,0,1,0,0|2,0,0]=4 725 B13R2.573 COc1cccc2c1OC[C@H]2N Amb26641982 [1,0,0,1,0,0|2,0,0]=4 726 B13R2.5569 CC(=O)c1cccc2c1OCC2 Amb10603301 [1,0,0,1,0,0|1,0,1]=4 727 B13R2.5569 CC(C)c1cccc2c1C=CC2 Amb24488648 [1,0,0,1,0,0|1,0,1]=4 728 B13R2.5569 CC(C)c1cccc2c1CCN2 Amb28058191 [1,0,0,1,0,0|2,0,0]=4 729 B13R2.5569 CC(C)c1cccc2c1CCO2 Amb28127128 [1,0,0,1,0,0|2,0,0]=4 730 B13R2.5569 CC(C)c1cccc2c1CNC2 Amb27967344 [1,0,0,1,0,0|2,0,0]=4 731 B13R2.5569 CC(C)c1cccc2c1NCC2 Amb1140185 [1,0,0,1,0,0|1,0,0]=3 732 B13R2.5569 CC(C)c1cccc2c1OCO2 Amb27199386 [1,0,0,1,0,0|1,0,0]=3 733 B13R2.5569 CC(C)c1cccc2ccoc12 Amb27831319 [1,0,0,1,0,0|0,0,2]=4 734 B13R2.5569 CC(C)c1cccc2ncoc12 Amb17570043 [1,0,0,1,0,0|1,0,1]=4 735 B13R2.5569 CC(C)c1cccc2oboc12 Amb22168988 [1,0,0,1,0,0|2,0,0]=4 736 B13R2.5569 CC(Cl)c1cccc2c1OCC2 Amb28347920 [1,0,0,1,0,0|1,0,0]=3 737 B13R2.5569 CC(N)c1cccc2c1CCC2 Amb27875579 [1,0,0,1,0,0|2,0,0]=4 738 B13R2.5569 CC(N)c1cccc2c1OCC2 Amb18829260 [1,0,0,1,0,0|1,0,0]=3 739 B13R2.5569 CC(N)c1cccc2c1OCO2 Amb27817842 [1,0,0,1,0,0|2,0,0]=4 740 B13R2.5569 CC(O)c1cccc2c1OCO2 Amb24080203 [1,0,0,1,0,0|2,0,0]=4 741 B13R2.5569 C[C@@H](N)c1cccc2c1CCC2 Amb24433378 [1,0,0,1,0,0|2,0,0]=4 742 B13R2.5569 C[C@@H](N)c1cccc2c1OCC2 Amb27785373 [1,0,0,1,0,0|1,0,0]=3 743 B13R2.5569 C[C@@H](N)c1cccc2c1OCO2 Amb24643388 [1,0,0,1,0,0|2,0,0]=4 744 B13R2.5569 C[C@@H](O)c1cccc2c1CCC2 Amb33147489 [1,0,0,1,0,0|2,0,0]=4 745 B13R2.5569 C[C@@H](O)c1cccc2c1OCC2 Amb33318874 [1,0,0,1,0,0|1,0,0]=3 746 B13R2.5569 C[C@@H](O)c1cccc2c1OCO2 Amb27835916 [1,0,0,1,0,0|2,0,0]=4 747 B13R2.5569 C[C@H](N)c1cccc2c1CCC2 Amb25087857 [1,0,0,1,0,0|2,0,0]=4 748 B13R2.5569 C[C@H](N)c1cccc2c1NCC2 Amb27168674 [1,0,0,1,0,0|2,0,0]=4 749 B13R2.5569 C[C@H](N)c1cccc2c1OCC2 Amb27832222 [1,0,0,1,0,0|1,0,0]=3 750 B13R2.5569 C[C@H](N)c1cccc2c1OCO2 Amb27663771 [1,0,0,1,0,0|2,0,0]=4 751 B13R2.5569 C[C@H](O)c1cccc2c1CCC2 Amb33147487 [1,0,0,1,0,0|2,0,0]=4 752 B13R2.5569 C[C@H](O)c1cccc2c1OCC2 Amb33318873 [1,0,0,1,0,0|1,0,0]=3 753 B13R2.5569 FC(F)c1cccc2c1OCC2 Amb27646932 [1,0,0,1,0,0|2,0,0]=4 754 B15R2.8 CC(C)Oc1cccc2c1CCC2O Amb19041648 [0,0,0,1,0,1|2,0,0]=4 755 B15R2.8 CC(C)Oc1cccc2c1OC[C@@H]2N Amb27748190 [0,0,0,1,0,1|1,0,0]=3 756 B15R2.384 CC(C)c1cccc2c1CCC(N)C2 Amb27173262 [0,0,0,1,0,1|2,0,0]=4 757 B15R2.384 CC(C)c1cccc2c1OCC(=O)N2 Amb17570529 [0,0,0,1,0,1|1,0,1]=4 758 B15R2.384 CC1=Cc2cccc(C(C)C)c2NC1 Amb18062211 [0,0,0,1,0,1|1,0,1]=4 759 B15R2.384 CC1CNc2c(cccc2C(C)C)C1 Amb5745997 [0,0,0,1,0,1|1,0,0]=3 760 B15R2.384 CC1COc2c(cccc2C(C)C)N1 Amb17570592 [0,0,0,1,0,1|0,0,0]=2 761 B15R2.43318 CC(C)c1cccc(CC2CC2)c1O Amb27425531 [0,0,0,1,0,1|0,0,0]=2 762 B15R2.43318 CC(C)c1cccc(OC2CC2)c1Br Amb27482774 [0,0,0,1,0,1|1,0,0]=3 763 B15R2.43318 CC(C)c1cccc(OC2CC2)c1F Amb27774851 [0,0,0,1,0,1|1,0,0]=3 764 B15R2.43318 CC(C)c1cncc(OC2CC2)c1N Amb28188927 [0,0,0,1,0,1|2,0,0]=4 765 B15R2.43318 CC(C)c1nccc(OC2CC2)c1I Amb27397621 [0,0,0,1,0,1|2,0,0]=4 766 B15R2.43318 CC(Cl)c1cccc(OC2CC2)c1F Amb35633618 [0,0,0,1,0,1|2,0,0]=4 767 B15R2.43318 CC(N)c1cccc(OC2CC2)c1F Amb35626390 [0,0,0,1,0,1|2,0,0]=4 768 B15R2.43318 CC(O)c1cccc(OC2CC2)c1F Amb35642103 [0,0,0,1,0,1|2,0,0]=4 769 B15R2.43318 CN(C)c1cccc(OC2CC2)c1F Amb27475979 [0,0,0,1,0,1|2,0,0]=4 770 B15R2.43318 Cc1c(OC2CC2)cncc1C(C)C Amb27267890 [0,0,0,1,0,1|2,0,0]=4 771 B15R2.69023 CC(C)c1cccc2c1OC(C)(C)O2 Amb17613329 [0,0,0,1,0,1|0,0,0]=2 772 B15R2.13611 CC(C)c1cccc2c1CCC[C@@H]2N Amb27872139 [0,1,0,1,0,0|2,0,0]=4 773 B15R2.13611 CC(C)c1cccc2c1CCC[C@H]2N Amb27749277 [0,1,0,1,0,0|2,0,0]=4 774 B15R2.13611 CC(C)c1cccc2c1CCNC2C Amb27868784 [0,1,0,1,0,0|1,0,0]=3 775 B15R2.13611 CC(C)c1cccc2c1COCC2N Amb27607837 [0,1,0,1,0,0|1,0,0]=3 776 B15R2.13611 CC(C)c1cccc2c1NCCC2N Amb18062304 [0,1,0,1,0,0|2,0,0]=4 777 B15R2.13611 CC(C)c1cccc2c1NCCC2O Amb18062303 [0,1,0,1,0,0|2,0,0]=4 778 B15R2.13611 CC(C)c1cccc2c1OCCC2=O Amb9213475 [0,1,0,1,0,0|1,0,1]=4 779 B15R2.13611 CC(C)c1cccc2c1OCCC2N Amb9213490 [0,1,0,1,0,0|1,0,0]=3 780 B15R2.13611 CC(C)c1cccc2c1OCCN2C Amb17570582 [0,1,0,1,0,0|1,0,0]=3 781 B15R2.13611 CC(C)c1cccc2c1OCC[C@H]2N Amb28143813 [0,1,0,1,0,0|1,0,0]=3 782 B15R2.13611 CC(C)c1cccc2c1OCC[C@H]2O Amb27590631 [0,1,0,1,0,0|1,0,0]=3 783 B15R2.13611 CC(C)c1cccc2c1SCC[C@@H]2N Amb27189156 [0,1,0,1,0,0|1,1,0]=4 784 B15R2.13611 CN(C)c1cccc2c1COCC2N Amb28123146 [0,1,0,1,0,0|2,0,0]=4 785 B15R2.13611 CN(C)c1cccc2c1OCCC2N Amb27815079 [0,1,0,1,0,0|2,0,0]=4 786 B15R2.13611 CN(C)c1cccc2c1OCC[C@H]2N Amb28340957 [0,1,0,1,0,0|2,0,0]=4 787 B15R2.69035 CC(C)c1cccc2c1NCC2(C)C Amb18560843 [0,1,0,1,0,0|1,0,0]=3 788 B15R2.24 CC(C)c1cccc2c1CN[C@H]2CO Amb28041617 [0,1,0,1,0,0|2,0,0]=4 789 B15R2.24 CC(C)c1cccc2c1NCC2C#N Amb18561228 [0,1,0,1,0,0|1,0,1]=4 790 B15R2.24 CC(C)c1cccc2c1NCC2CN Amb18560695 [0,1,0,1,0,0|1,0,0]=3 791 B15R2.24 CC(C)c1cccc2c1NCC2CO Amb18561211 [0,1,0,1,0,0|1,0,0]=3 792 B15R2.24 CCC1CNc2c(C(C)C)cccc21 Amb18063416 [0,1,0,1,0,0|1,0,0]=3 793 B15R2.19303 CCC(C)c1cccc2c1OCC2N Amb9373316 [0,1,0,1,0,0|1,0,0]=3 794 B15R2.19303 CCC(C)c1cccc2c1OC[C@H]2N Amb27775736 [0,1,0,1,0,0|1,0,0]=3 795 B15R2.45730 CC(C)c1cccc2c1OC(=O)N2C Amb18547353 [0,1,0,1,0,0|1,0,1]=4 796 B15R2.45730 CC(C)c1cccc2c1OC(C)C2N Amb18946111 [0,1,0,1,0,0|1,0,0]=3 797 B15R2.45730 CC1Oc2c(cccc2N(C)C)C1O Amb27664122 [0,1,0,1,0,0|2,0,0]=4 798 B15R2.45730 C[C@H]1Oc2c(cccc2N(C)C)[C@@H]1O Amb27978374 [0,1,0,1,0,0|2,0,0]=4 799 B15R2.50373 CC(C)c1ccc2c(c1O)C(N)CO2 Amb27600168 [0,1,0,1,0,0|1,0,0]=3 800 B15R2.142888 CC(C)c1cccc(C2CCN2)c1O Amb27828162 [0,1,0,1,0,0|0,0,0]=2 801 B15R2.142888 CC(C)c1cccc(C2CNC2)c1O Amb27948862 [0,1,0,1,0,0|0,0,0]=2 802 B15R2.9274 CC(C)c1cc(Br)cc2c1OCC2=O Amb27627703 [0,1,0,1,0,0|1,0,1]=4 803 B15R2.9 CC(C)(C)c1cccc2c1CCC2N Amb27252077 [0,1,0,1,0,0|2,0,0]=4 804 B15R2.9 CC(C)(C)c1cccc2c1OCC2=O Amb9372575 [0,1,0,1,0,0|1,0,1]=4 805 B15R2.9 CC(C)(C)c1cccc2c1OCC2O Amb27477385 [0,1,0,1,0,0|1,0,0]=3 806 B15R2.9 C[C@@H]1NCc2c1cccc2C(C)(C)C Amb27273362 [0,1,0,1,0,0|2,0,0]=4 807 B15R2.9280 CC(C)c1ccc(O)c2c1CCC2N Amb27205486 [0,1,0,1,0,0|2,0,0]=4 808 B15R2.9280 CC(C)c1ccc(O)c2c1CC[C@@H]2N Amb27237194 [0,1,0,1,0,0|2,0,0]=4 809 B15R2.9280 Cc1ccc(C(C)C)c2c1C(=O)CO2 Amb33531631 [0,1,0,1,0,0|1,0,1]=4 810 B15R2.9280 Cc1ccc(C(C)C)c2c1C(N)CC2 Amb27191994 [0,1,0,1,0,0|2,0,0]=4 811 B15R2.9280 Cc1ccc(C(C)C)c2c1[C@H](N)CO2 Amb27165100 [0,1,0,1,0,0|1,0,0]=3 812 B15R2.9280 Cc1ccc(N(C)C)c2c1C(N)CO2 Amb28060595 [0,1,0,1,0,0|2,0,0]=4 813 B15R3.2 NC1COc2c1ccnc2C3CC3 Amb27650379 [0,0,0,2,0,0|2,0,0]=4 814 B15R3.16460 CC1CC2CC(Cl)c3cccc1c32 Amb28283781 [0,0,0,2,0,0|2,0,0]=4 815 B15R3.16460 CC1CC2CC(O)c3cccc1c32 Amb27463861 [0,0,0,2,0,0|2,0,0]=4 816 B15R3.55990 Nc1c(C2CC2)cccc1C3CC3 Amb27482626 [0,0,0,2,0,0|1,0,0]=3 817 B11R1.175 CC(C)C1=CC=C(C(C)C)C1 Amb25694938 [1,0,0,0,1,0|0,0,1]=3 818 B11R1.175 CC(C)C1=CCC(C(C)C)=C1 Amb28326027 [1,0,0,0,1,0|0,0,1]=3 819 B11R1.175 CC(C)c1coc(C(C)N)c1 Amb27408453 [1,0,0,0,1,0|2,0,0]=4 820 B11R1.175 CC(C)c1csc(C(C)C)c1 Amb28428711 [1,0,0,0,1,0|1,0,0]=3 821 B11R1.175 CC(C)c1csc(C(C)C)n1 Amb23539281 [1,0,0,0,1,0|2,0,0]=4 822 B11R1.175 CC(C)n1cc[n+](C(C)C)c1 Amb22055165 [1,0,0,0,1,0|2,0,0]=4 823 B11R1.175 CC(N)c1ccn(C(C)C)c1 Amb21971503 [1,0,0,0,1,0|2,0,0]=4 824 B11R1.178 CC(C)c1ncoc1C(C)C Amb28318468 [1,0,0,0,1,0|2,0,0]=4 825 B11R1.178 CC(C)n1cccc1[C@@H](C)N Amb27254127 [1,0,0,0,1,0|2,0,0]=4 826 B11R1.178 CC(C)n1cccc1[C@H](C)N Amb27468678 [1,0,0,0,1,0|2,0,0]=4 827 B13R1.587 C=C(C)Cc1cccc(C(C)C)c1 Amb17678770 [1,0,0,0,0,1|0,0,2]=4 828 B13R1.587 CC(=O)Cc1cccc(C(C)C)c1 Amb33472421 [1,0,0,0,0,1|1,0,1]=4 829 B13R1.587 CC(=O)Oc1cccc(C(C)C)c1 Amb27953779 [1,0,0,0,0,1|1,0,1]=4 830 B13R1.587 CC(=O)Sc1cccc(C(C)C)c1 Amb24496770 [1,0,0,0,0,1|1,0,1]=4 831 B13R1.587 CC(=O)c1cccc(CC(C)C)c1 Amb27151786 [1,0,0,0,0,1|1,0,1]=4 832 B13R1.587 CC(=O)c1cccc(NC(C)C)c1 Amb17306670 [1,0,0,0,0,1|1,0,1]=4 833 B13R1.587 CC(=O)c1cccc(OC(C)C)c1 Amb6490992 [1,0,0,0,0,1|1,0,1]=4 834 B13R1.587 CC(=O)c1cccc(SC(C)C)c1 Amb27485386 [1,0,0,0,0,1|1,0,1]=4 835 B13R1.587 CC(Br)Cc1cccc(C(C)C)c1 Amb33005261 [1,0,0,0,0,1|1,0,0]=3 836 B13R1.587 CC(Br)Cc1cccc(N(C)C)c1 Amb33386325 [1,0,0,0,0,1|2,0,0]=4 837 B13R1.587 CC(C)Cc1cccc(C(C)Cl)c1 Amb27650575 [1,0,0,0,0,1|1,0,0]=3 838 B13R1.587 CC(C)Cc1cccc(C(C)N)c1 Amb27393326 [1,0,0,0,0,1|1,0,0]=3 839 B13R1.587 CC(C)Cc1cccc([C@H](C)N)c1 Amb28241251 [1,0,0,0,0,1|1,0,0]=3 840 B13R1.587 CC(C)Cc1cncc(C(C)N)c1 Amb35676709 [1,0,0,0,0,1|2,0,0]=4 841 B13R1.587 CC(C)Nc1cccc(C(C)C)c1 Amb6729066 [1,0,0,0,0,1|0,0,0]=2 842 B13R1.587 CC(C)Nc1cccc(C(C)N)c1 Amb27618080 [1,0,0,0,0,1|1,0,0]=3 843 B13R1.587 CC(C)Nc1cccc(C(F)F)c1 Amb28188080 [1,0,0,0,0,1|2,0,0]=4 844 B13R1.587 CC(C)Nc1cccc(N(C)C)c1 Amb18933609 [1,0,0,0,0,1|1,0,0]=3 845 B13R1.587 CC(C)Nc1cccc(N(C)C)n1 Amb27414786 [1,0,0,0,0,1|2,0,0]=4 846 B13R1.587 CC(C)Oc1cc(C(C)N)ccn1 Amb27968797 [1,0,0,0,0,1|2,0,0]=4 847 B13R1.587 CC(C)Oc1cccc(C(C)C)c1 Amb25735855 [1,0,0,0,0,1|0,0,0]=2 848 B13R1.587 CC(C)Oc1cccc(C(C)N)c1 Amb1131181 [1,0,0,0,0,1|1,0,0]=3 849 B13R1.587 CC(C)Oc1cccc(C(C)N)n1 Amb33423600 [1,0,0,0,0,1|2,0,0]=4 850 B13R1.587 CC(C)Oc1cccc(C(C)O)c1 Amb33540503 [1,0,0,0,0,1|1,0,0]=3 851 B13R1.587 CC(C)Oc1cccc(N(C)C)c1 Amb27641914 [1,0,0,0,0,1|1,0,0]=3 852 B13R1.587 CC(C)Oc1cccc([C@@H](C)N)c1 Amb28290012 [1,0,0,0,0,1|1,0,0]=3 853 B13R1.587 CC(C)Oc1cccc([C@@H](C)N)n1 Amb33423602 [1,0,0,0,0,1|2,0,0]=4 854 B13R1.587 CC(C)Oc1cccc([C@@H](C)O)c1 Amb25714020 [1,0,0,0,0,1|1,0,0]=3 855 B13R1.587 CC(C)Oc1cccc([C@@H](C)O)n1 Amb33275319 [1,0,0,0,0,1|2,0,0]=4 856 B13R1.587 CC(C)Oc1cccc([C@H](C)N)c1 Amb27179043 [1,0,0,0,0,1|1,0,0]=3 857 B13R1.587 CC(C)Oc1cccc([C@H](C)N)n1 Amb33423601 [1,0,0,0,0,1|2,0,0]=4 858 B13R1.587 CC(C)Oc1cccc([C@H](C)O)c1 Amb25063336 [1,0,0,0,0,1|1,0,0]=3 859 B13R1.587 CC(C)Oc1cccc([C@H](C)O)n1 Amb33275317 [1,0,0,0,0,1|2,0,0]=4 860 B13R1.587 CC(C)Oc1cncc(C(C)O)c1 Amb27979069 [1,0,0,0,0,1|2,0,0]=4 861 B13R1.587 CC(C)Sc1cc(C(C)N)ccn1 Amb27448247 [1,0,0,0,0,1|2,0,0]=4 862 B13R1.587 CC(C)Sc1cccc(C(C)N)n1 Amb29858561 [1,0,0,0,0,1|2,0,0]=4 863 B13R1.587 CC(C)Sc1cccc(C(C)O)n1 Amb29858545 [1,0,0,0,0,1|2,0,0]=4 864 B13R1.587 CC(C)Sc1cccc([C@@H](C)N)n1 Amb35733852 [1,0,0,0,0,1|2,0,0]=4 865 B13R1.587 CC(C)Sc1cccc([C@@H](C)O)n1 Amb35726348 [1,0,0,0,0,1|2,0,0]=4 866 B13R1.587 CC(C)Sc1cccc([C@H](C)N)n1 Amb29858440 [1,0,0,0,0,1|2,0,0]=4 867 B13R1.587 CC(C)Sc1cccc([C@H](C)O)n1 Amb35733693 [1,0,0,0,0,1|2,0,0]=4 868 B13R1.587 CC(C)c1cccc(CN(C)O)c1 Amb33472420 [1,0,0,0,0,1|2,0,0]=4 869 B13R1.587 CC(C)c1cccc(C[C@@H](C)N)c1 Amb27241803 [1,0,0,0,0,1|1,0,0]=3 870 B13R1.587 CC(C)c1cccc(C[C@@H](C)O)c1 Amb32876500 [1,0,0,0,0,1|1,0,0]=3 871 B13R1.587 CC(C)c1cccc(C[C@H](C)N)c1 Amb24713604 [1,0,0,0,0,1|1,0,0]=3 872 B13R1.587 CC(C)c1cccc(C[C@H](C)O)c1 Amb32876501 [1,0,0,0,0,1|1,0,0]=3 873 B13R1.587 CC(C)c1cccc(OC(F)F)c1 Amb17234283 [1,0,0,0,0,1|2,0,0]=4 874 B13R1.587 CC(N)c1cccc(CN(C)C)c1 Amb33416934 [1,0,0,0,0,1|2,0,0]=4 875 B13R1.587 CC(O)Cc1cccc(C(C)C)c1 Amb26881970 [1,0,0,0,0,1|1,0,0]=3 876 B13R1.587 CC(O)Cc1cccc(N(C)C)c1 Amb27833627 [1,0,0,0,0,1|2,0,0]=4 877 B13R1.587 C[C@@H](N)Cc1cccc(N(C)C)c1 Amb27849731 [1,0,0,0,0,1|2,0,0]=4 878 B13R1.587 C[C@@H](N)c1cccc(CN(C)C)c1 Amb33416851 [1,0,0,0,0,1|2,0,0]=4 879 B13R1.587 C[C@@H](O)Cc1cccc(N(C)C)c1 Amb33376254 [1,0,0,0,0,1|2,0,0]=4 880 B13R1.587 C[C@@H](O)c1cccc(CN(C)C)c1 Amb33416575 [1,0,0,0,0,1|2,0,0]=4 881 B13R1.587 C[C@H](N)Cc1cccc(N(C)C)c1 Amb24435452 [1,0,0,0,0,1|2,0,0]=4 882 B13R1.587 C[C@H](N)c1cccc(CN(C)C)c1 Amb33416850 [1,0,0,0,0,1|2,0,0]=4 883 B13R1.587 C[C@H](O)Cc1cccc(N(C)C)c1 Amb33376255 [1,0,0,0,0,1|2,0,0]=4 884 B13R1.587 C[C@H](O)c1cccc(CN(C)C)c1 Amb33416574 [1,0,0,0,0,1|2,0,0]=4 885 B13R1.641 CC(C)Oc1cccc(C#N)c1O Amb27228832 [1,0,0,0,0,1|1,0,1]=4 886 B13R1.641 CC(C)Oc1cccc(CCl)c1Cl Amb27395400 [1,0,0,0,0,1|2,0,0]=4 887 B13R1.641 CC(C)Oc1cccc(CN)c1Br Amb25714803 [1,0,0,0,0,1|2,0,0]=4 888 B13R1.641 CC(C)Oc1cccc(CN)c1F Amb32670080 [1,0,0,0,0,1|2,0,0]=4 889 B13R1.641 CC(C)Oc1cccc(CN)c1O Amb28243217 [1,0,0,0,0,1|1,0,0]=3 890 B13R1.641 CCc1cccc(CC(C)=O)c1O Amb27638483 [1,0,0,0,0,1|1,0,1]=4 891 B13R1.641 CCc1cccc(C[C@H](C)N)c1O Amb27467576 [1,0,0,0,0,1|1,0,0]=3 892 B13R1.641 CCc1cccc(OC(C)C)c1Br Amb27441242 [1,0,0,0,0,1|1,0,0]=3 893 B13R1.641 CNc1cccc(OC(C)C)c1N Amb27610157 [1,0,0,0,0,1|2,0,0]=4 894 B13R1.641 CNc1cccc(OC(C)C)c1O Amb28137748 [1,0,0,0,0,1|1,0,0]=3 895 B13R1.641 COc1cccc(CC(C)Br)c1O Amb33331931 [1,0,0,0,0,1|2,0,0]=4 896 B13R1.641 COc1cccc(CC(C)O)c1O Amb33428474 [1,0,0,0,0,1|2,0,0]=4 897 B13R1.641 COc1cccc(CN(C)C)c1O Amb1815807 [1,0,0,0,0,1|2,0,0]=4 898 B13R1.641 COc1cccc(C[C@@H](C)N)c1O Amb25809044 [1,0,0,0,0,1|2,0,0]=4 899 B13R1.641 COc1cccc(C[C@@H](C)O)c1O Amb33426292 [1,0,0,0,0,1|2,0,0]=4 900 B13R1.641 COc1cccc(C[C@H](C)N)c1O Amb25927402 [1,0,0,0,0,1|2,0,0]=4 901 B13R1.641 COc1cccc(C[C@H](C)O)c1O Amb33426293 [1,0,0,0,0,1|2,0,0]=4 902 B13R1.641 COc1cccc(OC(C)C)c1N Amb25204174 [1,0,0,0,0,1|2,0,0]=4 903 B13R1.641 COc1cccc(OC(C)C)c1O Amb24416809 [1,0,0,0,0,1|1,0,0]=3 904 B13R1.641 CSc1cccc(C[C@@H](C)N)c1O Amb28250715 [1,0,0,0,0,1|2,0,0]=4 905 B13R1.641 CSc1cccc(OC(C)C)c1O Amb27180440 [1,0,0,0,0,1|1,0,0]=3 906 B13R1.120 CC(=O)c1ccc(C(C)C)cc1O Amb27587332 [0,0,0,0,1,1|1,0,1]=4 907 B13R1.120 CC(C)C1=CC=C(C(C)N)C(=O)N1 Amb18923446 [0,0,0,0,1,1|1,0,1]=4 908 B13R1.120 CC(C)c1ccc(C(C)C)c(Br)c1 Amb8439156 [0,0,0,0,1,1|1,0,0]=3 909 B13R1.120 CC(C)c1ccc(C(C)C)c(N)c1 Amb27983796 [0,0,0,0,1,1|1,0,0]=3 910 B13R1.120 CC(C)c1ccc(C(C)C)c(O)c1 Amb3940661 [0,0,0,0,1,1|0,0,0]=2 911 B13R1.120 CC(C)c1ccc(C(C)N)cc1F Amb27958947 [0,0,0,0,1,1|2,0,0]=4 912 B13R1.120 CC(C)c1ccc(N(C)C)c(N)c1 Amb27421315 [0,0,0,0,1,1|2,0,0]=4 913 B13R1.120 CC(C)c1ccc(N(C)C)cc1N Amb17138890 [0,0,0,0,1,1|2,0,0]=4 914 B13R1.120 CC(C)c1cnc(C(C)C)c(Cl)n1 Amb25289314 [0,0,0,0,1,1|2,0,0]=4 915 B13R1.120 CC(C)c1cnc(C(C)C)c(O)n1 Amb18128752 [0,0,0,0,1,1|1,0,0]=3 916 B13R1.120 CC(C)c1ncc(C(C)C)c(Cl)n1 Amb24615564 [0,0,0,0,1,1|2,0,0]=4 917 B13R1.120 CC(C)c1ncc(C(C)C)c(O)n1 Amb24362962 [0,0,0,0,1,1|1,0,0]=3 918 B13R1.120 Cc1cc(C(C)C)ccc1C(C)C Amb27593890 [0,0,0,0,1,1|1,0,0]=3 919 B13R1.120 Cc1cc(N(C)C)ccc1C(C)C Amb10071257 [0,0,0,0,1,1|2,0,0]=4