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|1,0,1]=2 2 B12R1.128 CC(C)(C)C1=C(C=CC(=C1)O)I Z1269150048 [0,0,0,0,0,0|1,0,1]=2 3 B12R1.128 CC(C)(C)C1=C(C=CC(=C1)O)O Z1255402624 [0,0,0,0,0,0|0,0,2]=2 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)(C)N1CC(=O)NCC1=O Z1251277493 [0,0,0,0,0,0|2,0,2]=4 6 B12R1.128 CC(C)(N)C1=C(C=CC(=C1)Cl)F Z4579741758 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.128 CC(C)(O)C1=C(C=CC(=C1)Cl)Cl Z1020762424 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.128 CC(F)(F)C1=C(C=CC(=C1)F)N Z2732231082 [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|1,0,1]=2 10 B11R1.87 CC(C)(C)C1=C(C=CC=C1)I Z1217194897 [1,0,0,0,0,0|1,0,0]=2 11 B11R1.87 CC(C)(C)C1=C(C=CC=C1)N Z104477556 [1,0,0,0,0,0|1,0,0]=2 12 B11R1.87 CC(C)(C)C1=C(C=CC=C1)O Z104485444 [1,0,0,0,0,0|0,0,1]=2 13 B11R1.87 CC(C)(C)C1=C(C=CC=N1)O Z1198153185 [1,0,0,0,0,0|1,0,1]=3 14 B11R1.87 CC(C)(C)C1=C(N=CC=C1)N Z1192017799 [1,0,0,0,0,0|2,0,0]=3 15 B11R1.87 CC(C)(C)C1=NC=CNC1=O Z1606819839 [1,0,0,0,0,0|2,0,0]=3 16 B11R1.87 CC(C)(N)C1=C(C=CC=C1)Br Z449374382 [1,0,0,0,0,0|2,0,0]=3 17 B11R1.87 CC(C)(N)C1=C(C=CC=C1)N Z3039027002 [1,0,0,0,0,0|2,0,0]=3 18 B11R1.87 CC(C)(N)C1=C(C=NC=C1)Cl Z2065860604 [1,0,0,0,0,0|3,0,0]=4 19 B11R1.87 CC(C)(O)C1=C(C=CC=C1)Cl Z449374184 [1,0,0,0,0,0|2,0,0]=3 20 B11R1.87 CC(C)(O)C1=C(C=CC=C1)F Z449374082 [1,0,0,0,0,0|2,0,0]=3 21 B11R1.87 CC(C)(O)C1=C(C=CN=C1)N Z1192038970 [1,0,0,0,0,0|3,0,0]=4 22 B11R1.87 CC1=C(C=CC=C1)C(C)(C)O Z449373950 [1,0,0,0,0,0|2,0,0]=3 23 B11R1.155 CC(C)(C)C1=CC(=CN=C1)N Z1255418805 [1,0,0,0,0,0|2,0,0]=3 24 B11R1.155 CC(C)(C)C1=CC(=O)C=CO1 Z1255363030 [1,0,0,0,0,0|1,0,0]=2 25 B11R1.155 CC(C)(C)C1=CC(=O)NC=C1 Z2048189347 [1,0,0,0,0,0|1,0,0]=2 26 B11R1.155 CC(C)(C)C1=CC(=O)NC=N1 Z800200784 [1,0,0,0,0,0|2,0,0]=3 27 B11R1.155 CC(C)(C)C1=NC(=CC=C1)O Z1255380255 [1,0,0,0,0,0|1,0,1]=3 28 B11R1.155 CC(C)(C)C1=NC(=CC=N1)Br Z1269224391 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.155 CC(C)(C)C1=NC(=CC=N1)Cl Z445153134 [1,0,0,0,0,0|3,0,0]=4 30 B11R1.155 CC(C)(C)C1=NC(=CC=N1)O Z1262246110 [1,0,0,0,0,0|2,0,1]=4 31 B11R1.155 CC(C)(C)C1=NC(=NC=C1)Br Z2848695628 [1,0,0,0,0,0|3,0,0]=4 32 B11R1.155 CC(C)(C)C1=NC(=NC=C1)Cl Z1255400259 [1,0,0,0,0,0|3,0,0]=4 33 B11R1.155 CC(C)(C)C1=NC(=NC=C1)N Z991536692 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.155 CC(C)(C)C1=NC(=NC=C1)S Z1255404030 [1,0,0,0,0,0|2,1,0]=4 35 B11R1.155 CC(C)(C)C1=NC(=O)NC=C1 Z2211231227 [1,0,0,0,0,0|2,0,0]=3 36 B11R1.155 CC(C)(C)C1=NC=NC(=C1)Br Z1269140806 [1,0,0,0,0,0|3,0,0]=4 37 B11R1.155 CC(C)(C)C1=NC=NC(=C1)Cl Z800200806 [1,0,0,0,0,0|3,0,0]=4 38 B11R1.155 CC(C)(C)C1=NC=NC(=C1)N Z856211088 [1,0,0,0,0,0|3,0,0]=4 39 B11R1.155 CC(C)(N)C1=CC(=CC=C1)Br Z3037488222 [1,0,0,0,0,0|2,0,0]=3 40 B11R1.155 CC(C)(N)C1=CC(=CC=C1)Cl Z449374238 [1,0,0,0,0,0|2,0,0]=3 41 B11R1.155 CC(C)(N)C1=CC(=CC=C1)F Z449374128 [1,0,0,0,0,0|2,0,0]=3 42 B11R1.155 CC(C)(N)C1=NC(=O)C=CN1 Z1258850825 [1,0,0,0,0,0|3,0,0]=4 43 B11R1.155 CC(C)(O)C1=CC(=CC=C1)Cl Z449374152 [1,0,0,0,0,0|2,0,0]=3 44 B11R1.155 CC(C)(O)C1=CC(=CC=C1)N Z1262641436 [1,0,0,0,0,0|2,0,0]=3 45 B11R1.155 CC(F)(F)C1=CC(=CC=C1)N Z1753013071 [1,0,0,0,0,0|3,0,0]=4 46 B11R1.167 CC(C)C1=C(C=CC(=C1)Br)O Z1269143433 [1,0,0,0,0,0|1,0,1]=3 47 B11R1.167 CC(C)C1=C(C=CC(=C1)Cl)N Z2679866520 [1,0,0,0,0,0|2,0,0]=3 48 B11R1.167 CC(C)C1=C(C=CC(=C1)N)F Z5052153913 [1,0,0,0,0,0|2,0,0]=3 49 B11R1.167 CC(C)C1=C(C=CC(=C1)N)O Z1255375171 [1,0,0,0,0,0|1,0,1]=3 50 B11R1.167 CC(C)C1=C(N=CC(=C1)Cl)N Z1197892620 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.167 CC(N)C1=C(C=CC(=C1)Br)F Z4604865350 [1,0,0,0,0,0|3,0,0]=4 52 B11R1.167 CC(N)C1=C(C=CC(=C1)Cl)Cl Z239627076 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.167 CC(N)C1=C(C=CC(=C1)O)O Z4607148493 [1,0,0,0,0,0|1,0,2]=4 54 B11R1.167 CC(O)C1=C(C=CC(=C1)Br)N Z1509409907 [1,0,0,0,0,0|3,0,0]=4 55 B11R1.167 CC(O)C1=C(C=CC(=C1)Cl)Cl Z335244918 [1,0,0,0,0,0|3,0,0]=4 56 B11R1.167 CC(O)C1=C(C=CC(=C1)F)F Z228586372 [1,0,0,0,0,0|3,0,0]=4 57 B11R1.167 CC(O)C1=C(C=CC(=C1)I)Br Z1947410581 [1,0,0,0,0,0|3,0,0]=4 58 B11R1.167 CC1=CC(=C(C=C1)C)C(C)N Z56347427 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.167 CC1=CC(=C(C=C1)C)[C@@H](C)O Z360055836 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.167 CC1=CC(=C(C=C1)C)[C@H](C)O Z360055834 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.167 CC1=CC(=C(C=C1)O)N(C)C Z4989156435 [1,0,0,0,0,0|2,0,1]=4 62 B11R1.167 CN(C)C1=C(C=CC(=C1)N)Cl Z1255492548 [1,0,0,0,0,0|3,0,0]=4 63 B11R1.167 C[C@@H](N)C1=C(C=CC(=C1)F)F Z360056102 [1,0,0,0,0,0|3,0,0]=4 64 B11R1.167 C[C@@H](O)C1=C(C=CC(=C1)Cl)Cl Z360055424 [1,0,0,0,0,0|3,0,0]=4 65 B11R1.167 C[C@@H](O)C1=C(C=CC(=C1)Cl)F Z1245781311 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)Cl)Cl Z360055428 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)Cl)F Z1245781230 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.167 C[C@H](O)C1=C(C=CC(=C1)F)F Z360056062 [1,0,0,0,0,0|3,0,0]=4 69 B13R1.98 CC1=C(C=C(C=C1)C=O)C(C)(C)C Z2511826861 [0,1,0,0,0,0|1,0,0]=2 70 B13R1.98 COC1=CC(=C(C=C1)O)C(C)(C)C Z104483428 [0,1,0,0,0,0|0,0,2]=3 71 B13R1.257 CC(C)(C#N)C1=C(C=CC(=C1)Br)F Z1269173021 [0,1,0,0,0,0|2,0,1]=4 72 B13R1.877 CC(C)(C)C1=C(C=C(C(=C1)O)I)I Z2724166250 [0,1,0,0,0,0|1,0,1]=3 73 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 74 B13R1.877 CC1=C(C=C(C(=C1)O)C(C)(C)C)F Z1513807188 [0,1,0,0,0,0|1,0,1]=3 75 B13R1.2815 CC(C)(C)C1=C(C(=CC(=C1)Br)Br)O Z1269143457 [0,1,0,0,0,0|1,0,1]=3 76 B13R1.2815 CC(C)(C)C1=C(C(=CC(=C1)I)Br)O Z1861995977 [0,1,0,0,0,0|1,0,1]=3 77 B13R1.3090 COC1=C(C=C(C=C1)Cl)C(C)(C)O Z1020762406 [0,1,0,0,0,0|2,0,1]=4 78 B13R1.3090 COC1=C(C=C(C=C1)O)C(C)(C)C Z1198149489 [0,1,0,0,0,0|0,0,2]=3 79 B13R2.3791 CC1(CNC2=C1C=C(C=C2)Br)C Z2065464292 [0,0,0,1,0,0|2,0,0]=3 80 B13R2.3791 CC1(COC2=C1C=C(C=C2)Br)C Z1269161489 [0,0,0,1,0,0|1,0,1]=3 81 B13R2.3791 CC1(COC2=C1C=C(C=C2)O)C Z1513829476 [0,0,0,1,0,0|0,0,2]=3 82 B13R2.10533 CC1=CC(=C(C=C1)Br)C2(CC2)N Z4969857553 [0,0,0,1,0,0|3,0,0]=4 83 B13R2.10533 NC1(CC1)C2=C(C=CC(=C2)Cl)F Z4521488424 [0,0,0,1,0,0|3,0,0]=4 84 B11R1.496 CC(C)(C)N1C(=O)CNC1=O Z431948476 [0,0,0,0,1,0|2,0,1]=4 85 B11R1.646 CC(C)(C)C1NC(=O)NC1=O Z1029461812 [0,0,0,0,1,0|2,0,1]=4 86 B11R1.646 CC(C)(C)N1NC(=O)C=C1N Z1696861494 [0,0,0,0,1,0|3,0,0]=4 87 B11R1.646 CC1=CC(=O)N(N1)C(C)(C)C Z1696822347 [0,0,0,0,1,0|3,0,0]=4 88 B10R0.162 CC(C)/C(=C\C(=O)O)/C(=O)O Z1262511666 [1,0,1,0,0,0|2,0,0]=4 89 B10R1.28 CC(C)(Br)C1=CC=CC=C1 Z2520694454 [2,0,0,0,0,0|1,0,0]=3 90 B10R1.28 CC(C)(C)C1=CC=CC=C1 Z104478422 [2,0,0,0,0,0|0,0,0]=2 91 B10R1.28 CC(C)(N)C1=CC=CC=C1 Z336079658 [2,0,0,0,0,0|1,0,0]=3 92 B10R1.28 C[N+](C)(C)C1=CC=CC=C1 Z431522400 [2,0,0,0,0,0|1,0,0]=3 93 B10R1.61 CC(C)C1=C(C=CC=C1)Br Z1201618204 [2,0,0,0,0,0|1,0,0]=3 94 B10R1.61 CC(C)C1=C(C=CC=C1)N Z104475672 [2,0,0,0,0,0|1,0,0]=3 95 B10R1.61 CC(C)C1=C(C=CC=C1)O Z104485440 [2,0,0,0,0,0|0,0,1]=3 96 B10R1.61 CC(C)C1=C(C=CC=N1)N Z1416177001 [2,0,0,0,0,0|2,0,0]=4 97 B10R1.61 CC(C)C1=C(C=CN=C1)N Z1192004736 [2,0,0,0,0,0|2,0,0]=4 98 B10R1.61 CC(C)C1=C(C=CN=C1)O Z1255421924 [2,0,0,0,0,0|1,0,1]=4 99 B10R1.61 CC(C)C1=C(N=CC=C1)N Z1192017957 [2,0,0,0,0,0|2,0,0]=4 100 B10R1.61 CC(C)C1=NC=CNC1=O Z1203732938 [2,0,0,0,0,0|2,0,0]=4 101 B10R1.61 CC(N)C1=C(C=CC=C1)F Z56347426 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.61 CC(N)C1=C(C=CC=C1)O Z234895795 [2,0,0,0,0,0|1,0,1]=4 103 B10R1.61 CC(O)C1=C(C=CC=C1)Cl Z335244972 [2,0,0,0,0,0|2,0,0]=4 104 B10R1.61 CC(O)C1=C(C=CC=C1)N Z734526976 [2,0,0,0,0,0|2,0,0]=4 105 B10R1.61 CC1=C(C=CC=C1)C(C)O Z335245068 [2,0,0,0,0,0|2,0,0]=4 106 B10R1.61 CC1=C(C=CC=C1)[C@@H](C)O Z360055768 [2,0,0,0,0,0|2,0,0]=4 107 B10R1.61 CN(C)C1=C(C=CC=C1)I Z840599616 [2,0,0,0,0,0|2,0,0]=4 108 B10R1.61 CN(C)C1=C(C=CC=C1)N Z234893807 [2,0,0,0,0,0|2,0,0]=4 109 B10R1.61 CN(C)C1=C(C=CC=C1)O Z2681253687 [2,0,0,0,0,0|1,0,1]=4 110 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Br Z1696289917 [2,0,0,0,0,0|2,0,0]=4 111 B10R1.61 C[C@@H](N)C1=C(C=CC=C1)Cl Z360055184 [2,0,0,0,0,0|2,0,0]=4 112 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Br Z1127664407 [2,0,0,0,0,0|2,0,0]=4 113 B10R1.61 C[C@@H](O)C1=C(C=CC=C1)Cl Z360055178 [2,0,0,0,0,0|2,0,0]=4 114 B10R1.61 C[C@H](N)C1=C(C=CC=C1)Br Z1696289881 [2,0,0,0,0,0|2,0,0]=4 115 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Br Z1127664292 [2,0,0,0,0,0|2,0,0]=4 116 B10R1.61 C[C@H](O)C1=C(C=CC=C1)Cl Z360055172 [2,0,0,0,0,0|2,0,0]=4 117 B10R1.113 CC(C)C1=CC(=CC=C1)O Z104492878 [2,0,0,0,0,0|0,0,1]=3 118 B10R1.113 CC(C)C1=CC(=NC=C1)N Z1203581683 [2,0,0,0,0,0|2,0,0]=4 119 B10R1.113 CC(C)C1=NC=CC(=C1)N Z4438672474 [2,0,0,0,0,0|2,0,0]=4 120 B10R1.113 CC(C)C1=NC=CC(=C1)O Z1255384308 [2,0,0,0,0,0|1,0,1]=4 121 B10R1.113 CC(N)C1=CC(=CC=C1)Br Z239626864 [2,0,0,0,0,0|2,0,0]=4 122 B10R1.113 CC(N)C1=CC(=CC=C1)Cl Z56347061 [2,0,0,0,0,0|2,0,0]=4 123 B10R1.113 CC(N)C1=CC(=CC=C1)F Z56347483 [2,0,0,0,0,0|2,0,0]=4 124 B10R1.113 CC(N)C1=CC(=CC=C1)O Z426041632 [2,0,0,0,0,0|1,0,1]=4 125 B10R1.113 CC(O)C1=CC(=CC=C1)Cl Z335244960 [2,0,0,0,0,0|2,0,0]=4 126 B10R1.113 CC(O)C1=CC(=CC=C1)F Z335245218 [2,0,0,0,0,0|2,0,0]=4 127 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [2,0,0,0,0,0|1,0,1]=4 128 B10R1.113 CC1=CC=CC(=C1)C(C)N Z2284390656 [2,0,0,0,0,0|2,0,0]=4 129 B10R1.113 CC1=CC=CC(=C1)C(C)O Z445987122 [2,0,0,0,0,0|2,0,0]=4 130 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)N Z1626921284 [2,0,0,0,0,0|2,0,0]=4 131 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)O Z1127664487 [2,0,0,0,0,0|2,0,0]=4 132 B10R1.113 CC1=CC=CC(=C1)[C@H](C)N Z1626921239 [2,0,0,0,0,0|2,0,0]=4 133 B10R1.113 CC1=CC=CC(=C1)[C@H](C)O Z1127664373 [2,0,0,0,0,0|2,0,0]=4 134 B10R1.113 CN(C)C1=CC(=CC=C1)F Z1201621444 [2,0,0,0,0,0|2,0,0]=4 135 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Br Z803153182 [2,0,0,0,0,0|2,0,0]=4 136 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Cl Z360055382 [2,0,0,0,0,0|2,0,0]=4 137 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [2,0,0,0,0,0|1,0,1]=4 138 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Br Z803153180 [2,0,0,0,0,0|2,0,0]=4 139 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Cl Z360055386 [2,0,0,0,0,0|2,0,0]=4 140 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [2,0,0,0,0,0|1,0,1]=4 141 B10R1.30 CCC1=C(C=CC(=C1)Br)C Z1813137877 [2,0,0,0,0,0|2,0,0]=4 142 B10R1.30 CCC1=C(C=CC(=C1)Br)O Z1269214466 [2,0,0,0,0,0|1,0,1]=4 143 B10R1.30 CCC1=C(C=CC(=C1)F)N Z4449286205 [2,0,0,0,0,0|2,0,0]=4 144 B10R1.30 CCC1=C(C=CC(=C1)I)Br Z1269132508 [2,0,0,0,0,0|2,0,0]=4 145 B10R1.30 CCC1=C(C=CC(=C1)O)O Z1255360449 [2,0,0,0,0,0|0,0,2]=4 146 B10R1.30 CCC1=CC(=O)NC=C1Br Z1613477209 [2,0,0,0,0,0|2,0,0]=4 147 B10R1.30 CCN1C=C(C=CC1=O)N Z285226454 [2,0,0,0,0,0|2,0,0]=4 148 B12R1.76 CC(C)(C)C1=C(C=CC=C1)C=O Z1255429474 [1,1,0,0,0,0|0,0,0]=2 149 B12R1.76 CC(C)(C)C1=C(C=CC=C1)CO Z1255433283 [1,1,0,0,0,0|0,0,1]=3 150 B12R1.76 CC(C)(C)C1=C(C=NC=C1)C#N Z1198235022 [1,1,0,0,0,0|2,0,0]=4 151 B12R1.76 CC(C)(O)C1=C(C=CC=C1)C=O Z1511758915 [1,1,0,0,0,0|1,0,0]=3 152 B12R1.76 CC(F)(F)C1=C(C=CC=C1)C=O Z3243451860 [1,1,0,0,0,0|2,0,0]=4 153 B12R1.76 COC1=C(C=CC=C1)C(C)(C)N Z449374472 [1,1,0,0,0,0|1,0,1]=4 154 B12R1.76 COC1=C(C=CC=C1)C(C)(C)O Z449374410 [1,1,0,0,0,0|1,0,1]=4 155 B12R1.126 CC(C)(C)C1=C(C=C(C=C1)Cl)N Z1262627870 [1,1,0,0,0,0|1,0,0]=3 156 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)Br)F Z4574933795 [1,1,0,0,0,0|2,0,0]=4 157 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)F)Br Z4658970057 [1,1,0,0,0,0|2,0,0]=4 158 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)F)Cl Z1267881731 [1,1,0,0,0,0|2,0,0]=4 159 B12R1.126 CC(C)(N)C1=C(C=C(C=C1)F)F Z2805859055 [1,1,0,0,0,0|2,0,0]=4 160 B12R1.126 CC(C)(O)C1=C(C=C(C=C1)Br)Cl Z1486034916 [1,1,0,0,0,0|2,0,0]=4 161 B12R1.195 CC(C)(C#N)C1=C(C=CC=C1)Br Z1020847934 [1,1,0,0,0,0|1,0,1]=4 162 B12R1.195 CC(C)(C#N)C1=C(C=CC=C1)Cl Z858030358 [1,1,0,0,0,0|1,0,1]=4 163 B12R1.195 CC(C)(CN)C1=C(C=CC=C1)Br Z1020847578 [1,1,0,0,0,0|1,0,0]=3 164 B12R1.195 CC(C)(CN)C1=C(C=CC=C1)Cl Z858031312 [1,1,0,0,0,0|1,0,0]=3 165 B12R1.195 CC(C)(CN)C1=C(C=CC=C1)F Z825741310 [1,1,0,0,0,0|1,0,0]=3 166 B12R1.195 CC(N)(CO)C1=C(C=CC=C1)Cl Z4511734215 [1,1,0,0,0,0|2,0,0]=4 167 B12R1.195 CC(O)(CN)C1=C(C=CC=C1)Cl Z1020684190 [1,1,0,0,0,0|2,0,0]=4 168 B12R1.195 CC1=C(C=CC=C1)C(C)(C)CN Z725146486 [1,1,0,0,0,0|1,0,0]=3 169 B12R1.195 CC1=C(N=CC=C1)C(C)(C)CN Z1255404843 [1,1,0,0,0,0|2,0,0]=4 170 B12R1.228 CC(C)(C)C1=C(C(=CC=C1)N)O Z1723849149 [1,1,0,0,0,0|0,0,1]=3 171 B12R1.228 CC(C)(C)C1=C(C(=CC=C1)O)Cl Z1255385707 [1,1,0,0,0,0|1,0,0]=3 172 B12R1.228 CC(C)(N)C1=C(C(=CC=C1)Cl)F Z1723418831 [1,1,0,0,0,0|2,0,0]=4 173 B12R1.228 CC1=C(C(=CC=C1)C(C)(C)C)O Z1255464948 [1,1,0,0,0,0|0,0,1]=3 174 B12R1.228 CC1=C(C(=CC=C1)C(C)(C)N)C Z4658970059 [1,1,0,0,0,0|2,0,0]=4 175 B12R1.228 CC1=C(C(=CC=C1)C(C)(C)O)C Z992749066 [1,1,0,0,0,0|2,0,0]=4 176 B12R1.1010 CC(C)(N)C1=C(C=CC=C1Cl)Cl Z1262327510 [1,1,0,0,0,0|2,0,0]=4 177 B12R1.10 CC(C)(C#N)C1=CC(=CC=C1)F Z725146244 [1,1,0,0,0,0|1,0,1]=4 178 B12R1.10 CC(C)(C#N)C1=CC(=CC=C1)N Z1251415409 [1,1,0,0,0,0|1,0,1]=4 179 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)Br Z725146618 [1,1,0,0,0,0|1,0,0]=3 180 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)Cl Z725146492 [1,1,0,0,0,0|1,0,0]=3 181 B12R1.10 CC(C)(CN)C1=CC(=CC=C1)F Z725146550 [1,1,0,0,0,0|1,0,0]=3 182 B12R1.10 CC(C)(CN)C1=CC(=O)C=CN1 Z4923389973 [1,1,0,0,0,0|1,0,0]=3 183 B12R1.10 CC(C)(CN)C1=CC(=O)NC=C1 Z4926861924 [1,1,0,0,0,0|1,0,0]=3 184 B12R1.10 CC(C)(CN)C1=CC=CC(=O)N1 Z4657939558 [1,1,0,0,0,0|1,0,0]=3 185 B12R1.10 CC(C)(CO)C1=CC(=CC=C1)N Z1416169387 [1,1,0,0,0,0|1,0,0]=3 186 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)Br Z2939851870 [1,1,0,0,0,0|2,0,0]=4 187 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)N Z2752202173 [1,1,0,0,0,0|2,0,0]=4 188 B12R1.10 CC(N)(CO)C1=CC(=CC=C1)O Z2111443115 [1,1,0,0,0,0|1,0,1]=4 189 B12R1.10 CC1=CC(=CC=C1)C(C)(C)CN Z725146606 [1,1,0,0,0,0|1,0,0]=3 190 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)I)O Z1269154708 [1,1,0,0,0,0|0,0,1]=3 191 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)N)O Z2004548136 [1,1,0,0,0,0|0,0,1]=3 192 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)O)O Z104476062 [1,1,0,0,0,0|0,0,1]=3 193 B12R1.23 CC(C)(N)C1=CC(=C(C=C1)Cl)Cl Z725146798 [1,1,0,0,0,0|2,0,0]=4 194 B12R1.23 CC(C)(N)C1=CC(=C(C=C1)F)F Z1020787660 [1,1,0,0,0,0|2,0,0]=4 195 B12R1.23 CC1=C(C=CC(=C1)C(C)(C)C)N Z5875960931 [1,1,0,0,0,0|1,0,0]=3 196 B12R1.102 CC(C)(C)C1=CC(=CC(=C1)N)N Z2235674849 [1,1,0,0,0,0|1,0,0]=3 197 B12R1.102 CC(C)(C)C1=CC(=CC(=C1)O)Br Z1269170846 [1,1,0,0,0,0|0,0,1]=3 198 B12R1.102 CC(C)(C)C1=CC(=O)NC(=O)N1 Z1889710313 [1,1,0,0,0,0|2,0,0]=4 199 B12R1.102 CC(C)(N)C1=CC(=CC(=C1)Cl)Cl Z3235143349 [1,1,0,0,0,0|2,0,0]=4 200 B12R1.102 CC(C)(N)C1=CC(=CC(=C1)F)F Z3244401199 [1,1,0,0,0,0|2,0,0]=4 201 B12R1.102 CC1=CC(=CC(=C1)C(C)(C)C)C Z104498360 [1,1,0,0,0,0|1,0,0]=3 202 B12R1.436 CC(C)(C)C1=CC(=CC=C1)C=O Z1198310513 [1,1,0,0,0,0|0,0,0]=2 203 B12R1.436 CC(C)(C)C1=CC(=CC=C1)CN Z3243653645 [1,1,0,0,0,0|1,0,0]=3 204 B12R1.436 CC(C)(C)C1=CC(=CN=C1)C=O Z1255422499 [1,1,0,0,0,0|1,0,0]=3 205 B12R1.436 CC(C)(C)C1=CC(=NC=C1)C=O Z1255504498 [1,1,0,0,0,0|1,0,0]=3 206 B12R1.436 CC(C)(C)C1=CC(=NC=C1)CN Z3244923162 [1,1,0,0,0,0|2,0,0]=4 207 B12R1.436 CC(C)(N)C1=CC(=CC=C1)C#N Z2457156259 [1,1,0,0,0,0|2,0,0]=4 208 B12R1.436 CC(F)(F)C1=CC(=CC=C1)C=O Z1322795061 [1,1,0,0,0,0|2,0,0]=4 209 B12R1.436 COC1=CC(=CC=C1)C(C)(C)N Z3023980681 [1,1,0,0,0,0|1,0,1]=4 210 B12R1.46 COC1=C(C=C(C=C1)N)C(C)C Z3244866812 [1,1,0,0,0,0|1,0,1]=4 211 B12R1.232 CC1=CC(=C(C=C1Cl)C(C)C)O Z104485030 [1,1,0,0,0,0|1,0,1]=4 212 B12R1.232 CC1=CC(=C(C=C1N)C(C)C)O Z1407007577 [1,1,0,0,0,0|1,0,1]=4 213 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)Cl Z104495034 [1,1,0,0,0,0|1,0,1]=4 214 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)O Z1198148655 [1,1,0,0,0,0|0,0,2]=4 215 B12R1.232 CC1=CC(=O)C(=CC1=O)C(C)C Z1255372388 [1,1,0,0,0,0|0,0,0]=2 216 B12R1.354 CNC(C)C1=C(C=CC(=C1)F)F Z239629056 [1,1,0,0,0,0|2,0,0]=4 217 B12R1.453 CC(C)C1=C(C=CC(=C1)C#N)O Z1255467730 [1,1,0,0,0,0|1,0,1]=4 218 B12R1.1191 CC(C)(C#N)N1C(=O)C=CC1=O Z756353804 [0,1,0,0,1,0|1,0,1]=4 219 B14R1.1866 CC1=CC(=C(C=C1)CN)OC(C)(C)C Z972654974 [0,1,0,0,0,1|2,0,0]=4 220 B14R1.12 CC(C)(C)C1=C(C=CC(=C1)C(=O)O)O Z1255386783 [0,2,0,0,0,0|0,0,1]=3 221 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]=3 222 B14R1.3720 COC1=C(C=C(C=C1)C=O)C(C)(C)C Z1198156306 [0,2,0,0,0,0|0,0,1]=3 223 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]=4 224 B14R1.361 CC(C)(C)C1=C(C(=CC(=C1)Br)C=O)O Z1269199495 [0,2,0,0,0,0|1,0,1]=4 225 B12R2.88 CC1(CC1)C2=C(C=CC=C2)Br Z1269218613 [1,0,0,1,0,0|1,0,0]=3 226 B12R2.88 CC1(CC1)C2=C(C=CC=C2)N Z3034284333 [1,0,0,1,0,0|1,0,0]=3 227 B12R2.88 CC1=C(C=CC=C1)C2(CC2)N Z2429425682 [1,0,0,1,0,0|2,0,0]=4 228 B12R2.88 NC1(CC1)C2=C(C=CC=C2)Br Z3244924184 [1,0,0,1,0,0|2,0,0]=4 229 B12R2.88 NC1(CC1)C2=C(C=CC=C2)F Z1695797781 [1,0,0,1,0,0|2,0,0]=4 230 B12R2.88 NC1(CC1)C2=C(C=CC=C2)I Z2751942763 [1,0,0,1,0,0|2,0,0]=4 231 B12R2.2403 CC1(CCC2=C1C=CC=C2)N Z449371306 [1,0,0,1,0,0|2,0,0]=4 232 B12R2.2403 CC1(CCC2=C1C=CC=C2)O Z449370928 [1,0,0,1,0,0|2,0,0]=4 233 B12R2.2403 CC1(CNC2=C1C=CC=C2)C Z1413780522 [1,0,0,1,0,0|1,0,0]=3 234 B12R2.2403 CC1(CNC2=C1C=CN=C2)C Z1861999570 [1,0,0,1,0,0|2,0,0]=4 235 B12R2.2403 CC1(CNC2=C1N=CC=C2)C Z1861999568 [1,0,0,1,0,0|2,0,0]=4 236 B12R2.2403 CC1(COC2=C1C=CC=C2)N Z5094222723 [1,0,0,1,0,0|1,0,1]=4 237 B12R2.1282 CC1(CC1)C2=CC(=CC=C2)N Z3016341162 [1,0,0,1,0,0|1,0,0]=3 238 B12R2.1282 CC1=CC(=CC=C1)C2(CC2)N Z3235027684 [1,0,0,1,0,0|2,0,0]=4 239 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)Br Z1250132660 [1,0,0,1,0,0|2,0,0]=4 240 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)Cl Z1272949049 [1,0,0,1,0,0|2,0,0]=4 241 B12R2.1282 NC1(CC1)C2=CC(=CC=C2)F Z1250132685 [1,0,0,1,0,0|2,0,0]=4 242 B12R2.1316 NC1=CC(=C(C=C1)Cl)C2CC2 Z5095428568 [1,0,0,1,0,0|2,0,0]=4 243 B14R2.4491 CC1(CCC2=C(O1)C=C(C=C2)Br)C Z2681257284 [0,0,0,1,0,1|2,0,0]=4 244 B14R2.4491 CC1(CCC2=C(O1)C=C(C=C2)N)C Z5039996915 [0,0,0,1,0,1|2,0,0]=4 245 B14R2.4491 CC1(CCC2=C(O1)C=C(C=C2)O)C Z839129166 [0,0,0,1,0,1|1,0,1]=4 246 B14R2.4491 CC1(CNC2=C(O1)C=C(C=C2)Br)C Z1813183570 [0,0,0,1,0,1|2,0,0]=4 247 B14R2.4536 CC1(CCSC2=C1C=C(C=C2)Cl)C Z1416179004 [0,1,0,1,0,0|1,1,0]=4 248 B14R2.4536 CC1(CCSC2=C1C=C(C=C2)O)C Z1513902728 [0,1,0,1,0,0|0,1,1]=4 249 B14R2.4536 CC1(CNCC2=C1C=C(C=C2)F)C Z4330191890 [0,1,0,1,0,0|2,0,0]=4 250 B14R2.4536 CC1(CNCC2=C1NC(=O)C=C2)C Z4778786046 [0,1,0,1,0,0|2,0,0]=4 251 B14R2.8654 CC1=C2C(=C(C=C1)Br)NCC2(C)C Z1715300937 [0,1,0,1,0,0|2,0,0]=4 252 B14R2.8333 CC1(CNC2=C1C=C(C(=C2)F)Br)C Z3183627465 [0,1,0,1,0,0|2,0,0]=4 253 B12R1.119 CC(C)(N)CC1=CC(=CC=C1)Br Z415658564 [1,0,0,0,0,1|2,0,0]=4 254 B12R1.127 CC(C)OC1=C(C=CC(=C1)F)N Z1623872319 [1,0,0,0,0,1|2,0,0]=4 255 B12R1.127 CC(C)OC1=C(C=CC(=C1)F)O Z1255426185 [1,0,0,0,0,1|1,0,1]=4 256 B12R1.127 CC1=C(C=C(C=C1)N)OC(C)C Z1895741280 [1,0,0,0,0,1|2,0,0]=4 257 B12R1.127 CC1=CC(=C(C=C1)C)NC(C)C Z267155660 [1,0,0,0,0,1|2,0,0]=4 258 B14R1.6073 CC(C)(C)NCC1=C(C=CC(=C1)Cl)O Z239630380 [0,0,0,0,0,2|1,0,1]=4 259 B9R1.6 CC(C)C1=NC=CC=C1 Z1198148831 [3,0,0,0,0,0|1,0,0]=4 260 B9R1.6 CC(N)C1=CC=CC=C1 Z57102377 [3,0,0,0,0,0|1,0,0]=4 261 B9R1.6 CC(O)C1=CC=CC=C1 Z104494956 [3,0,0,0,0,0|1,0,0]=4 262 B9R1.6 C[C@@H](N)C1=CC=CC=C1 Z1079183182 [3,0,0,0,0,0|1,0,0]=4 263 B9R1.6 C[C@@H](O)C1=CC=CC=C1 Z360055166 [3,0,0,0,0,0|1,0,0]=4 264 B9R1.6 C[C@H](N)C1=CC=CC=C1 Z1079131570 [3,0,0,0,0,0|1,0,0]=4 265 B9R1.6 C[C@H](O)C1=CC=CC=C1 Z360055168 [3,0,0,0,0,0|1,0,0]=4 266 B9R1.15 CCC1=C(C=CC=C1)Br Z1255457372 [3,0,0,0,0,0|1,0,0]=4 267 B9R1.15 CCC1=C(C=CC=C1)O Z104477226 [3,0,0,0,0,0|0,0,1]=4 268 B9R1.2 CCC1=CC(=CC=C1)Br Z1201619408 [3,0,0,0,0,0|1,0,0]=4 269 B9R1.2 CCC1=CC(=CC=C1)N Z104478688 [3,0,0,0,0,0|1,0,0]=4 270 B9R1.69 CC1=CC(=O)C=CC1=O Z57248271 [3,0,0,0,0,0|0,0,0]=3 271 B11R1.7 CC(C)(C#N)C1=CC=CC=C1 Z339435272 [2,1,0,0,0,0|0,0,1]=4 272 B11R1.7 CC(C)(C=O)C1=CC=CC=C1 Z1079442604 [2,1,0,0,0,0|0,0,1]=4 273 B11R1.7 CC(C)(CN)C1=CC=CC=C1 Z291234238 [2,1,0,0,0,0|0,0,0]=3 274 B11R1.7 CC(C)(CN)C1=CN=CC=C1 Z1255424681 [2,1,0,0,0,0|1,0,0]=4 275 B11R1.7 CC(C)(CO)C1=CC=CC=C1 Z397587218 [2,1,0,0,0,0|0,0,0]=3 276 B11R1.7 CC(C)(CO)C1=NC=CC=C1 Z1216821531 [2,1,0,0,0,0|1,0,0]=4 277 B11R1.7 CC(F)(CN)C1=CC=CC=C1 Z2768234774 [2,1,0,0,0,0|1,0,0]=4 278 B11R1.7 CC(N)(CO)C1=CC=CC=C1 Z734150992 [2,1,0,0,0,0|1,0,0]=4 279 B11R1.7 CC(O)(CN)C1=CC=CC=C1 Z979721628 [2,1,0,0,0,0|1,0,0]=4 280 B11R1.7 CCC(C)(N)C1=CC=CC=C1 Z449373366 [2,1,0,0,0,0|1,0,0]=4 281 B11R1.7 CCC(C)(O)C1=CC=CC=C1 Z449373348 [2,1,0,0,0,0|1,0,0]=4 282 B11R1.7 CNC(C)(C)C1=CC=CC=C1 Z991114970 [2,1,0,0,0,0|0,0,0]=3 283 B11R1.19 CC(C)(C)C1=CC=C(C=C1)Br Z299596150 [2,1,0,0,0,0|0,0,0]=3 284 B11R1.19 CC(C)(C)C1=CC=C(C=C1)N Z104473848 [2,1,0,0,0,0|0,0,0]=3 285 B11R1.19 CC(C)(C)C1=CC=C(C=C1)O Z57127886 [2,1,0,0,0,0|0,0,0]=3 286 B11R1.19 CC(C)(C)C1=CNC(=O)C=C1 Z2284401490 [2,1,0,0,0,0|1,0,0]=4 287 B11R1.19 CC(C)(C)C1=NC=C(C=C1)N Z2935931505 [2,1,0,0,0,0|1,0,0]=4 288 B11R1.19 CC(C)(N)C1=CC=C(C=C1)Br Z406678874 [2,1,0,0,0,0|1,0,0]=4 289 B11R1.19 CC(C)(N)C1=CC=C(C=C1)Cl Z449374202 [2,1,0,0,0,0|1,0,0]=4 290 B11R1.19 CC(C)(N)C1=CC=C(C=C1)F Z449374056 [2,1,0,0,0,0|1,0,0]=4 291 B11R1.19 CC(C)(N)C1=CC=C(C=C1)I Z5225137620 [2,1,0,0,0,0|1,0,0]=4 292 B11R1.19 CC(C)(O)C1=CC=C(C=C1)Br Z449374220 [2,1,0,0,0,0|1,0,0]=4 293 B11R1.19 CC(C)(O)C1=CC=C(C=C1)O Z1198750150 [2,1,0,0,0,0|1,0,0]=4 294 B11R1.53 CC(C)C1=C(C=CC=C1)C=O Z1171158413 [2,1,0,0,0,0|0,0,0]=3 295 B11R1.53 CC(C)C1=C(C=CC=N1)C=O Z1255398088 [2,1,0,0,0,0|1,0,0]=4 296 B11R1.53 CC(C)C1=C(C=CN=C1)C=O Z1255393915 [2,1,0,0,0,0|1,0,0]=4 297 B11R1.53 CN(C)C1=C(C=CC=C1)C=O Z335439980 [2,1,0,0,0,0|1,0,0]=4 298 B11R1.53 CNC1=C(C=CC=C1)C(C)C Z335263032 [2,1,0,0,0,0|1,0,0]=4 299 B11R1.159 CC(C)C1=C(C(=CC=C1)F)N Z4997400271 [2,1,0,0,0,0|1,0,0]=4 300 B11R1.159 CC1=C(C=CC=C1N)C(C)C Z2740750367 [2,1,0,0,0,0|1,0,0]=4 301 B11R1.159 CC1=CC=CC(=C1N)C(C)C Z3676142304 [2,1,0,0,0,0|1,0,0]=4 302 B11R1.166 CC(C)C1=C(C=C(C=C1)Br)F Z1486025406 [2,1,0,0,0,0|1,0,0]=4 303 B11R1.166 CC(C)C1=C(C=C(C=C1)F)N Z4697442277 [2,1,0,0,0,0|1,0,0]=4 304 B11R1.166 CC(C)C1=C(C=C(C=C1)N)F Z1262668944 [2,1,0,0,0,0|1,0,0]=4 305 B11R1.166 CC(C)C1=C(C=C(C=C1)N)N Z1198148869 [2,1,0,0,0,0|1,0,0]=4 306 B11R1.166 CC1=C(C=CC(=C1)Br)C(C)C Z1861997013 [2,1,0,0,0,0|1,0,0]=4 307 B11R1.166 CC1=C(C=CC(=C1)O)C(C)C Z104476618 [2,1,0,0,0,0|1,0,0]=4 308 B11R1.166 CC1=CC(=C(C=C1)C(C)C)O Z57127464 [2,1,0,0,0,0|0,0,1]=4 309 B11R1.222 CNC(C)C1=C(C=CC=C1)Br Z1497158706 [2,1,0,0,0,0|1,0,0]=4 310 B11R1.222 CNC(C)C1=C(C=CC=C1)C Z159528196 [2,1,0,0,0,0|1,0,0]=4 311 B11R1.222 CNC(C)C1=C(C=CC=C1)Cl Z138106016 [2,1,0,0,0,0|1,0,0]=4 312 B11R1.222 CNC(C)C1=C(C=CC=C1)O Z316170358 [2,1,0,0,0,0|0,0,1]=4 313 B11R1.21 CC(C)C1=CC(=C(C=C1)F)N Z4722235861 [2,1,0,0,0,0|1,0,0]=4 314 B11R1.21 CC(C)C1=CC(=C(C=C1)N)Cl Z1262643307 [2,1,0,0,0,0|1,0,0]=4 315 B11R1.21 CC(C)C1=CC(=C(C=C1)N)N Z1198154332 [2,1,0,0,0,0|1,0,0]=4 316 B11R1.21 CC(C)C1=CC(=C(C=C1)O)N Z57441596 [2,1,0,0,0,0|1,0,0]=4 317 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O Z104496566 [2,1,0,0,0,0|0,0,1]=4 318 B11R1.23 CC(CN)C1=CC(=CC=C1)Br Z5094147873 [2,1,0,0,0,0|1,0,0]=4 319 B11R1.23 CC(CN)C1=CC(=CC=C1)F Z415654914 [2,1,0,0,0,0|1,0,0]=4 320 B11R1.23 CC(CN)C1=CC=CC(=O)N1 Z4656721256 [2,1,0,0,0,0|1,0,0]=4 321 B11R1.23 CC(CO)C1=CC(=CC=C1)Br Z1269177166 [2,1,0,0,0,0|1,0,0]=4 322 B11R1.23 CC(CO)C1=CC(=CC=C1)Cl Z1222424631 [2,1,0,0,0,0|1,0,0]=4 323 B11R1.23 CNC(C)C1=CC(=CC=C1)Cl Z159528162 [2,1,0,0,0,0|1,0,0]=4 324 B11R1.23 CNC(C)C1=CC(=CC=C1)O Z1266854844 [2,1,0,0,0,0|0,0,1]=4 325 B11R1.23 COC(C)C1=CC(=CC=C1)N Z801781454 [2,1,0,0,0,0|1,0,0]=4 326 B11R1.23 CSC(C)C1=CC(=CC=C1)N Z801781922 [2,1,0,0,0,0|1,0,0]=4 327 B11R1.74 CC(C)C1=CC(=CC(=C1)N)F Z4946679480 [2,1,0,0,0,0|1,0,0]=4 328 B11R1.74 CC(C)C1=CC(=CC(=O)O1)O Z1198170475 [2,1,0,0,0,0|1,0,0]=4 329 B11R1.74 CC1=CC(=CC(=C1)O)C(C)C Z104479096 [2,1,0,0,0,0|0,0,1]=4 330 B11R1.266 CC(C)C1=CC(=CC=C1)C=O Z1162448800 [2,1,0,0,0,0|0,0,0]=3 331 B11R1.266 CC(C)C1=CC(=CN=C1)C=O Z1255398379 [2,1,0,0,0,0|1,0,0]=4 332 B11R1.266 CC(C)C1=NC=CC(=C1)C=O Z1255390052 [2,1,0,0,0,0|1,0,0]=4 333 B11R1.266 CN(C)C1=CC(=CC=C1)C=O Z1079442658 [2,1,0,0,0,0|1,0,0]=4 334 B11R1.266 CNC1=CC(=CC=C1)C(C)C Z362639302 [2,1,0,0,0,0|1,0,0]=4 335 B11R1.266 C[C@@H](O)C1=CC(=CC=C1)C=O Z1511906513 [2,1,0,0,0,0|1,0,0]=4 336 B11R1.37 CCC1=C(C=CC(=C1)F)C=O Z2472525340 [2,1,0,0,0,0|1,0,0]=4 337 B11R1.37 CCC1=C(C=CC(=C1)O)C=O Z1255421932 [2,1,0,0,0,0|0,0,1]=4 338 B11R1.280 CCC1=C(C=CC(=C1)C=O)F Z1255357885 [2,1,0,0,0,0|1,0,0]=4 339 B11R1.45 CC(C)(C)C1=CC(=CS1)C=O Z1511755849 [1,1,0,0,1,0|1,0,0]=4 340 B11R1.45 CC(C)(C)C1=CC=C(S1)C=O Z1416289198 [1,1,0,0,1,0|1,0,0]=4 341 B11R1.45 CC(C)(C)N1C=CC(=C1)C=O Z274531498 [1,1,0,0,1,0|1,0,0]=4 342 B11R1.875 CC(CO)N1C(=O)C=CC1=O Z763781706 [1,1,0,0,1,0|1,0,0]=4 343 B13R1.80 CC(C)(C)OC1=CC(=CC=C1)C=O Z1198160195 [1,1,0,0,0,1|0,0,0]=3 344 B13R1.80 CC(C)(C)OC1=CC(=CC=C1)CN Z2753220258 [1,1,0,0,0,1|1,0,0]=4 345 B13R1.250 CC(C)(CN)CC1=CC(=CC=C1)Br Z2235409208 [1,1,0,0,0,1|1,0,0]=4 346 B13R1.250 CC(C)(CN)CC1=CC(=CC=C1)Cl Z995183126 [1,1,0,0,0,1|1,0,0]=4 347 B13R1.518 CC1=C(C=CC(=C1)SC(C)(C)C)N Z419012526 [1,1,0,0,0,1|1,0,0]=4 348 B13R1.3492 CC(C)(C)C(=O)C1=CC(=CC=C1)F Z513735884 [1,1,0,0,0,1|1,0,0]=4 349 B13R1.3492 CC(C)(C)C(N)C1=CC(=CC=C1)F Z513798266 [1,1,0,0,0,1|1,0,0]=4 350 B13R1.3492 CC1=CC(=CC=C1)C(=O)C(C)(C)C Z513735876 [1,1,0,0,0,1|1,0,0]=4 351 B13R1.3492 CC1=CC(=CC=C1)C(N)C(C)(C)C Z513798256 [1,1,0,0,0,1|1,0,0]=4 352 B13R1.3089 CC(C)SC1=C(C=CC(=C1)Br)C=O Z1157748448 [1,1,0,0,0,1|1,0,0]=4 353 B13R1.349 CC(=O)C1=C(C=CC=C1)C(C)(C)C Z1251362309 [1,2,0,0,0,0|0,0,0]=3 354 B13R1.349 CC(C)(C)C1=C(C=CC=C1)B(O)O Z1217194913 [1,2,0,0,0,0|0,0,1]=4 355 B13R1.349 CC(C)(C)C1=C(C=CC=C1)C(=O)O Z1198187055 [1,2,0,0,0,0|0,0,0]=3 356 B13R1.349 CC(C)(C)C1=C(C=NC=C1)C(=O)O Z2238539860 [1,2,0,0,0,0|1,0,0]=4 357 B13R1.349 CC(C)(C)C1=C(N=CC=C1)C(=O)O Z3476723439 [1,2,0,0,0,0|1,0,0]=4 358 B13R1.349 CC(C)(N)C1=C(C=CC=C1)[N+](=O)[O-] Z1258979208 [1,2,0,0,0,0|1,0,0]=4 359 B13R1.381 CCNC1=C(C=CC=C1)C(C)(C)C Z445301988 [1,2,0,0,0,0|1,0,0]=4 360 B13R1.381 CNCC1=C(C=CC=C1)C(C)(C)C Z3847414831 [1,2,0,0,0,0|1,0,0]=4 361 B13R1.2129 COC1=C(C=CC=C1)C(C)(C)CN Z725146544 [1,2,0,0,0,0|0,0,1]=4 362 B13R1.96 CC(C)(C)C1=C(C=C(C=C1)C=O)O Z1255358849 [1,2,0,0,0,0|0,0,1]=4 363 B13R1.884 CC1=C(C(=C(C=C1)C(C)(C)C)O)F Z1513889937 [1,2,0,0,0,0|0,0,1]=4 364 B13R1.4183 CC(C)(CN)C1=C(C=C(C=C1)Br)Cl Z1813168755 [1,2,0,0,0,0|1,0,0]=4 365 B13R1.4183 CC(C)(CN)C1=C(C=C(C=C1)F)Br Z5384940106 [1,2,0,0,0,0|1,0,0]=4 366 B13R1.4183 CC(C)(CN)C1=C(C=C(C=C1)F)Cl Z1080447132 [1,2,0,0,0,0|1,0,0]=4 367 B13R1.4183 CC1=CC(=C(C=C1)C(C)(C)CN)C Z1255459793 [1,2,0,0,0,0|1,0,0]=4 368 B13R1.7 CC(C)(CN)C1=C(C(=CC=C1)Cl)F Z1708090075 [1,2,0,0,0,0|1,0,0]=4 369 B13R1.2711 CC(CO)(CO)C1=C(C=CC=C1)F Z1322546700 [1,2,0,0,0,0|1,0,0]=4 370 B13R1.2819 CC(C)(CCO)C1=C(C=CC=C1)O Z1513810267 [1,2,0,0,0,0|0,0,1]=4 371 B13R1.8256 CC(C)(CN)C1=C(C=CC=C1Cl)Cl Z1263824429 [1,2,0,0,0,0|1,0,0]=4 372 B13R1.8256 CC(C)(CN)C1=C(C=CC=C1F)Cl Z1263820359 [1,2,0,0,0,0|1,0,0]=4 373 B13R1.645 CC(C)(C)C1=C(C(=CC=C1)C=O)O Z1255387194 [1,2,0,0,0,0|0,0,1]=4 374 B13R1.272 CC(C)(CN)C1=CC(=C(C=C1)Cl)Cl Z725146602 [1,2,0,0,0,0|1,0,0]=4 375 B13R1.272 CC(C)(CO)C1=CC(=C(C=C1)Cl)Cl Z1269134025 [1,2,0,0,0,0|1,0,0]=4 376 B13R1.272 CCC(C)(C)C1=CC(=C(C=C1)O)Cl Z1198147677 [1,2,0,0,0,0|1,0,0]=4 377 B13R1.3040 COC1=CC(=CC=C1)C(C)(C)CN Z801752006 [1,2,0,0,0,0|0,0,1]=4 378 B13R1.38 CC(C)(C)C1=CC(=C(C=C1)C=O)Br Z1269242987 [1,2,0,0,0,0|1,0,0]=4 379 B13R1.38 CC(C)(C)C1=CC(=C(C=C1)C=O)O Z1201623529 [1,2,0,0,0,0|0,0,1]=4 380 B13R1.38 CC(C)(C)C1=CC=C(C(=O)N1)C#N Z432102182 [1,2,0,0,0,0|1,0,0]=4 381 B13R1.38 CC(C)(C)C1=CC=C(C(=O)N1)CN Z2690874820 [1,2,0,0,0,0|1,0,0]=4 382 B13R1.50 COC1=C(C=CC(=C1)C(C)(C)C)O Z1255435164 [1,2,0,0,0,0|0,0,1]=4 383 B13R1.57 CC(C)(C)C1=CC(=CC(=C1)O)C=O Z1255433789 [1,2,0,0,0,0|0,0,0]=3 384 B13R1.345 CC(C)(C)C1=CC(=CC=C1)B(O)O Z1741969639 [1,2,0,0,0,0|0,0,1]=4 385 B13R1.345 CC(C)(C)C1=CC(=CC=C1)C(=O)O Z1201621071 [1,2,0,0,0,0|0,0,0]=3 386 B13R1.345 CC(C)(C)C1=CC(=CN=C1)C(=O)O Z3377866418 [1,2,0,0,0,0|1,0,0]=4 387 B13R1.345 CC(C)(C)C1=CC(=NC=C1)C(=O)O Z3244601025 [1,2,0,0,0,0|1,0,0]=4 388 B13R1.345 CC(C)(C)C1=NC(=CC=C1)C(=O)O Z1255491592 [1,2,0,0,0,0|1,0,0]=4 389 B13R1.345 CC(C)(C)C1=NC=CC(=C1)C(=O)O Z1198164134 [1,2,0,0,0,0|1,0,0]=4 390 B13R1.375 CC(C)(C)C1=CC(=CC=C1)CCN Z1198264307 [1,2,0,0,0,0|1,0,0]=4 391 B13R1.375 CNCC1=CC(=CC=C1)C(C)(C)C Z4997704488 [1,2,0,0,0,0|1,0,0]=4 392 B13R1.2430 COC1=C(C=C(C=C1)C=O)C(C)C Z1198168466 [1,2,0,0,0,0|0,0,1]=4 393 B13R1.651 CC(C)C1=C(C=C(C(=C1)C=O)O)O Z1416177459 [1,2,0,0,0,0|0,0,1]=4 394 B13R1.13 CC(C)C1=C(C=CC(=C1)C(=O)O)O Z1255501223 [1,2,0,0,0,0|0,0,1]=4 395 B13R1.13 CC(C)N1C=C(C=CC1=O)C(=O)O Z854062484 [1,2,0,0,0,0|1,0,0]=4 396 B11R1.424 CC1=C(C(CC=C1)(C)C)C=O Z1255446334 [1,0,1,1,0,0|1,0,0]=4 397 B11R2.40 CC1(CO1)C2=CC=CC=C2 Z813010616 [2,0,0,1,0,0|1,0,0]=4 398 B11R2.40 NC1(CC1)C2=CC=CC=C2 Z1262398449 [2,0,0,1,0,0|1,0,0]=4 399 B11R2.1 CC1CNC2=C1C=CC=C2 Z415739264 [2,0,0,1,0,0|1,0,0]=4 400 B11R2.55 NC1=C(C=CC=C1)C2CC2 Z336079888 [2,0,0,1,0,0|1,0,0]=4 401 B11R2.35 NC1=CC(=CC=C1)C2CC2 Z992239700 [2,0,0,1,0,0|1,0,0]=4 402 B11R2.35 O=C1C=COC(=C1)C2CC2 Z4461966095 [2,0,0,1,0,0|1,0,0]=4 403 B11R2.35 OC1=CC(=CC=C1)C2CC2 Z1198170922 [2,0,0,1,0,0|0,0,1]=4 404 B11R2.206 O=C1C=CC(=O)N1C2CC2 Z166648620 [1,0,0,1,1,0|1,0,0]=4 405 B13R2.3108 CC1(CNC2=C1C=CC(=C2)Cl)C Z1416188766 [1,1,0,1,0,0|1,0,0]=4 406 B13R2.359 CC1(C2=C(C=CC=C2)CC1N)C Z5181794095 [1,1,0,1,0,0|1,0,0]=4 407 B13R2.359 CC1=NC2=C(C1(C)C)C=CC=C2 Z339406798 [1,1,0,1,0,0|1,0,0]=4 408 B13R2.359 CC1NC2=C(C1(C)C)C=CC=C2 Z1262562152 [1,1,0,1,0,0|1,0,0]=4 409 B13R2.2531 CC1(COC2=C1C=CC=C2)CN Z5185116445 [1,1,0,1,0,0|0,0,1]=4 410 B13R2.2552 CC1=C(C=CC=C1)C2(CC2)CN Z361883770 [1,1,0,1,0,0|1,0,0]=4 411 B13R2.2552 NCC1(CC1)C2=C(C=CC=C2)Br Z1020847572 [1,1,0,1,0,0|1,0,0]=4 412 B13R2.2552 NCC1(CC1)C2=C(C=CC=C2)Cl Z858031306 [1,1,0,1,0,0|1,0,0]=4 413 B13R2.2552 NCC1(CC1)C2=C(C=CC=C2)F Z825741304 [1,1,0,1,0,0|1,0,0]=4 414 B13R2.3570 CC1(CC1N)C2=C(C=CC=C2)Cl Z1250132353 [1,1,0,1,0,0|1,0,0]=4 415 B13R2.3570 CC1(CC1N)C2=C(C=CC=C2)F Z1259162122 [1,1,0,1,0,0|1,0,0]=4 416 B13R2.3570 CC1=C(C=CC=C1)C2(CC2N)C Z1259162043 [1,1,0,1,0,0|1,0,0]=4 417 B13R2.13023 CC1(CNC2=C1C(=CC=C2)Cl)C Z1342208389 [1,1,0,1,0,0|1,0,0]=4 418 B13R2.100 NC1=CC(=CC=C1)C2(CC2)CO Z1416184930 [1,1,0,1,0,0|1,0,0]=4 419 B13R2.100 NCC1(CC1)C2=CC(=CC=C2)Br Z390130896 [1,1,0,1,0,0|1,0,0]=4 420 B13R2.100 NCC1(CC1)C2=CC(=CC=C2)Cl Z361883782 [1,1,0,1,0,0|1,0,0]=4 421 B13R2.100 NCC1(CC1)C2=CC(=CC=C2)F Z361883914 [1,1,0,1,0,0|1,0,0]=4 422 B13R2.3019 CC1(CC1N)C2=CC(=CC=C2)F Z1695926124 [1,1,0,1,0,0|1,0,0]=4 423 B13R2.66 O=CC1=C(C=C(C=C1)F)C2CC2 Z1948202327 [1,1,0,1,0,0|1,0,0]=4 424 B13R2.2169 CC1=C(C=C(C=C1)C=O)C2CC2 Z1778471152 [1,1,0,1,0,0|1,0,0]=4 425 B13R2.8674 O=C1C=CC(=O)N1C2(CC2)CO Z1713209580 [0,1,0,1,1,0|1,0,0]=4 426 B15R2.63911 CC1(CC(=O)C2=C(C1)NC(=O)C=C2)C Z1198233894 [0,1,0,1,0,1|1,0,0]=4 427 B15R2.63911 CC1(CC(=O)C2=C(O1)C=C(C=C2)Br)C Z1269148458 [0,1,0,1,0,1|1,0,0]=4 428 B15R2.63911 CC1(CC(=O)C2=C(O1)C=C(C=C2)F)C Z1255388984 [0,1,0,1,0,1|1,0,0]=4 429 B15R2.63911 CC1(CC(=O)C2=C(O1)C=C(C=C2)O)C Z839129162 [0,1,0,1,0,1|0,0,1]=4 430 B15R2.4775 CC1(CCC2=C(O1)C=C(C=C2)C=O)C Z1511814596 [0,1,0,1,0,1|1,0,0]=4 431 B15R2.1542 CC1(CC1)C2=C(C=CC(=C2)C(=O)O)F Z4909857127 [0,2,0,1,0,0|1,0,0]=4 432 B15R2.67862 CC1(CNC2=C1C=C(C=C2)C(=O)O)C Z1617983906 [0,2,0,1,0,0|1,0,0]=4 433 B15R2.67862 CC1(CNC2=C1C=C(C=C2)[N+](=O)[O-])C Z5161369368 [0,2,0,1,0,0|1,0,0]=4 434 B15R2.67862 CC1(COC2=C1C=C(C=C2)C(=O)O)C Z1255505224 [0,2,0,1,0,0|0,0,1]=4 435 B15R2.4845 CC1(CCOC2=C1C=C(C=C2)C=O)C Z1255448899 [0,2,0,1,0,0|0,0,1]=4 436 B15R2.13973 CC1(CC(=O)OC2=C1C=C(C=C2)O)C Z1513816576 [0,2,0,1,0,0|0,0,1]=4 437 B9R1.19 CC(C)(C)N1C=CC=C1 Z55892217 [2,0,0,0,1,0|1,0,0]=4 438 B9R1.27 CCN1C(=O)C=CC1=O Z205012234 [2,0,0,0,1,0|1,0,0]=4 439 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [2,0,0,0,0,1|1,0,0]=4 440 B11R1.157 CC(C)NC1=CC(=CC=C1)Br Z266469772 [2,0,0,0,0,1|1,0,0]=4 441 B11R1.157 CC(C)NC1=CC(=CC=C1)F Z266497380 [2,0,0,0,0,1|1,0,0]=4 442 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [2,0,0,0,0,1|0,0,1]=4 443 B11R1.157 CC(C)OC1=CC(=CC=C1)Br Z53833977 [2,0,0,0,0,1|1,0,0]=4 444 B11R1.157 CC(C)OC1=CC(=CC=C1)N Z239604760 [2,0,0,0,0,1|1,0,0]=4 445 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [2,0,0,0,0,1|0,0,1]=4