0 B12R1.128 CC(C)(C)C1=C(C=CC(=C1)Br)N Z5086486810 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.128 CC(C)(C)C1=C(C=CC(=C1)Br)O Z1269183272 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.128 CC(C)(C)C1=C(C=CC(=C1)O)I Z1269150048 [0,0,0,0,0,0|1,0,0]=1 3 B12R1.128 CC(C)(C)C1=C(C=CC(=C1)O)O Z1255402624 [0,0,0,0,0,0|0,0,0]=0 4 B12R1.128 CC(C)(C)C1=C(N=NC(=C1)Cl)Cl Z1269241627 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.128 CC(C)(N)C1=C(C=CC(=C1)Cl)F Z4579741758 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.128 CC(C)(O)C1=C(C=CC(=C1)Cl)Cl Z1020762424 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.128 CC(F)(F)C1=C(C=CC(=C1)F)N Z2732231082 [0,0,0,0,0,0|4,0,0]=4 8 B12R1.128 CC(F)(F)C1=C(C=NC(=C1)O)F Z4663192828 [0,0,0,0,0,0|4,0,0]=4 9 B12R1.128 CC1=CC(=C(C=C1)O)C(C)(C)C Z104477904 [0,0,0,0,0,0|1,0,0]=1 10 B12R1.128 OC1=C(C=C(C=C1)Cl)C(F)(F)F Z384970696 [0,0,0,0,0,0|4,0,0]=4 11 B11R1.87 CC(C)(C)C1=C(C=CC=C1)I Z1217194897 [1,0,0,0,0,0|1,0,0]=2 12 B11R1.87 CC(C)(C)C1=C(C=CC=C1)N Z104477556 [1,0,0,0,0,0|1,0,0]=2 13 B11R1.87 CC(C)(C)C1=C(C=CC=C1)O Z104485444 [1,0,0,0,0,0|0,0,0]=1 14 B11R1.87 CC(C)(C)C1=C(C=CC=N1)O Z1198153185 [1,0,0,0,0,0|1,0,0]=2 15 B11R1.87 CC(C)(C)C1=C(N=CC=C1)N Z1192017799 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.87 CC(C)(C)C1=NC=CNC1=O Z1606819839 [1,0,0,0,0,0|2,0,1]=4 17 B11R1.87 CC(C)(N)C1=C(C=CC=C1)Br Z449374382 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.87 CC(C)(N)C1=C(C=CC=C1)N Z3039027002 [1,0,0,0,0,0|2,0,0]=3 19 B11R1.87 CC(C)(N)C1=C(C=NC=C1)Cl Z2065860604 [1,0,0,0,0,0|3,0,0]=4 20 B11R1.87 CC(C)(O)C1=C(C=CC=C1)Cl Z449374184 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.87 CC(C)(O)C1=C(C=CC=C1)F Z449374082 [1,0,0,0,0,0|2,0,0]=3 22 B11R1.87 CC(C)(O)C1=C(C=CN=C1)N Z1192038970 [1,0,0,0,0,0|3,0,0]=4 23 B11R1.87 CC1=C(C=CC=C1)C(C)(C)O Z449373950 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.87 CS(=O)(=O)C1=C(C=CC=C1)O Z815289314 [1,0,0,0,0,0|3,0,0]=4 25 B11R1.155 CC(C)(C)C1=CC(=CN=C1)N Z1255418805 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.155 CC(C)(C)C1=CC(=O)C=CO1 Z1255363030 [1,0,0,0,0,0|1,0,1]=3 27 B11R1.155 CC(C)(C)C1=CC(=O)NC=C1 Z2048189347 [1,0,0,0,0,0|1,0,1]=3 28 B11R1.155 CC(C)(C)C1=CC(=O)NC=N1 Z800200784 [1,0,0,0,0,0|2,0,1]=4 29 B11R1.155 CC(C)(C)C1=NC(=CC=C1)O Z1255380255 [1,0,0,0,0,0|1,0,0]=2 30 B11R1.155 CC(C)(C)C1=NC(=CC=N1)Br Z1269224391 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.155 CC(C)(C)C1=NC(=CC=N1)Cl Z445153134 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.155 CC(C)(C)C1=NC(=CC=N1)O Z1262246110 [1,0,0,0,0,0|2,0,0]=3 33 B11R1.155 CC(C)(C)C1=NC(=NC=C1)Br Z2848695628 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.155 CC(C)(C)C1=NC(=NC=C1)Cl Z1255400259 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.155 CC(C)(C)C1=NC(=NC=C1)N Z991536692 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.155 CC(C)(C)C1=NC(=NC=C1)S Z1255404030 [1,0,0,0,0,0|2,1,0]=4 37 B11R1.155 CC(C)(C)C1=NC(=O)NC=C1 Z2211231227 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.155 CC(C)(C)C1=NC=NC(=C1)Br Z1269140806 [1,0,0,0,0,0|3,0,0]=4 39 B11R1.155 CC(C)(C)C1=NC=NC(=C1)Cl Z800200806 [1,0,0,0,0,0|3,0,0]=4 40 B11R1.155 CC(C)(C)C1=NC=NC(=C1)N Z856211088 [1,0,0,0,0,0|3,0,0]=4 41 B11R1.155 CC(C)(N)C1=CC(=CC=C1)Br Z3037488222 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.155 CC(C)(N)C1=CC(=CC=C1)Cl Z449374238 [1,0,0,0,0,0|2,0,0]=3 43 B11R1.155 CC(C)(N)C1=CC(=CC=C1)F Z449374128 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.155 CC(C)(O)C1=CC(=CC=C1)Cl Z449374152 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.155 CC(C)(O)C1=CC(=CC=C1)N Z1262641436 [1,0,0,0,0,0|2,0,0]=3 46 B11R1.155 CC(F)(F)C1=CC(=CC=C1)N Z1753013071 [1,0,0,0,0,0|3,0,0]=4 47 B11R1.155 CS(=O)(=O)C1=CC(=CC=C1)O Z415743792 [1,0,0,0,0,0|3,0,0]=4 48 B11R1.155 OC1=CC(=CC=C1)C(F)(F)F Z104476676 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.167 CC(=O)C1=C(C=CC(=C1)Br)O Z104500026 [1,0,0,0,0,0|2,0,1]=4 50 B11R1.167 CC(=O)C1=C(C=CC(=C1)C)O Z85923114 [1,0,0,0,0,0|2,0,1]=4 51 B11R1.167 CC(=O)C1=C(C=CC(=C1)Cl)O Z57101024 [1,0,0,0,0,0|2,0,1]=4 52 B11R1.167 CC(=O)C1=C(C=CC(=C1)F)O Z56858268 [1,0,0,0,0,0|2,0,1]=4 53 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)F Z1198184516 [1,0,0,0,0,0|2,0,1]=4 54 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)N Z1255417279 [1,0,0,0,0,0|2,0,1]=4 55 B11R1.167 CC(=O)C1=C(C=CC(=C1)O)O Z56889030 [1,0,0,0,0,0|1,0,1]=3 56 B11R1.167 CC(C)C1=C(C=CC(=C1)Br)O Z1269143433 [1,0,0,0,0,0|1,0,0]=2 57 B11R1.167 CC(C)C1=C(C=CC(=C1)Cl)N Z2679866520 [1,0,0,0,0,0|2,0,0]=3 58 B11R1.167 CC(C)C1=C(C=CC(=C1)N)F Z5052153913 [1,0,0,0,0,0|2,0,0]=3 59 B11R1.167 CC(C)C1=C(C=CC(=C1)N)O Z1255375171 [1,0,0,0,0,0|1,0,0]=2 60 B11R1.167 CC(C)C1=C(N=CC(=C1)Cl)N Z1197892620 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.167 CC(N)C1=C(C=CC(=C1)Br)F Z4604865350 [1,0,0,0,0,0|3,0,0]=4 62 B11R1.167 CC(N)C1=C(C=CC(=C1)Cl)Cl Z239627076 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.167 CC(N)C1=C(C=CC(=C1)O)O Z4607148493 [1,0,0,0,0,0|1,0,0]=2 64 B11R1.167 CC(O)C1=C(C=CC(=C1)Br)N Z1509409907 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.167 CC(O)C1=C(C=CC(=C1)Cl)Cl Z335244918 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.167 CC(O)C1=C(C=CC(=C1)F)F Z228586372 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.167 CC(O)C1=C(C=CC(=C1)I)Br Z1947410581 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.167 CC1=CC(=C(C=C1)C)C(C)N Z56347427 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.167 CC1=CC(=C(C=C1)C)[C@@H](C)O Z360055836 [1,0,0,0,0,0|3,0,0]=4 70 B11R1.167 CC1=CC(=C(C=C1)C)[C@H](C)O Z360055834 [1,0,0,0,0,0|3,0,0]=4 71 B11R1.167 CC1=CC(=C(C=C1)O)N(C)C Z4989156435 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.167 CN(C)C1=C(C=CC(=C1)N)Cl Z1255492548 [1,0,0,0,0,0|3,0,0]=4 73 B11R1.167 C[C@@H](N)C1=C(C=CC(=C1)F)F Z360056102 [1,0,0,0,0,0|3,0,0]=4 74 B11R1.167 C[C@@H](O)C1=C(C=CC(=C1)Cl)Cl Z360055424 [1,0,0,0,0,0|3,0,0]=4 75 B11R1.167 C[C@@H](O)C1=C(C=CC(=C1)Cl)F Z1245781311 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)Cl)Cl Z360055428 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)Cl)F Z1245781230 [1,0,0,0,0,0|3,0,0]=4 78 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)F)F Z360056062 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.167 O=C(O)C1=C(C=CC(=C1)O)O Z275164274 [1,0,0,0,0,0|2,0,1]=4 80 B11R1.167 OC1=CC(=C(C=C1)Br)C(F)F Z1269214404 [1,0,0,0,0,0|3,0,0]=4 81 B13R1.98 CC1=C(C=C(C=C1)C=O)C(C)(C)C Z2511826861 [0,1,0,0,0,0|1,0,1]=3 82 B13R1.98 COC1=CC(=C(C=C1)O)C(C)(C)C Z104483428 [0,1,0,0,0,0|0,0,0]=1 83 B13R1.98 COC1=CC(=C(C=C1)O)C(F)(F)F Z1255388473 [0,1,0,0,0,0|3,0,0]=4 84 B13R1.257 CC(C)(C#N)C1=C(C=CC(=C1)Br)F Z1269173021 [0,1,0,0,0,0|2,0,1]=4 85 B13R1.877 CC(C)(C)C1=C(C=C(C(=C1)O)I)I Z2724166250 [0,1,0,0,0,0|1,0,0]=2 86 B13R1.877 CC(C)(O)C1=C(C=C(C(=C1)F)Cl)Cl Z606832448 [0,1,0,0,0,0|3,0,0]=4 87 B13R1.877 CC1=C(C=C(C(=C1)O)C(C)(C)C)F Z1513807188 [0,1,0,0,0,0|1,0,0]=2 88 B13R1.2815 CC(C)(C)C1=C(C(=CC(=C1)Br)Br)O Z1269143457 [0,1,0,0,0,0|1,0,0]=2 89 B13R1.2815 CC(C)(C)C1=C(C(=CC(=C1)I)Br)O Z1861995977 [0,1,0,0,0,0|1,0,0]=2 90 B13R1.3090 COC1=C(C=C(C=C1)Cl)C(C)(C)O Z1020762406 [0,1,0,0,0,0|2,0,0]=3 91 B13R1.3090 COC1=C(C=C(C=C1)O)C(C)(C)C Z1198149489 [0,1,0,0,0,0|0,0,0]=1 92 B13R2.3791 CC1(CNC2=C1C=C(C=C2)Br)C Z2065464292 [0,0,0,1,0,0|2,0,0]=3 93 B13R2.3791 CC1(COC2=C1C=C(C=C2)Br)C Z1269161489 [0,0,0,1,0,0|1,0,0]=2 94 B13R2.3791 CC1(COC2=C1C=C(C=C2)O)C Z1513829476 [0,0,0,1,0,0|0,0,0]=1 95 B13R2.10533 CC1=CC(=C(C=C1)Br)C2(CC2)N Z4969857553 [0,0,0,1,0,0|3,0,0]=4 96 B13R2.10533 NC1(CC1)C2=C(C=CC(=C2)Cl)F Z4521488424 [0,0,0,1,0,0|3,0,0]=4 97 B10R0.162 CC(C)/C(=C\C(=O)O)/C(=O)O Z1262511666 [1,0,1,0,0,0|2,0,0]=4 98 B10R1.28 CC(C)(Br)C1=CC=CC=C1 Z2520694454 [2,0,0,0,0,0|1,0,0]=3 99 B10R1.28 CC(C)(C)C1=CC=CC=C1 Z104478422 [2,0,0,0,0,0|0,0,0]=2 100 B10R1.28 CC(C)(N)C1=CC=CC=C1 Z336079658 [2,0,0,0,0,0|1,0,0]=3 101 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 Z431522400 [2,0,0,0,0,0|1,0,0]=3 102 B10R1.61 CC(=O)C1=C(C=CC=C1)O Z57101014 [2,0,0,0,0,0|1,0,1]=4 103 B10R1.61 CC(C)C1=C(C=CC=C1)Br Z1201618204 [2,0,0,0,0,0|1,0,0]=3 104 B10R1.61 CC(C)C1=C(C=CC=C1)N Z104475672 [2,0,0,0,0,0|1,0,0]=3 105 B10R1.61 CC(C)C1=C(C=CC=C1)O Z104485440 [2,0,0,0,0,0|0,0,0]=2 106 B10R1.61 CC(C)C1=C(C=CC=N1)N Z1416177001 [2,0,0,0,0,0|2,0,0]=4 107 B10R1.61 CC(C)C1=C(C=CN=C1)N Z1192004736 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.61 CC(C)C1=C(C=CN=C1)O Z1255421924 [2,0,0,0,0,0|1,0,0]=3 109 B10R1.61 CC(C)C1=C(C=NC=N1)O Z1618037650 [2,0,0,0,0,0|2,0,0]=4 110 B10R1.61 CC(C)C1=C(N=CC=C1)N Z1192017957 [2,0,0,0,0,0|2,0,0]=4 111 B10R1.61 CC(N)C1=C(C=CC=C1)F Z56347426 [2,0,0,0,0,0|2,0,0]=4 112 B10R1.61 CC(N)C1=C(C=CC=C1)O Z234895795 [2,0,0,0,0,0|1,0,0]=3 113 B10R1.61 CC(N)C1=C(C=CN=C1)O Z4515690259 [2,0,0,0,0,0|2,0,0]=4 114 B10R1.61 CC(O)C1=C(C=CC=C1)Cl Z335244972 [2,0,0,0,0,0|2,0,0]=4 115 B10R1.61 CC(O)C1=C(C=CC=C1)N Z734526976 [2,0,0,0,0,0|2,0,0]=4 116 B10R1.61 CC1=C(C=CC=C1)C(C)O Z335245068 [2,0,0,0,0,0|2,0,0]=4 117 B10R1.61 CC1=C(C=CC=C1)[C@@H](C)O Z360055768 [2,0,0,0,0,0|2,0,0]=4 118 B10R1.61 CN(C)C1=C(C=CC=C1)I Z840599616 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.61 CN(C)C1=C(C=CC=C1)N Z234893807 [2,0,0,0,0,0|2,0,0]=4 120 B10R1.61 CN(C)C1=C(C=CC=C1)O Z2681253687 [2,0,0,0,0,0|1,0,0]=3 121 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Br Z1696289917 [2,0,0,0,0,0|2,0,0]=4 122 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Cl Z360055184 [2,0,0,0,0,0|2,0,0]=4 123 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Br Z1127664407 [2,0,0,0,0,0|2,0,0]=4 124 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Cl Z360055178 [2,0,0,0,0,0|2,0,0]=4 125 B10R1.61 C[C@H](N)C1=C(C=CC=C1)Br Z1696289881 [2,0,0,0,0,0|2,0,0]=4 126 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Br Z1127664292 [2,0,0,0,0,0|2,0,0]=4 127 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Cl Z360055172 [2,0,0,0,0,0|2,0,0]=4 128 B10R1.113 CC(C)C1=CC(=CC=C1)O Z104492878 [2,0,0,0,0,0|0,0,0]=2 129 B10R1.113 CC(C)C1=CC(=NC=C1)N Z1203581683 [2,0,0,0,0,0|2,0,0]=4 130 B10R1.113 CC(C)C1=NC(=CC=N1)O Z1259335793 [2,0,0,0,0,0|2,0,0]=4 131 B10R1.113 CC(C)C1=NC=CC(=C1)N Z4438672474 [2,0,0,0,0,0|2,0,0]=4 132 B10R1.113 CC(C)C1=NC=CC(=C1)O Z1255384308 [2,0,0,0,0,0|1,0,0]=3 133 B10R1.113 CC(C)C1=NC=NC(=C1)O Z798484912 [2,0,0,0,0,0|2,0,0]=4 134 B10R1.113 CC(N)C1=CC(=CC=C1)Br Z239626864 [2,0,0,0,0,0|2,0,0]=4 135 B10R1.113 CC(N)C1=CC(=CC=C1)Cl Z56347061 [2,0,0,0,0,0|2,0,0]=4 136 B10R1.113 CC(N)C1=CC(=CC=C1)F Z56347483 [2,0,0,0,0,0|2,0,0]=4 137 B10R1.113 CC(N)C1=CC(=CC=C1)O Z426041632 [2,0,0,0,0,0|1,0,0]=3 138 B10R1.113 CC(O)C1=CC(=CC=C1)Cl Z335244960 [2,0,0,0,0,0|2,0,0]=4 139 B10R1.113 CC(O)C1=CC(=CC=C1)F Z335245218 [2,0,0,0,0,0|2,0,0]=4 140 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [2,0,0,0,0,0|1,0,0]=3 141 B10R1.113 CC1=CC=CC(=C1)C(C)N Z2284390656 [2,0,0,0,0,0|2,0,0]=4 142 B10R1.113 CC1=CC=CC(=C1)C(C)O Z445987122 [2,0,0,0,0,0|2,0,0]=4 143 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)N Z1626921284 [2,0,0,0,0,0|2,0,0]=4 144 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)O Z1127664487 [2,0,0,0,0,0|2,0,0]=4 145 B10R1.113 CC1=CC=CC(=C1)[C@H](C)N Z1626921239 [2,0,0,0,0,0|2,0,0]=4 146 B10R1.113 CC1=CC=CC(=C1)[C@H](C)O Z1127664373 [2,0,0,0,0,0|2,0,0]=4 147 B10R1.113 CN(C)C1=CC(=CC=C1)F Z1201621444 [2,0,0,0,0,0|2,0,0]=4 148 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Br Z803153182 [2,0,0,0,0,0|2,0,0]=4 149 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Cl Z360055382 [2,0,0,0,0,0|2,0,0]=4 150 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [2,0,0,0,0,0|1,0,0]=3 151 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Br Z803153180 [2,0,0,0,0,0|2,0,0]=4 152 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Cl Z360055386 [2,0,0,0,0,0|2,0,0]=4 153 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [2,0,0,0,0,0|1,0,0]=3 154 B10R1.30 CC1=C(C=C(C=C1)O)CN Z2672012535 [2,0,0,0,0,0|2,0,0]=4 155 B10R1.30 CCC1=C(C=CC(=C1)Br)C Z1813137877 [2,0,0,0,0,0|2,0,0]=4 156 B10R1.30 CCC1=C(C=CC(=C1)Br)O Z1269214466 [2,0,0,0,0,0|1,0,0]=3 157 B10R1.30 CCC1=C(C=CC(=C1)F)N Z4449286205 [2,0,0,0,0,0|2,0,0]=4 158 B10R1.30 CCC1=C(C=CC(=C1)I)Br Z1269132508 [2,0,0,0,0,0|2,0,0]=4 159 B10R1.30 CCC1=C(C=CC(=C1)O)O Z1255360449 [2,0,0,0,0,0|0,0,0]=2 160 B10R1.30 CCC1=C(C=CC(=N1)C)O Z1741975119 [2,0,0,0,0,0|2,0,0]=4 161 B10R1.30 COC1=C(C=CC(=C1)N)O Z3244869289 [2,0,0,0,0,0|2,0,0]=4 162 B10R1.30 COC1=C(C=CC(=C1)O)Br Z1258567775 [2,0,0,0,0,0|2,0,0]=4 163 B10R1.30 COC1=C(C=CC(=C1)O)N Z2574932955 [2,0,0,0,0,0|2,0,0]=4 164 B10R1.30 CSC1=C(C=CC(=C1)O)N Z1255433773 [2,0,0,0,0,0|2,0,0]=4 165 B10R1.30 NCC1=C(C=CC(=C1)Br)O Z57102487 [2,0,0,0,0,0|2,0,0]=4 166 B10R1.30 NCC1=C(C=CC(=C1)Cl)O Z594413668 [2,0,0,0,0,0|2,0,0]=4 167 B10R1.30 NCC1=C(C=CC(=C1)N)O Z2786366737 [2,0,0,0,0,0|2,0,0]=4 168 B10R1.30 NCC1=C(C=CC(=C1)O)Cl Z2768234857 [2,0,0,0,0,0|2,0,0]=4 169 B10R1.30 NCC1=C(C=CC(=C1)O)F Z4502872788 [2,0,0,0,0,0|2,0,0]=4 170 B10R1.30 NCC1=C(C=CC(=C1)O)O Z2757657768 [2,0,0,0,0,0|1,0,0]=3 171 B10R1.30 O=CC1=C(C=CC(=C1)O)O Z586251264 [2,0,0,0,0,0|1,0,1]=4 172 B10R1.30 OCC1=C(C=CC(=C1)Br)O Z56969308 [2,0,0,0,0,0|2,0,0]=4 173 B10R1.30 OCC1=C(C=CC(=C1)O)Cl Z1198184474 [2,0,0,0,0,0|2,0,0]=4 174 B12R1.76 CC(C)(C)C1=C(C=CC=C1)C=O Z1255429474 [1,1,0,0,0,0|0,0,1]=3 175 B12R1.76 CC(C)(C)C1=C(C=CC=C1)CO Z1255433283 [1,1,0,0,0,0|0,0,0]=2 176 B12R1.76 CC(C)(C)C1=C(C=NC=C1)C#N Z1198235022 [1,1,0,0,0,0|2,0,0]=4 177 B12R1.76 CC(C)(O)C1=C(C=CC=C1)C=O Z1511758915 [1,1,0,0,0,0|1,0,1]=4 178 B12R1.76 COC1=C(C=CC=C1)C(C)(C)N Z449374472 [1,1,0,0,0,0|1,0,0]=3 179 B12R1.76 COC1=C(C=CC=C1)C(C)(C)O Z449374410 [1,1,0,0,0,0|1,0,0]=3 180 B12R1.126 CC(C)(C)C1=C(C=C(C=C1)Cl)N Z1262627870 [1,1,0,0,0,0|1,0,0]=3 181 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)Br)F Z4574933795 [1,1,0,0,0,0|2,0,0]=4 182 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)F)Br Z4658970057 [1,1,0,0,0,0|2,0,0]=4 183 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)F)Cl Z1267881731 [1,1,0,0,0,0|2,0,0]=4 184 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)F)F Z2805859055 [1,1,0,0,0,0|2,0,0]=4 185 B12R1.126 CC(C)(O)C1=C(C=C(C=C1)Br)Cl Z1486034916 [1,1,0,0,0,0|2,0,0]=4 186 B12R1.195 CC(C)(C#N)C1=C(C=CC=C1)Br Z1020847934 [1,1,0,0,0,0|1,0,1]=4 187 B12R1.195 CC(C)(C#N)C1=C(C=CC=C1)Cl Z858030358 [1,1,0,0,0,0|1,0,1]=4 188 B12R1.195 CC(C)(CN)C1=C(C=CC=C1)Br Z1020847578 [1,1,0,0,0,0|1,0,0]=3 189 B12R1.195 CC(C)(CN)C1=C(C=CC=C1)Cl Z858031312 [1,1,0,0,0,0|1,0,0]=3 190 B12R1.195 CC(C)(CN)C1=C(C=CC=C1)F Z825741310 [1,1,0,0,0,0|1,0,0]=3 191 B12R1.195 CC(N)(CO)C1=C(C=CC=C1)Cl Z4511734215 [1,1,0,0,0,0|2,0,0]=4 192 B12R1.195 CC(O)(CN)C1=C(C=CC=C1)Cl Z1020684190 [1,1,0,0,0,0|2,0,0]=4 193 B12R1.195 CC1=C(C=CC=C1)C(C)(C)CN Z725146486 [1,1,0,0,0,0|1,0,0]=3 194 B12R1.195 CC1=C(N=CC=C1)C(C)(C)CN Z1255404843 [1,1,0,0,0,0|2,0,0]=4 195 B12R1.228 CC(C)(C)C1=C(C(=CC=C1)N)O Z1723849149 [1,1,0,0,0,0|0,0,0]=2 196 B12R1.228 CC(C)(C)C1=C(C(=CC=C1)O)Cl Z1255385707 [1,1,0,0,0,0|1,0,0]=3 197 B12R1.228 CC(C)(N)C1=C(C(=CC=C1)Cl)F Z1723418831 [1,1,0,0,0,0|2,0,0]=4 198 B12R1.228 CC1=C(C(=CC=C1)C(C)(C)C)O Z1255464948 [1,1,0,0,0,0|0,0,0]=2 199 B12R1.228 CC1=C(C(=CC=C1)C(C)(C)N)C Z4658970059 [1,1,0,0,0,0|2,0,0]=4 200 B12R1.228 CC1=C(C(=CC=C1)C(C)(C)O)C Z992749066 [1,1,0,0,0,0|2,0,0]=4 201 B12R1.1010 CC(C)(N)C1=C(C=CC=C1Cl)Cl Z1262327510 [1,1,0,0,0,0|2,0,0]=4 202 B12R1.10 CC(C)(C#N)C1=CC(=CC=C1)F Z725146244 [1,1,0,0,0,0|1,0,1]=4 203 B12R1.10 CC(C)(C#N)C1=CC(=CC=C1)N Z1251415409 [1,1,0,0,0,0|1,0,1]=4 204 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)Br Z725146618 [1,1,0,0,0,0|1,0,0]=3 205 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)Cl Z725146492 [1,1,0,0,0,0|1,0,0]=3 206 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)F Z725146550 [1,1,0,0,0,0|1,0,0]=3 207 B12R1.10 CC(C)(CN)C1=CC(=O)C=CN1 Z4923389973 [1,1,0,0,0,0|1,0,1]=4 208 B12R1.10 CC(C)(CN)C1=CC(=O)NC=C1 Z4926861924 [1,1,0,0,0,0|1,0,1]=4 209 B12R1.10 CC(C)(CN)C1=CC=CC(=O)N1 Z4657939558 [1,1,0,0,0,0|1,0,1]=4 210 B12R1.10 CC(C)(CO)C1=CC(=CC=C1)N Z1416169387 [1,1,0,0,0,0|1,0,0]=3 211 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)Br Z2939851870 [1,1,0,0,0,0|2,0,0]=4 212 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)N Z2752202173 [1,1,0,0,0,0|2,0,0]=4 213 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)O Z2111443115 [1,1,0,0,0,0|1,0,0]=3 214 B12R1.10 CC1=CC(=CC=C1)C(C)(C)CN Z725146606 [1,1,0,0,0,0|1,0,0]=3 215 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)I)O Z1269154708 [1,1,0,0,0,0|0,0,0]=2 216 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)N)O Z2004548136 [1,1,0,0,0,0|0,0,0]=2 217 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)O)O Z104476062 [1,1,0,0,0,0|0,0,0]=2 218 B12R1.23 CC(C)(N)C1=CC(=C(C=C1)Cl)Cl Z725146798 [1,1,0,0,0,0|2,0,0]=4 219 B12R1.23 CC(C)(N)C1=CC(=C(C=C1)F)F Z1020787660 [1,1,0,0,0,0|2,0,0]=4 220 B12R1.23 CC1=C(C=CC(=C1)C(C)(C)C)N Z5875960931 [1,1,0,0,0,0|1,0,0]=3 221 B12R1.102 CC(C)(C)C1=CC(=CC(=C1)N)N Z2235674849 [1,1,0,0,0,0|1,0,0]=3 222 B12R1.102 CC(C)(C)C1=CC(=CC(=C1)O)Br Z1269170846 [1,1,0,0,0,0|0,0,0]=2 223 B12R1.102 CC(C)(C)C1=NC(=NC(=C1)O)S Z2065836423 [1,1,0,0,0,0|2,0,0]=4 224 B12R1.102 CC(C)(N)C1=CC(=CC(=C1)Cl)Cl Z3235143349 [1,1,0,0,0,0|2,0,0]=4 225 B12R1.102 CC(C)(N)C1=CC(=CC(=C1)F)F Z3244401199 [1,1,0,0,0,0|2,0,0]=4 226 B12R1.102 CC1=CC(=CC(=C1)C(C)(C)C)C Z104498360 [1,1,0,0,0,0|1,0,0]=3 227 B12R1.102 CC1=NC(=NC(=C1)O)C(C)(C)C Z1259341067 [1,1,0,0,0,0|2,0,0]=4 228 B12R1.436 CC(C)(C)C1=CC(=CC=C1)C=O Z1198310513 [1,1,0,0,0,0|0,0,1]=3 229 B12R1.436 CC(C)(C)C1=CC(=CC=C1)CN Z3243653645 [1,1,0,0,0,0|1,0,0]=3 230 B12R1.436 CC(C)(C)C1=CC(=CN=C1)C=O Z1255422499 [1,1,0,0,0,0|1,0,1]=4 231 B12R1.436 CC(C)(C)C1=CC(=NC=C1)C=O Z1255504498 [1,1,0,0,0,0|1,0,1]=4 232 B12R1.436 CC(C)(C)C1=CC(=NC=C1)CN Z3244923162 [1,1,0,0,0,0|2,0,0]=4 233 B12R1.436 CC(C)(N)C1=CC(=CC=C1)C#N Z2457156259 [1,1,0,0,0,0|2,0,0]=4 234 B12R1.436 COC1=CC(=CC=C1)C(C)(C)N Z3023980681 [1,1,0,0,0,0|1,0,0]=3 235 B12R1.46 CN(C)C1=C(C=CC(=C1)Br)CO Z405057312 [1,1,0,0,0,0|2,0,0]=4 236 B12R1.46 COC1=C(C=C(C=C1)C)C(C)N Z94601375 [1,1,0,0,0,0|2,0,0]=4 237 B12R1.46 COC1=C(C=C(C=C1)C)[C@@H](C)O Z360056216 [1,1,0,0,0,0|2,0,0]=4 238 B12R1.46 COC1=C(C=C(C=C1)C)[C@H](C)O Z360056212 [1,1,0,0,0,0|2,0,0]=4 239 B12R1.46 COC1=C(C=C(C=C1)F)C(C)N Z332383672 [1,1,0,0,0,0|2,0,0]=4 240 B12R1.46 COC1=C(C=C(C=C1)N)C(C)C Z3244866812 [1,1,0,0,0,0|1,0,0]=3 241 B12R1.46 COC1=C(C=C(C=C1)O)C(=O)C Z1198163904 [1,1,0,0,0,0|1,0,1]=4 242 B12R1.232 CC(=O)C1=C(C=C(C(=C1)O)O)O Z274502124 [1,1,0,0,0,0|1,0,1]=4 243 B12R1.232 CC1=CC(=C(C=C1Cl)C(C)C)O Z104485030 [1,1,0,0,0,0|1,0,0]=3 244 B12R1.232 CC1=CC(=C(C=C1Cl)C(C)N)O Z4921616835 [1,1,0,0,0,0|2,0,0]=4 245 B12R1.232 CC1=CC(=C(C=C1N)C(C)C)O Z1407007577 [1,1,0,0,0,0|1,0,0]=3 246 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)Cl Z104495034 [1,1,0,0,0,0|1,0,0]=3 247 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)O Z1198148655 [1,1,0,0,0,0|0,0,0]=2 248 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)C Z1255372388 [1,1,0,0,0,0|0,0,2]=4 249 B12R1.354 CNC(C)C1=C(C=CC(=C1)F)F Z239629056 [1,1,0,0,0,0|2,0,0]=4 250 B12R1.354 COC(=O)C1=C(C=CC(=C1)O)O Z275165842 [1,1,0,0,0,0|1,0,1]=4 251 B12R1.453 CC(C)C1=C(C=CC(=C1)C#N)O Z1255467730 [1,1,0,0,0,0|1,0,0]=3 252 B12R1.453 COC1=CC(=C(C=C1)O)C(=O)C Z104483744 [1,1,0,0,0,0|1,0,1]=4 253 B12R1.453 COC1=CC(=C(C=C1)O)C(C)N Z239627178 [1,1,0,0,0,0|1,0,0]=3 254 B14R1.1866 CC1=CC(=C(C=C1)CN)OC(C)(C)C Z972654974 [0,1,0,0,0,1|2,0,0]=4 255 B14R1.12 CC(C)(C)C1=C(C=CC(=C1)C(=O)O)O Z1255386783 [0,2,0,0,0,0|0,0,0]=2 256 B14R1.12 CC1=C(C=C(C=C1)C(=O)O)C(C)(C)C Z3242283539 [0,2,0,0,0,0|1,0,0]=3 257 B14R1.3720 COC1=C(C=C(C=C1)C=O)C(C)(C)C Z1198156306 [0,2,0,0,0,0|0,0,1]=3 258 B14R1.2285 CC(C)(C)C1=C(C=C(C(=C1)F)C=O)F Z1511875054 [0,2,0,0,0,0|2,0,0]=4 259 B14R1.361 CC(C)(C)C1=C(C(=CC(=C1)Br)C=O)O Z1269199495 [0,2,0,0,0,0|1,0,0]=3 260 B12R1.837 CC1=CC=C(O1)C(=O)C(C)(C)C Z852744572 [0,0,1,1,0,0|2,0,0]=4 261 B12R2.88 CC1(CC1)C2=C(C=CC=C2)Br Z1269218613 [1,0,0,1,0,0|1,0,0]=3 262 B12R2.88 CC1(CC1)C2=C(C=CC=C2)N Z3034284333 [1,0,0,1,0,0|1,0,0]=3 263 B12R2.88 CC1=C(C=CC=C1)C2(CC2)N Z2429425682 [1,0,0,1,0,0|2,0,0]=4 264 B12R2.88 NC1(CC1)C2=C(C=CC=C2)Br Z3244924184 [1,0,0,1,0,0|2,0,0]=4 265 B12R2.88 NC1(CC1)C2=C(C=CC=C2)F Z1695797781 [1,0,0,1,0,0|2,0,0]=4 266 B12R2.88 NC1(CC1)C2=C(C=CC=C2)I Z2751942763 [1,0,0,1,0,0|2,0,0]=4 267 B12R2.2403 CC1(CCC2=C1C=CC=C2)N Z449371306 [1,0,0,1,0,0|2,0,0]=4 268 B12R2.2403 CC1(CCC2=C1C=CC=C2)O Z449370928 [1,0,0,1,0,0|2,0,0]=4 269 B12R2.2403 CC1(CNC2=C1C=CC=C2)C Z1413780522 [1,0,0,1,0,0|1,0,0]=3 270 B12R2.2403 CC1(CNC2=C1C=CN=C2)C Z1861999570 [1,0,0,1,0,0|2,0,0]=4 271 B12R2.2403 CC1(CNC2=C1N=CC=C2)C Z1861999568 [1,0,0,1,0,0|2,0,0]=4 272 B12R2.2403 CC1(COC2=C1C=CC=C2)N Z5094222723 [1,0,0,1,0,0|1,0,0]=3 273 B12R2.1282 CC1(CC1)C2=CC(=CC=C2)N Z3016341162 [1,0,0,1,0,0|1,0,0]=3 274 B12R2.1282 CC1=CC(=CC=C1)C2(CC2)N Z3235027684 [1,0,0,1,0,0|2,0,0]=4 275 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)Br Z1250132660 [1,0,0,1,0,0|2,0,0]=4 276 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)Cl Z1272949049 [1,0,0,1,0,0|2,0,0]=4 277 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)F Z1250132685 [1,0,0,1,0,0|2,0,0]=4 278 B12R2.132 CC1=CC2=C(C=C1)OCC2N Z1431002725 [1,0,0,1,0,0|2,0,0]=4 279 B12R2.132 NC1CCC2=C1C=C(C=C2)O Z1198165276 [1,0,0,1,0,0|2,0,0]=4 280 B12R2.132 NC1COC2=C1C=C(C=C2)Br Z3241275758 [1,0,0,1,0,0|2,0,0]=4 281 B12R2.132 NC1COC2=C1C=C(C=C2)Cl Z1431002566 [1,0,0,1,0,0|2,0,0]=4 282 B12R2.132 NC1COC2=C1C=C(C=C2)F Z1698549696 [1,0,0,1,0,0|2,0,0]=4 283 B12R2.1316 NC1=CC(=C(C=C1)Cl)C2CC2 Z5095428568 [1,0,0,1,0,0|2,0,0]=4 284 B14R2.4491 CC1(CCC2=C(O1)C=C(C=C2)Br)C Z2681257284 [0,0,0,1,0,1|2,0,0]=4 285 B14R2.4491 CC1(CCC2=C(O1)C=C(C=C2)N)C Z5039996915 [0,0,0,1,0,1|2,0,0]=4 286 B14R2.4491 CC1(CCC2=C(O1)C=C(C=C2)O)C Z839129166 [0,0,0,1,0,1|1,0,0]=3 287 B14R2.4491 CC1(CNC2=C(O1)C=C(C=C2)Br)C Z1813183570 [0,0,0,1,0,1|2,0,0]=4 288 B14R2.4507 CC1(C(=O)OC2=C1C=C(C=C2)O)C Z1513821827 [0,1,0,1,0,0|0,0,1]=3 289 B14R2.4536 CC1(CCSC2=C1C=C(C=C2)Cl)C Z1416179004 [0,1,0,1,0,0|1,1,0]=4 290 B14R2.4536 CC1(CCSC2=C1C=C(C=C2)O)C Z1513902728 [0,1,0,1,0,0|0,1,0]=3 291 B14R2.4536 CC1(CNCC2=C1C=C(C=C2)F)C Z4330191890 [0,1,0,1,0,0|2,0,0]=4 292 B14R2.8654 CC1=C2C(=C(C=C1)Br)NCC2(C)C Z1715300937 [0,1,0,1,0,0|2,0,0]=4 293 B14R2.8333 CC1(CNC2=C1C=C(C(=C2)F)Br)C Z3183627465 [0,1,0,1,0,0|2,0,0]=4 294 B14R2.8732 CC1(OB(C2=C1C=C(C=C2)Cl)O)C Z4554352172 [0,1,0,1,0,0|2,0,0]=4 295 B14R2.8732 CC1(OB(C2=C1C=C(C=C2)F)O)C Z1681350847 [0,1,0,1,0,0|2,0,0]=4 296 B10R1.65 CC(C)(C)N1N=CC=C1O Z2939852017 [1,0,0,0,1,0|2,0,0]=4 297 B12R1.119 CC(C)(N)CC1=CC(=CC=C1)Br Z415658564 [1,0,0,0,0,1|2,0,0]=4 298 B12R1.127 CC(C)OC1=C(C=CC(=C1)F)N Z1623872319 [1,0,0,0,0,1|2,0,0]=4 299 B12R1.127 CC(C)OC1=C(C=CC(=C1)F)O Z1255426185 [1,0,0,0,0,1|1,0,0]=3 300 B12R1.127 CC1=C(C=C(C=C1)N)OC(C)C Z1895741280 [1,0,0,0,0,1|2,0,0]=4 301 B12R1.127 CC1=CC(=C(C=C1)C)NC(C)C Z267155660 [1,0,0,0,0,1|2,0,0]=4 302 B14R1.6073 CC(C)(C)NCC1=C(C=CC(=C1)Cl)O Z239630380 [0,0,0,0,0,2|1,0,0]=3