0 B12R1.19 CC(=O)CC1=CC(=C(C=C1)Br)F Z1269186824 [0,0,0,0,0,0|3,0,1]=4 1 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [0,0,0,0,0,0|2,0,1]=3 2 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,0,0,0,0,0|3,0,1]=4 3 B12R1.19 CC(C)NC1=CC(=C(C=C1)Cl)Cl Z267194630 [0,0,0,0,0,0|4,0,0]=4 4 B12R1.19 CC(C)OC1=CC(=C(C=C1)N)Cl Z955172598 [0,0,0,0,0,0|4,0,0]=4 5 B12R1.19 CC(C)OC1=CC(=C(C=C1)N)F Z839157364 [0,0,0,0,0,0|4,0,0]=4 6 B12R1.19 CC(N)CC1=CC(=C(C=C1)F)Br Z285144030 [0,0,0,0,0,0|2,0,0]=2 7 B12R1.19 CC(N)CC1=CC(=C(C=C1)O)O Z1891776857 [0,0,0,0,0,0|0,0,0]=0 8 B12R1.19 CC(O)CC1=CC(=C(C=C1)Br)F Z1295686053 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)O Z1198166108 [0,0,0,0,0,0|3,0,1]=4 10 B12R1.19 CC1=C(C=C(C=C1)CC(C)N)F Z4098107054 [0,0,0,0,0,0|2,0,0]=2 11 B12R1.19 CC1=C(C=C(C=C1)CN(C)C)N Z335289232 [0,0,0,0,0,0|4,0,0]=4 12 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,0,0,0,0,0|3,0,1]=4 13 B12R1.19 CC1=C(C=CC(=C1)CN(C)C)N Z335289244 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.19 CC1=C(C=CC(=C1)OC(C)C)N Z239604804 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.19 CN(C)CC1=CC(=C(C=C1)N)F Z1097100932 [0,0,0,0,0,0|4,0,0]=4 16 B12R1.19 CN(C)CC1=CC(=C(C=C1)O)Cl Z1945695050 [0,0,0,0,0,0|3,0,0]=3 17 B12R1.19 CS(=O)CC1=CC(=C(C=C1)Cl)N Z802580892 [0,0,0,0,0,0|4,0,0]=4 18 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [0,0,0,0,0,0|3,0,1]=4 19 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,0,0,0,0,0|3,0,1]=4 20 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,0,0,0,0,0|3,0,1]=4 21 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,0,0,0,0,0|2,0,1]=3 22 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [1,0,0,0,0,0|2,0,1]=4 23 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [1,0,0,0,0,0|2,0,1]=4 24 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [1,0,0,0,0,0|2,0,1]=4 25 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [1,0,0,0,0,0|2,0,0]=3 26 B11R1.20 CC(C)CC1=NC=C(C=C1)Br Z1269179231 [1,0,0,0,0,0|3,0,0]=4 27 B11R1.20 CC(C)NC1=CC=C(C=C1)Cl Z993967140 [1,0,0,0,0,0|3,0,0]=4 28 B11R1.20 CC(C)NC1=CC=C(C=C1)F Z266481896 [1,0,0,0,0,0|3,0,0]=4 29 B11R1.20 CC(C)OC1=CC=C(C=C1)Br Z53834735 [1,0,0,0,0,0|3,0,0]=4 30 B11R1.20 CC(C)OC1=CC=C(C=C1)I Z54181200 [1,0,0,0,0,0|3,0,0]=4 31 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [1,0,0,0,0,0|0,0,0]=1 32 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [1,0,0,0,0,0|2,0,1]=4 33 B11R1.20 CC1=CC=C(C=C1)NC(C)C Z992717194 [1,0,0,0,0,0|3,0,0]=4 34 B11R1.20 CC1=CC=C(C=C1)OC(C)C Z53834229 [1,0,0,0,0,0|3,0,0]=4 35 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [1,0,0,0,0,0|3,0,0]=4 36 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [1,0,0,0,0,0|2,0,1]=4 37 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [1,0,0,0,0,0|2,0,1]=4 38 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [1,0,0,0,0,0|2,0,1]=4 39 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [1,0,0,0,0,0|2,0,1]=4 40 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [1,0,0,0,0,0|2,0,1]=4 41 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [1,0,0,0,0,0|2,0,1]=4 42 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [1,0,0,0,0,0|2,0,1]=4 43 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,0,0,0,0,0|2,0,1]=4 44 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,0,0,0,0,0|2,0,1]=4 45 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,0,0,0,0,0|2,0,1]=4 46 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [1,0,0,0,0,0|2,0,1]=4 47 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [1,0,0,0,0,0|2,0,0]=3 48 B11R1.157 CC(C)CC1=CC(=NC=C1)N Z1197889925 [1,0,0,0,0,0|3,0,0]=4 49 B11R1.157 CC(C)NC1=CC(=CC=C1)Br Z266469772 [1,0,0,0,0,0|3,0,0]=4 50 B11R1.157 CC(C)NC1=CC(=CC=C1)F Z266497380 [1,0,0,0,0,0|3,0,0]=4 51 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.157 CC(C)OC1=CC(=CC=C1)Br Z53833977 [1,0,0,0,0,0|3,0,0]=4 53 B11R1.157 CC(C)OC1=CC(=CC=C1)N Z239604760 [1,0,0,0,0,0|3,0,0]=4 54 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [1,0,0,0,0,0|1,0,0]=2 56 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [1,0,0,0,0,0|1,0,0]=2 57 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [1,0,0,0,0,0|0,0,0]=1 58 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [1,0,0,0,0,0|2,0,0]=3 59 B11R1.157 CN(C)CC1=CC(=CC=C1)N Z285162888 [1,0,0,0,0,0|3,0,0]=4 60 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [1,0,0,0,0,0|3,0,0]=4 61 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,0,0,0,0,0|2,0,1]=4 62 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,0,0,0,0,0|2,0,1]=4 63 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,0,0,0,0,0|2,0,1]=4 64 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,0,0,0,0,0|2,0,1]=4 65 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,0,0,0,0,0|1,0,1]=3 66 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [1,0,0,0,0,0|2,0,1]=4 67 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [1,0,0,0,0,0|2,0,1]=4 68 B11R1.157 NC1=CC(=CC=C1)CC(F)F Z4075414750 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,0,0,0,0,0|2,0,1]=4 70 B11R1.192 CC1=C(C=C(C=C1)CCN)C Z2526366647 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.192 CC1=C(C=C(C=C1)CCN)Cl Z4330614334 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.192 CC1=C(C=CC(=C1)CC#N)O Z1255368240 [1,0,0,0,0,0|1,0,2]=4 73 B11R1.192 CC1=C(C=CC(=C1)CCN)Br Z1269233616 [1,0,0,0,0,0|2,0,0]=3 74 B11R1.192 CC1=C(C=CC(=C1)CCN)Cl Z1198178622 [1,0,0,0,0,0|2,0,0]=3 75 B11R1.192 CC1=C(C=CC(=C1)CCN)F Z1682072426 [1,0,0,0,0,0|2,0,0]=3 76 B11R1.192 CCNC1=CC(=C(C=C1)C)C Z5214919889 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.192 CCNC1=CC(=C(C=C1)C)F Z2306658828 [1,0,0,0,0,0|3,0,0]=4 78 B11R1.192 CCNC1=CC(=C(C=C1)F)C Z2756154226 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.192 CCNC1=CC(=C(C=C1)F)Cl Z286408112 [1,0,0,0,0,0|3,0,0]=4 80 B11R1.192 CCNC1=CC(=C(C=C1)F)F Z334934070 [1,0,0,0,0,0|3,0,0]=4 81 B11R1.192 CCOC1=CC(=C(C=C1)Br)F Z1185888453 [1,0,0,0,0,0|3,0,0]=4 82 B11R1.192 CCOC1=CC(=C(C=C1)Cl)N Z1255357315 [1,0,0,0,0,0|3,0,0]=4 83 B11R1.192 CCOC1=CC(=C(C=C1)N)F Z2327883785 [1,0,0,0,0,0|3,0,0]=4 84 B11R1.192 CNCC1=CC(=C(C=C1)Br)Br Z6011701708 [1,0,0,0,0,0|3,0,0]=4 85 B11R1.192 CNCC1=CC(=C(C=C1)Br)Cl Z5321384345 [1,0,0,0,0,0|3,0,0]=4 86 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [1,0,0,0,0,0|3,0,0]=4 87 B11R1.192 CNCC1=CC(=C(C=C1)C)Cl Z5390415454 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.192 CNCC1=CC(=C(C=C1)C)F Z385447006 [1,0,0,0,0,0|3,0,0]=4 89 B11R1.192 CNCC1=CC(=C(C=C1)Cl)Cl Z56963342 [1,0,0,0,0,0|3,0,0]=4 90 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [1,0,0,0,0,0|3,0,0]=4 91 B11R1.192 CNCC1=CC(=C(C=C1)F)F Z102767736 [1,0,0,0,0,0|3,0,0]=4 92 B11R1.192 CSCC1=CC(=C(C=C1)Cl)N Z732207352 [1,0,0,0,0,0|3,0,0]=4 93 B11R1.192 NCCC1=CC(=C(C=C1)Br)Cl Z5222342336 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.192 NCCC1=CC(=C(C=C1)Cl)Cl Z285143770 [1,0,0,0,0,0|2,0,0]=3 95 B11R1.192 NCCC1=CC(=C(C=C1)Cl)F Z2681241887 [1,0,0,0,0,0|2,0,0]=3 96 B11R1.192 NCCC1=CC(=C(C=C1)F)Br Z752370708 [1,0,0,0,0,0|2,0,0]=3 97 B11R1.192 NCCC1=CC(=C(C=C1)F)Cl Z4607148848 [1,0,0,0,0,0|2,0,0]=3 98 B11R1.192 NCCC1=CC(=C(C=C1)F)F Z1695670002 [1,0,0,0,0,0|2,0,0]=3 99 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [1,0,0,0,0,0|0,0,0]=1 100 B11R1.192 OCCC1=CC(=C(C=C1)Br)F Z1450935429 [1,0,0,0,0,0|3,0,0]=4 101 B11R1.192 OCCC1=CC(=C(C=C1)F)F Z1020788674 [1,0,0,0,0,0|3,0,0]=4 102 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [1,0,0,0,0,0|2,0,0]=3 103 B13R1.35 CC(C)OC1=CC(=C(C=C1)CO)Cl Z1861997960 [0,1,0,0,0,0|3,0,0]=4 104 B13R1.35 COC1=C(C=C(C=C1)CC(=N)N)F Z1263602367 [0,1,0,0,0,0|2,0,1]=4 105 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)O Z1065613560 [0,1,0,0,0,0|2,0,1]=4 106 B13R1.35 COC1=C(C=C(C=C1)CC(C)N)O Z4574899614 [0,1,0,0,0,0|0,0,0]=1 107 B13R1.35 COC1=C(C=C(C=C1)NC(C)C)F Z1262254324 [0,1,0,0,0,0|3,0,0]=4 108 B13R1.52 COC1=C(C=CC(=C1)CC(=O)N)C Z194976376 [0,1,0,0,0,0|2,0,1]=4 109 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)O Z1203162033 [0,1,0,0,0,0|2,0,1]=4 110 B13R1.52 COC1=C(C=CC(=C1)CC(C)N)O Z4119887033 [0,1,0,0,0,0|0,0,0]=1 111 B13R1.52 COC1=C(C=CC(=C1)CN(C)C)O Z2177030804 [0,1,0,0,0,0|2,0,0]=3 112 B13R1.510 CC(C)C(N)C1=CC(=C(C=C1)F)F Z335235556 [0,1,0,0,0,0|3,0,0]=4 113 B13R1.510 CC(N)C(O)C1=CC(=C(C=C1)F)F Z1342208384 [0,1,0,0,0,0|2,0,0]=3 114 B13R1.510 CC1=C(C=CC(=C1)C(O)C(C)N)F Z4133752082 [0,1,0,0,0,0|2,0,0]=3 115 B13R1.518 CC(C)(N)CC1=CC(=C(C=C1)F)O Z5336269159 [0,1,0,0,0,0|1,0,0]=2 116 B13R1.518 CC(C)(O)CC1=CC(=C(C=C1)Br)F Z2756530158 [0,1,0,0,0,0|3,0,0]=4 117 B13R1.518 CC1=C(C=CC(=C1)CC(C)(C)N)Br Z2182115428 [0,1,0,0,0,0|2,0,0]=3 118 B13R1.518 CC1=C(C=CC(=C1)CC(F)(F)F)O Z1255403482 [0,1,0,0,0,0|3,0,0]=4 119 B13R1.876 CC(N)CC1=C(C=C(C(=C1)F)F)F Z4092809107 [0,1,0,0,0,0|2,0,0]=3 120 B13R1.2879 CC1=C(C=C(C=C1)CC(N)CO)C Z2255081939 [0,1,0,0,0,0|2,0,0]=3 121 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)F Z1255453601 [0,1,0,0,0,0|2,0,1]=4 122 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)N Z1201622979 [0,1,0,0,0,0|2,0,1]=4 123 B13R2.521 CC1=C(C=CC(=C1)CC2CO2)F Z1495386296 [0,0,0,1,0,0|3,0,0]=4 124 B13R2.522 CC1=C(C=C(C=C1)C2CC2N)C Z234897043 [0,0,0,1,0,0|2,0,0]=3 125 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)Cl Z2298098026 [0,0,0,1,0,0|2,0,0]=3 126 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)Cl)F Z2298098037 [0,0,0,1,0,0|2,0,0]=3 127 B13R2.522 N[C@@H]1C[C@H]1C2=CC(=C(C=C2)F)F Z2298098006 [0,0,0,1,0,0|2,0,0]=3 128 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)O Z1198169413 [0,0,0,0,1,0|2,0,1]=4 129 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)O Z1201626572 [0,0,0,0,1,0|2,0,1]=4 130 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)O Z1198158301 [0,0,0,0,1,0|2,0,1]=4 131 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Br Z1037557930 [0,0,0,0,1,0|2,0,1]=4 132 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)C Z57221419 [0,0,0,0,1,0|2,0,1]=4 133 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl Z57905816 [0,0,0,0,1,0|2,0,1]=4 134 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F Z385458772 [0,0,0,0,1,0|2,0,1]=4 135 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)N Z1664347745 [0,0,0,0,1,0|2,0,1]=4 136 B11R1.21 CC(Br)C1=CC(=C(C=C1)Cl)Cl Z381392948 [0,0,0,0,1,0|3,0,0]=4 137 B11R1.21 CC(Br)C1=CC(=C(C=C1)F)Cl Z381393046 [0,0,0,0,1,0|3,0,0]=4 138 B11R1.21 CC(C)C1=CC(=C(C=C1)F)N Z4722235861 [0,0,0,0,1,0|3,0,0]=4 139 B11R1.21 CC(C)C1=CC(=C(C=C1)N)Cl Z1262643307 [0,0,0,0,1,0|3,0,0]=4 140 B11R1.21 CC(C)C1=CC(=C(C=C1)N)N Z1198154332 [0,0,0,0,1,0|3,0,0]=4 141 B11R1.21 CC(C)C1=CC(=C(C=C1)O)N Z57441596 [0,0,0,0,1,0|2,0,0]=3 142 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)F Z3213740225 [0,0,0,0,1,0|2,0,0]=3 143 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)O Z1551939587 [0,0,0,0,1,0|1,0,0]=2 144 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)Cl Z56347253 [0,0,0,0,1,0|2,0,0]=3 145 B11R1.21 CC(N)C1=CC(=C(C=C1)Cl)F Z1198724032 [0,0,0,0,1,0|2,0,0]=3 146 B11R1.21 CC(N)C1=CC(=C(C=C1)F)Cl Z335437988 [0,0,0,0,1,0|2,0,0]=3 147 B11R1.21 CC(N)C1=CC(=C(C=C1)O)O Z4958589100 [0,0,0,0,1,0|0,0,0]=1 148 B11R1.21 CC(O)C1=CC(=C(C=C1)Br)F Z1436188584 [0,0,0,0,1,0|3,0,0]=4 149 B11R1.21 CC(O)C1=CC(=C(C=C1)Cl)Cl Z335245002 [0,0,0,0,1,0|3,0,0]=4 150 B11R1.21 CC(O)C1=CC(=C(C=C1)F)Cl Z335438560 [0,0,0,0,1,0|3,0,0]=4 151 B11R1.21 CC(O)C1=CC(=C(C=C1)F)F Z228586306 [0,0,0,0,1,0|3,0,0]=4 152 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)O Z323032498 [0,0,0,0,1,0|2,0,1]=4 153 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O Z104496566 [0,0,0,0,1,0|2,0,0]=3 154 B11R1.21 CC1=C(C=C(C=C1)C(C)N)C Z285186052 [0,0,0,0,1,0|2,0,0]=3 155 B11R1.21 CC1=C(C=C(C=C1)C(C)N)F Z363990474 [0,0,0,0,1,0|2,0,0]=3 156 B11R1.21 CC1=C(C=C(C=C1)[C@@H](C)O)C Z360055396 [0,0,0,0,1,0|3,0,0]=4 157 B11R1.21 CC1=C(C=C(C=C1)[C@H](C)O)C Z360055400 [0,0,0,0,1,0|3,0,0]=4 158 B11R1.21 CC1=C(C=CC(=C1)C(C)N)F Z1359429587 [0,0,0,0,1,0|2,0,0]=3 159 B11R1.21 CC1=C(C=CC(=C1)N(C)C)O Z4988450441 [0,0,0,0,1,0|3,0,0]=4 160 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Br Z1696091701 [0,0,0,0,1,0|2,0,0]=3 161 B11R1.21 C[C@@H](N)C1=CC(=C(C=C1)F)Cl Z1127664214 [0,0,0,0,1,0|2,0,0]=3 162 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055342 [0,0,0,0,1,0|3,0,0]=4 163 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)F)Cl Z1127664454 [0,0,0,0,1,0|3,0,0]=4 164 B11R1.21 C[C@@H](O)C1=CC(=C(C=C1)F)F Z360055916 [0,0,0,0,1,0|3,0,0]=4 165 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)Cl)Cl Z1962166972 [0,0,0,0,1,0|2,0,0]=3 166 B11R1.21 C[C@H](N)C1=CC(=C(C=C1)F)Br Z360056272 [0,0,0,0,1,0|2,0,0]=3 167 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)Cl)Cl Z360055344 [0,0,0,0,1,0|3,0,0]=4 168 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)Br Z360056260 [0,0,0,0,1,0|3,0,0]=4 169 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)Cl Z1127664340 [0,0,0,0,1,0|3,0,0]=4 170 B11R1.21 C[C@H](O)C1=CC(=C(C=C1)F)F Z360055912 [0,0,0,0,1,0|3,0,0]=4 171 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)O Z1269119521 [0,0,0,0,1,0|2,0,1]=4 172 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)O Z1126161217 [0,0,0,0,1,0|2,0,1]=4 173 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)Cl Z68591301 [0,0,0,0,1,0|2,0,1]=4 174 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)F Z1255448698 [0,0,0,0,1,0|2,0,1]=4 175 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)O Z1198152898 [0,0,0,0,1,0|1,0,1]=3 176 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)O Z104501142 [0,0,0,0,1,0|2,0,1]=4 177 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)O Z1255450010 [0,0,0,0,1,0|3,0,0]=4 178 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)O)F Z1083021660 [0,0,0,0,0,1|2,0,1]=4 179 B13R1.511 CC(C)NCC1=CC(=C(C=C1)Cl)Cl Z86129869 [0,0,0,0,0,1|3,0,0]=4 180 B13R1.511 CC(N)CCC1=CC(=C(C=C1)F)F Z1123686389 [0,0,0,0,0,1|2,0,0]=3 181 B13R1.511 CN(C)CCC1=CC(=C(C=C1)O)O Z1501469796 [0,0,0,0,0,1|2,0,0]=3 182 B13R1.511 NC(=O)NCC1=CC(=C(C=C1)O)F Z1244088772 [0,0,0,0,0,1|2,0,1]=4 183 B10R1.1 CC1=CC=C(C=C1)CCN Z1268153218 [2,0,0,0,0,0|1,0,0]=3 184 B10R1.1 CC1=CC=C(C=C1)CCO Z397587076 [2,0,0,0,0,0|2,0,0]=4 185 B10R1.1 CC1=NC=C(C=C1)CCN Z600584220 [2,0,0,0,0,0|2,0,0]=4 186 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [2,0,0,0,0,0|1,0,0]=3 187 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [2,0,0,0,0,0|1,0,0]=3 188 B10R1.1 CCNC1=CC=C(C=C1)Br Z286365048 [2,0,0,0,0,0|2,0,0]=4 189 B10R1.1 CCNC1=CC=C(C=C1)Cl Z2902298062 [2,0,0,0,0,0|2,0,0]=4 190 B10R1.1 CCNC1=CC=C(C=C1)F Z89270849 [2,0,0,0,0,0|2,0,0]=4 191 B10R1.1 CCNC1=CC=C(C=C1)N Z359511474 [2,0,0,0,0,0|2,0,0]=4 192 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [2,0,0,0,0,0|1,0,0]=3 193 B10R1.1 CCOC1=CC=C(C=C1)C Z53834228 [2,0,0,0,0,0|2,0,0]=4 194 B10R1.1 CCOC1=CC=C(C=C1)N Z57127438 [2,0,0,0,0,0|2,0,0]=4 195 B10R1.1 CCOC1=CC=C(C=C1)S Z166646982 [2,0,0,0,0,0|1,1,0]=4 196 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [2,0,0,0,0,0|2,0,0]=4 197 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [2,0,0,0,0,0|2,0,0]=4 198 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [2,0,0,0,0,0|2,0,0]=4 199 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [2,0,0,0,0,0|2,0,0]=4 200 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [2,0,0,0,0,0|2,0,0]=4 201 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [2,0,0,0,0,0|2,0,0]=4 202 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [2,0,0,0,0,0|2,0,0]=4 203 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [2,0,0,0,0,0|2,0,0]=4 204 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [2,0,0,0,0,0|0,0,2]=4 205 B10R1.1 NC1=CC=C(C=C1)CCO Z276600190 [2,0,0,0,0,0|2,0,0]=4 206 B10R1.1 NCCC1=CC=C(C=C1)Br Z285143750 [2,0,0,0,0,0|1,0,0]=3 207 B10R1.1 NCCC1=CC=C(C=C1)Cl Z57051065 [2,0,0,0,0,0|1,0,0]=3 208 B10R1.1 NCCC1=CC=C(C=C1)F Z90122126 [2,0,0,0,0,0|1,0,0]=3 209 B10R1.1 NCCC1=CC=C(C=C1)I Z2515133713 [2,0,0,0,0,0|1,0,0]=3 210 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [2,0,0,0,0,0|0,0,0]=2 211 B10R1.1 NCCC1=CN=C(C=C1)Cl Z1198178633 [2,0,0,0,0,0|2,0,0]=4 212 B10R1.1 NCCC1=CN=C(N=C1)O Z2725055726 [2,0,0,0,0,0|2,0,0]=4 213 B10R1.1 NCCC1=NC=C(C=C1)F Z2238508662 [2,0,0,0,0,0|2,0,0]=4 214 B10R1.1 NCCC1=NC=C(C=C1)O Z2350909287 [2,0,0,0,0,0|1,0,0]=3 215 B10R1.1 NOCC1=CC=C(C=C1)Cl Z1198164677 [2,0,0,0,0,0|2,0,0]=4 216 B10R1.1 OCCC1=CC=C(C=C1)Br Z397587340 [2,0,0,0,0,0|2,0,0]=4 217 B10R1.1 OCCC1=CC=C(C=C1)F Z397587326 [2,0,0,0,0,0|2,0,0]=4 218 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [2,0,0,0,0,0|1,0,0]=3 219 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [2,0,0,0,0,0|1,0,0]=3 220 B10R1.18 CC(C)CC1=NC=CC=C1 Z1201621742 [2,0,0,0,0,0|2,0,0]=4 221 B10R1.18 CC(C)NC1=CC=CC=C1 Z104475020 [2,0,0,0,0,0|2,0,0]=4 222 B10R1.18 CC(C)OC1=CC=CC=C1 Z53833867 [2,0,0,0,0,0|2,0,0]=4 223 B10R1.18 CC(N)CC1=CC=NC=C1 Z285143992 [2,0,0,0,0,0|1,0,0]=3 224 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [2,0,0,0,0,0|1,0,0]=3 225 B10R1.18 CC(O)CC1=CC=NC=C1 Z992409872 [2,0,0,0,0,0|2,0,0]=4 226 B10R1.18 CC(O)CC1=NC=CC=C1 Z513750714 [2,0,0,0,0,0|2,0,0]=4 227 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [2,0,0,0,0,0|1,0,1]=4 228 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [2,0,0,0,0,0|1,0,1]=4 229 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [2,0,0,0,0,0|1,0,1]=4 230 B10R1.10 CC1=CC(=CC=C1)CCN Z241056516 [2,0,0,0,0,0|1,0,0]=3 231 B10R1.10 CC1=NC(=CC=C1)CCN Z1098234194 [2,0,0,0,0,0|2,0,0]=4 232 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [2,0,0,0,0,0|1,0,0]=3 233 B10R1.10 CCNC1=CC(=CC=C1)Br Z1217910559 [2,0,0,0,0,0|2,0,0]=4 234 B10R1.10 CCNC1=CC(=CC=C1)C Z56785946 [2,0,0,0,0,0|2,0,0]=4 235 B10R1.10 CCNC1=CC(=CC=C1)Cl Z286371690 [2,0,0,0,0,0|2,0,0]=4 236 B10R1.10 CCOC1=CC(=CC=C1)Br Z53833934 [2,0,0,0,0,0|2,0,0]=4 237 B10R1.10 CCOC1=CC(=CC=C1)I Z54181578 [2,0,0,0,0,0|2,0,0]=4 238 B10R1.10 CCSC1=CC(=CC=C1)Br Z1090207966 [2,0,0,0,0,0|2,0,0]=4 239 B10R1.10 CCSC1=CC(=CC=C1)N Z600393424 [2,0,0,0,0,0|2,0,0]=4 240 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [2,0,0,0,0,0|2,0,0]=4 241 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [2,0,0,0,0,0|2,0,0]=4 242 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [2,0,0,0,0,0|2,0,0]=4 243 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [2,0,0,0,0,0|2,0,0]=4 244 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [2,0,0,0,0,0|1,0,0]=3 245 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [2,0,0,0,0,0|2,0,0]=4 246 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [2,0,0,0,0,0|1,0,0]=3 247 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [2,0,0,0,0,0|2,0,0]=4 248 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [2,0,0,0,0,0|2,0,0]=4 249 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [2,0,0,0,0,0|0,0,2]=4 250 B10R1.10 NC1=CC(=CC=C1)CCO Z1198160776 [2,0,0,0,0,0|2,0,0]=4 251 B10R1.10 NCCC1=CC(=CC=C1)Br Z285143760 [2,0,0,0,0,0|1,0,0]=3 252 B10R1.10 NCCC1=CC(=CC=C1)Cl Z57051063 [2,0,0,0,0,0|1,0,0]=3 253 B10R1.10 NCCC1=CC(=CC=C1)F Z96092963 [2,0,0,0,0,0|1,0,0]=3 254 B10R1.10 NCCC1=CC(=CC=C1)I Z4874662549 [2,0,0,0,0,0|1,0,0]=3 255 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [2,0,0,0,0,0|0,0,0]=2 256 B10R1.10 NCCC1=CC(=CN=C1)O Z1504671788 [2,0,0,0,0,0|1,0,0]=3 257 B10R1.10 NCCC1=CC(=NC=C1)N Z2310698980 [2,0,0,0,0,0|2,0,0]=4 258 B10R1.10 NCCC1=NC=NC(=C1)O Z2310716008 [2,0,0,0,0,0|2,0,0]=4 259 B10R1.10 NOCC1=CC(=CC=C1)Cl Z1198339567 [2,0,0,0,0,0|2,0,0]=4 260 B10R1.10 OCCC1=CC(=CC=C1)Cl Z992289382 [2,0,0,0,0,0|2,0,0]=4 261 B10R1.10 OCCC1=CC(=CC=C1)F Z397587224 [2,0,0,0,0,0|2,0,0]=4 262 B10R1.176 CC1=C(C=C(C=C1)CN)Cl Z4658099850 [2,0,0,0,0,0|2,0,0]=4 263 B10R1.176 CC1=C(C=C(C=C1)CN)F Z166652084 [2,0,0,0,0,0|2,0,0]=4 264 B10R1.176 CC1=C(C=C(C=C1)CN)N Z5023069916 [2,0,0,0,0,0|2,0,0]=4 265 B10R1.176 CC1=C(C=C(C=C1)CN)O Z3951014909 [2,0,0,0,0,0|1,0,0]=3 266 B10R1.176 CC1=C(C=CC(=C1)CN)Br Z2293605627 [2,0,0,0,0,0|2,0,0]=4 267 B10R1.176 CC1=C(C=CC(=C1)CN)Cl Z1255503196 [2,0,0,0,0,0|2,0,0]=4 268 B10R1.176 CC1=C(C=CC(=C1)CN)I Z1992316385 [2,0,0,0,0,0|2,0,0]=4 269 B10R1.176 CCC1=CC(=C(C=C1)Br)Cl Z1551924078 [2,0,0,0,0,0|2,0,0]=4 270 B10R1.176 CCC1=CC(=C(C=C1)Br)N Z2753220544 [2,0,0,0,0,0|2,0,0]=4 271 B10R1.176 CCC1=CC(=C(C=C1)N)F Z1255421063 [2,0,0,0,0,0|2,0,0]=4 272 B10R1.176 CCC1=CC(=C(C=C1)N)N Z1198311235 [2,0,0,0,0,0|2,0,0]=4 273 B10R1.176 CCC1=CC(=C(C=C1)O)C Z1255463943 [2,0,0,0,0,0|1,0,0]=3 274 B10R1.176 CCC1=CC(=C(C=C1)O)N Z1318147478 [2,0,0,0,0,0|1,0,0]=3 275 B10R1.176 COC1=CC(=C(C=C1)C)O Z1255384359 [2,0,0,0,0,0|2,0,0]=4 276 B10R1.176 COC1=CC(=C(C=C1)O)C Z1198310476 [2,0,0,0,0,0|2,0,0]=4 277 B10R1.176 COC1=CC(=C(C=C1)O)N Z57727878 [2,0,0,0,0,0|2,0,0]=4 278 B10R1.176 CSC1=CC(=C(C=C1)Br)O Z1269146558 [2,0,0,0,0,0|2,0,0]=4 279 B10R1.176 NCC1=CC(=C(C=C1)Br)F Z2327126749 [2,0,0,0,0,0|2,0,0]=4 280 B10R1.176 NCC1=CC(=C(C=C1)Cl)F Z3244773428 [2,0,0,0,0,0|2,0,0]=4 281 B10R1.176 NCC1=CC(=C(C=C1)Cl)N Z1480642430 [2,0,0,0,0,0|2,0,0]=4 282 B10R1.176 NCC1=CC(=C(C=C1)F)Cl Z992424146 [2,0,0,0,0,0|2,0,0]=4 283 B10R1.176 NCC1=CC(=C(C=C1)F)F Z239626576 [2,0,0,0,0,0|2,0,0]=4 284 B10R1.176 NCC1=CC(=C(C=C1)F)O Z2786079401 [2,0,0,0,0,0|1,0,0]=3 285 B10R1.176 NCC1=CC(=C(C=C1)O)Br Z1436472846 [2,0,0,0,0,0|1,0,0]=3 286 B10R1.176 NCC1=CC(=C(C=C1)O)Cl Z2757555437 [2,0,0,0,0,0|1,0,0]=3 287 B10R1.176 NCC1=CC(=C(C=C1)O)F Z1250080941 [2,0,0,0,0,0|1,0,0]=3 288 B10R1.176 NCC1=CC(=C(C=C1)O)O Z1272096628 [2,0,0,0,0,0|0,0,0]=2 289 B10R1.176 NCC1=CC(=C(N=C1)O)F Z5004159399 [2,0,0,0,0,0|2,0,0]=4 290 B10R1.176 O=CC1=CC(=C(C=C1)O)O Z56957508 [2,0,0,0,0,0|1,0,1]=4 291 B10R1.176 OCC1=CC(=C(C=C1)I)O Z1269159331 [2,0,0,0,0,0|2,0,0]=4 292 B10R1.176 OCC1=CC(=C(C=C1)O)Cl Z839172284 [2,0,0,0,0,0|2,0,0]=4 293 B10R1.176 OCC1=CC(=C(C=C1)O)F Z385458838 [2,0,0,0,0,0|2,0,0]=4 294 B10R1.176 OCC1=NC=C(C(=C1)O)O Z3003010756 [2,0,0,0,0,0|2,0,0]=4 295 B12R1.4 CC(C)CC1=CC=C(C=C1)C=O Z385369920 [1,1,0,0,0,0|1,0,1]=4 296 B12R1.4 CC(C)CC1=CC=C(C=C1)CO Z385370338 [1,1,0,0,0,0|1,0,0]=3 297 B12R1.4 CC(C)OC1=CC=C(C=C1)CO Z54549633 [1,1,0,0,0,0|2,0,0]=4 298 B12R1.4 CC(C)SC1=CC=C(C=C1)CO Z1157828975 [1,1,0,0,0,0|2,0,0]=4 299 B12R1.4 CC(O)CC1=CC=C(C=C1)C=O Z1511913303 [1,1,0,0,0,0|1,0,1]=4 300 B12R1.4 CN(C)CC1=CC=C(C=C1)CO Z336081024 [1,1,0,0,0,0|2,0,0]=4 301 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [1,1,0,0,0,0|1,0,1]=4 302 B12R1.4 COC1=CC=C(C=C1)CC(C)O Z228586162 [1,1,0,0,0,0|1,0,0]=3 303 B12R1.20 CC(C)C(=O)C1=CC=C(C=C1)O Z1198150713 [1,1,0,0,0,0|1,0,1]=4 304 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Br Z3211605350 [1,1,0,0,0,0|2,0,0]=4 305 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)Cl Z221528970 [1,1,0,0,0,0|2,0,0]=4 306 B12R1.20 CC(C)C(N)C1=CC=C(C=C1)F Z99598998 [1,1,0,0,0,0|2,0,0]=4 307 B12R1.20 CC(C)C(O)C1=CC=C(C=C1)Cl Z513748660 [1,1,0,0,0,0|2,0,0]=4 308 B12R1.20 CC(N)C(=O)C1=CC=C(C=C1)Cl Z3023980683 [1,1,0,0,0,0|1,0,1]=4 309 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)Br Z336086694 [1,1,0,0,0,0|1,0,0]=3 310 B12R1.20 CC(N)C(O)C1=CC=C(C=C1)F Z336086696 [1,1,0,0,0,0|1,0,0]=3 311 B12R1.49 CC(CN)OC1=CC=C(C=C1)Br Z844632490 [1,1,0,0,0,0|2,0,0]=4 312 B12R1.49 CC(CN)OC1=CC=C(C=C1)Cl Z844632498 [1,1,0,0,0,0|2,0,0]=4 313 B12R1.49 CC(CN)OC1=CC=C(C=C1)F Z274779140 [1,1,0,0,0,0|2,0,0]=4 314 B12R1.49 CC(CN)SC1=CC=C(C=C1)Br Z1266854950 [1,1,0,0,0,0|2,0,0]=4 315 B12R1.49 CC1=CC=C(C=C1)CC(N)CO Z1800620539 [1,1,0,0,0,0|1,0,0]=3 316 B12R1.49 CC1=CC=C(C=C1)OC(C)CN Z844632044 [1,1,0,0,0,0|2,0,0]=4 317 B12R1.49 CCC(C)OC1=CC=C(C=C1)O Z381414944 [1,1,0,0,0,0|2,0,0]=4 318 B12R1.49 CCC(N)CC1=CC=C(C=C1)Br Z2582143601 [1,1,0,0,0,0|1,0,0]=3 319 B12R1.49 CCC(N)CC1=CC=C(C=C1)C Z431980102 [1,1,0,0,0,0|1,0,0]=3 320 B12R1.49 CCC(N)CC1=CC=C(C=C1)Cl Z2044769785 [1,1,0,0,0,0|1,0,0]=3 321 B12R1.49 CCC(N)CC1=CC=C(C=C1)F Z2492774579 [1,1,0,0,0,0|1,0,0]=3 322 B12R1.49 CCC(N)CC1=CC=C(C=C1)O Z1815149210 [1,1,0,0,0,0|0,0,0]=2 323 B12R1.49 CCC(O)CC1=CC=C(C=C1)C Z513751166 [1,1,0,0,0,0|2,0,0]=4 324 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [1,1,0,0,0,0|1,0,1]=4 325 B12R1.49 C[C@@H](CN)OC1=CC=C(C=C1)Cl Z1860991587 [1,1,0,0,0,0|2,0,0]=4 326 B12R1.49 NC(CO)CC1=CC=C(C=C1)Cl Z3244488892 [1,1,0,0,0,0|1,0,0]=3 327 B12R1.49 NC(CO)CC1=CC=C(C=C1)F Z1849004242 [1,1,0,0,0,0|1,0,0]=3 328 B12R1.49 NC(CO)CC1=CC=C(C=C1)I Z1263636488 [1,1,0,0,0,0|1,0,0]=3 329 B12R1.49 NC1=CC=C(C=C1)CC(F)CO Z4580450313 [1,1,0,0,0,0|2,0,0]=4 330 B12R1.49 NCC(O)CC1=CC=C(C=C1)Br Z4990293859 [1,1,0,0,0,0|2,0,0]=4 331 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O Z295456854 [1,1,0,0,0,0|0,0,0]=2 332 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O Z203038576 [1,1,0,0,0,0|0,0,0]=2 333 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [1,1,0,0,0,0|1,0,1]=4 334 B12R1.106 CC(C)(C)CC1=CC=C(C=C1)Br Z1681356955 [1,1,0,0,0,0|2,0,0]=4 335 B12R1.106 CC(C)(N)CC1=CC=C(C=C1)Br Z1263529603 [1,1,0,0,0,0|1,0,0]=3 336 B12R1.106 CC(C)(O)CC1=CC=C(C=C1)Br Z513707720 [1,1,0,0,0,0|2,0,0]=4 337 B12R1.106 CC1=CC=C(C=C1)CC(C)(C)N Z415658550 [1,1,0,0,0,0|1,0,0]=3 338 B12R1.106 OC1=CC=C(C=C1)CC(F)(F)F Z1198278054 [1,1,0,0,0,0|2,0,0]=4 339 B12R1.233 CC(C)CC1=C(C=C(C=C1)O)O Z1513805538 [1,1,0,0,0,0|1,0,0]=3 340 B12R1.233 CC(N)CC1=C(C=C(C=C1)Br)F Z405046456 [1,1,0,0,0,0|1,0,0]=3 341 B12R1.233 CC(N)CC1=C(C=C(C=C1)Cl)Cl Z285143988 [1,1,0,0,0,0|1,0,0]=3 342 B12R1.233 CC(N)CC1=C(C=C(C=C1)F)F Z5002837134 [1,1,0,0,0,0|1,0,0]=3 343 B12R1.233 CC1=CC(=C(C=C1)CC(C)N)C Z285143886 [1,1,0,0,0,0|1,0,0]=3 344 B12R1.50 C#CC(N)CC1=CC(=CC=C1)F Z3178895122 [1,1,0,0,0,0|1,0,1]=4 345 B12R1.50 CC(CN)OC1=CC(=CC=C1)Br Z844632504 [1,1,0,0,0,0|2,0,0]=4 346 B12R1.50 CC(CN)OC1=CC(=CC=C1)Cl Z1263820268 [1,1,0,0,0,0|2,0,0]=4 347 B12R1.50 CC(CN)OC1=CC(=CC=C1)F Z844631990 [1,1,0,0,0,0|2,0,0]=4 348 B12R1.50 CC1=CC(=CC=C1)CC(N)CO Z1801307645 [1,1,0,0,0,0|1,0,0]=3 349 B12R1.50 CC1=CC=CC(=C1)OC(C)CN Z844631960 [1,1,0,0,0,0|2,0,0]=4 350 B12R1.50 CC1=NC(=CC=C1)CC(N)CO Z4870594850 [1,1,0,0,0,0|2,0,0]=4 351 B12R1.50 CNC(=O)CC1=CC(=CC=C1)O Z816010790 [1,1,0,0,0,0|1,0,1]=4 352 B12R1.50 CNC(C)CC1=CC(=CC=C1)C Z2311236342 [1,1,0,0,0,0|1,0,0]=3 353 B12R1.50 COC(=O)CC1=CC(=CC=C1)O Z816010254 [1,1,0,0,0,0|1,0,1]=4 354 B12R1.50 NC(CO)CC1=CC(=CC=C1)F Z1198222234 [1,1,0,0,0,0|1,0,0]=3 355 B12R1.50 NCC(O)CC1=CC(=CC=C1)Br Z4981222469 [1,1,0,0,0,0|2,0,0]=4 356 B12R1.50 O=C(CC1=CC(=CC=C1)O)NO Z816010210 [1,1,0,0,0,0|1,0,1]=4 357 B12R1.101 CC(O)CC1=CC(=CC(=C1)F)Br Z1295686052 [1,1,0,0,0,0|2,0,0]=4 358 B12R1.101 CC1=CC(=CC(=C1)CC(C)N)C Z1262691704 [1,1,0,0,0,0|1,0,0]=3 359 B12R1.119 CC(C)(N)CC1=CC(=CC=C1)Br Z415658564 [1,1,0,0,0,0|1,0,0]=3 360 B12R1.127 CC(O)CC1=C(C=CC(=C1)F)Br Z992976478 [1,1,0,0,0,0|2,0,0]=4 361 B12R1.224 CC(N)CC1=C(C(=CC=C1)F)F Z5033535620 [1,1,0,0,0,0|1,0,0]=3 362 B12R1.224 CC(O)CC1=C(C(=CC=C1)F)Br Z1295677298 [1,1,0,0,0,0|2,0,0]=4 363 B12R1.225 CC(C1=CC(=CC=C1)O)N(C)C Z1176485649 [1,1,0,0,0,0|2,0,0]=4 364 B12R1.225 CC(N)C(=O)C1=CC(=CC=C1)O Z3015076235 [1,1,0,0,0,0|0,0,1]=3 365 B12R1.225 CC(N)C(O)C1=CC(=CC=C1)F Z1695740794 [1,1,0,0,0,0|1,0,0]=3 366 B12R1.225 C[C@@H](C1=CC(=CC=C1)O)N(C)C Z1198169241 [1,1,0,0,0,0|2,0,0]=4 367 B12R1.225 C[C@H](N)[C@H](O)C1=CC(=CC=C1)O Z2050038784 [1,1,0,0,0,0|0,0,0]=2 368 B12R1.438 CC(C)OC1=CC(=CC=C1)CO Z335246356 [1,1,0,0,0,0|2,0,0]=4 369 B12R1.438 CN(C)CC1=CC(=CC=C1)CO Z336081030 [1,1,0,0,0,0|2,0,0]=4 370 B12R1.438 COC1=CC(=CC=C1)CC(=N)N Z951367838 [1,1,0,0,0,0|1,0,1]=4 371 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [1,1,0,0,0,0|1,0,1]=4 372 B12R1.44 CC1=CC(=CC(=C1O)C)CCN Z1809367687 [1,1,0,0,0,0|1,0,0]=3 373 B12R1.44 NCCC1=CC(=C(C(=C1)F)F)F Z1682072427 [1,1,0,0,0,0|2,0,0]=4 374 B12R1.44 OCCC1=CC(=C(C(=C1)Br)O)Br Z1860411848 [1,1,0,0,0,0|2,0,0]=4 375 B12R1.286 C/C=C/C1=CC(=C(C=C1)O)OC Z57953030 [1,1,0,0,0,0|0,0,2]=4 376 B12R1.286 C=CCC1=CC(=C(C=C1)O)OC Z56347226 [1,1,0,0,0,0|0,0,2]=4 377 B12R1.286 CC1=C(C=C(C=C1)CCN)C#N Z3614117785 [1,1,0,0,0,0|2,0,0]=4 378 B12R1.286 CCCC1=CC(=C(C=C1)N)C#N Z1532769937 [1,1,0,0,0,0|2,0,0]=4 379 B12R1.286 CCCC1=CC(=C(C=C1)O)CO Z1513840121 [1,1,0,0,0,0|0,0,0]=2 380 B12R1.286 CCOC1=CC(=C(C=C1)O)C=O Z56347093 [1,1,0,0,0,0|1,0,1]=4 381 B12R1.286 CNCC1=CC(=C(C=C1)O)OC Z425387552 [1,1,0,0,0,0|1,0,0]=3 382 B12R1.286 COC1=C(C=CC(=C1)CCN)C Z1198167712 [1,1,0,0,0,0|1,0,0]=3 383 B12R1.286 COC1=C(C=CC(=C1)CCN)O Z1268152336 [1,1,0,0,0,0|0,0,0]=2 384 B12R1.286 NCCC1=CC(=C(C=C1)O)CO Z1262658266 [1,1,0,0,0,0|0,0,0]=2 385 B12R1.288 CC1=C(C=CC(=C1)CCN)C#N Z3571126634 [1,1,0,0,0,0|2,0,0]=4 386 B12R1.288 CCCC1=CC(=C(C=C1)OC)O Z87001810 [1,1,0,0,0,0|0,0,0]=2 387 B12R1.288 CCNC1=CC(=C(C=C1)C=O)O Z1262605772 [1,1,0,0,0,0|1,0,1]=4 388 B12R1.288 CCOC1=CC(=C(C=C1)C=O)O Z56862355 [1,1,0,0,0,0|1,0,1]=4 389 B12R1.288 CNCC1=CC(=C(C=C1)OC)Br Z3243654223 [1,1,0,0,0,0|2,0,0]=4 390 B12R1.288 CNCC1=CC(=C(C=C1)OC)C Z1101435075 [1,1,0,0,0,0|2,0,0]=4 391 B12R1.288 CNCC1=CC(=C(C=C1)OC)Cl Z839166898 [1,1,0,0,0,0|2,0,0]=4 392 B12R1.288 CNCC1=CC(=C(C=C1)OC)F Z85956704 [1,1,0,0,0,0|2,0,0]=4 393 B12R1.288 CNCC1=CC(=C(C=C1)OC)O Z57842333 [1,1,0,0,0,0|1,0,0]=3 394 B12R1.288 COC1=C(C=C(C=C1)CCN)Br Z5122698103 [1,1,0,0,0,0|1,0,0]=3 395 B12R1.288 COC1=C(C=C(C=C1)CCN)Cl Z3295464152 [1,1,0,0,0,0|1,0,0]=3 396 B12R1.288 COC1=C(C=C(C=C1)CCN)F Z382820754 [1,1,0,0,0,0|1,0,0]=3 397 B12R1.288 COC1=C(C=C(C=C1)CCO)O Z1198339386 [1,1,0,0,0,0|1,0,0]=3 398 B12R1.367 CC(CN)C1=CC(=C(C=C1)Cl)Cl Z4937190097 [1,1,0,0,0,0|2,0,0]=4 399 B12R1.367 CC(CN)C1=CC(=C(C=C1)F)Cl Z4937045907 [1,1,0,0,0,0|2,0,0]=4 400 B12R1.367 CC(CN)C1=CC(=C(C=C1)F)F Z415655058 [1,1,0,0,0,0|2,0,0]=4 401 B12R1.367 CCC(=O)C1=CC(=C(C=C1)O)F Z1255468561 [1,1,0,0,0,0|1,0,1]=4 402 B12R1.367 CCC(=O)C1=CC(=C(C=C1)O)N Z2177031047 [1,1,0,0,0,0|1,0,1]=4 403 B12R1.367 CCC(C)C1=CC(=C(C=C1)O)N Z57441610 [1,1,0,0,0,0|1,0,0]=3 404 B12R1.367 CCC(N)C1=CC(=C(C=C1)Br)F Z5368653956 [1,1,0,0,0,0|2,0,0]=4 405 B12R1.367 CCC(O)C1=CC(=C(C=C1)Cl)Cl Z235447502 [1,1,0,0,0,0|2,0,0]=4 406 B12R1.367 CC[C@@H](O)C1=CC(=C(C=C1)Cl)Cl Z1483951050 [1,1,0,0,0,0|2,0,0]=4 407 B12R1.367 CC[C@H](O)C1=CC(=C(C=C1)C)F Z1255444475 [1,1,0,0,0,0|2,0,0]=4 408 B12R1.367 NCC(O)C1=CC(=C(C=C1)F)F Z330910382 [1,1,0,0,0,0|2,0,0]=4 409 B12R1.367 O=C(CCl)C1=CC(=C(C=C1)O)O Z56912624 [1,1,0,0,0,0|1,0,1]=4 410 B12R1.385 CC1=C(C=C(C=C1)SCCN)C Z56347318 [1,1,0,0,0,0|2,0,0]=4 411 B12R1.385 CCCCC1=CC(=C(C=C1)C)N Z1262626215 [1,1,0,0,0,0|2,0,0]=4 412 B12R1.385 CCCCC1=CC(=C(C=C1)O)C Z1416171318 [1,1,0,0,0,0|1,0,0]=3 413 B12R1.385 CCCNC1=CC(=C(C=C1)C)C Z3179194889 [1,1,0,0,0,0|2,0,0]=4 414 B12R1.385 CCCNC1=CC(=C(C=C1)C)Cl Z3178892110 [1,1,0,0,0,0|2,0,0]=4 415 B12R1.385 CCCNC1=CC(=C(C=C1)Cl)C Z3178893817 [1,1,0,0,0,0|2,0,0]=4 416 B12R1.385 CCCNC1=CC(=C(C=C1)Cl)Cl Z3006084945 [1,1,0,0,0,0|2,0,0]=4 417 B12R1.385 CCCOC1=CC(=C(C=C1)Br)Cl Z1618009620 [1,1,0,0,0,0|2,0,0]=4 418 B12R1.385 CCCOC1=CC(=C(C=C1)N)C Z239604814 [1,1,0,0,0,0|2,0,0]=4 419 B12R1.385 CCNCC1=CC(=C(C=C1)Cl)Cl Z752370982 [1,1,0,0,0,0|2,0,0]=4 420 B12R1.385 CCNCC1=CC(=C(C=C1)F)F Z594413796 [1,1,0,0,0,0|2,0,0]=4 421 B12R1.385 CNCCC1=CC(=C(C=C1)O)Br Z3710478807 [1,1,0,0,0,0|1,0,0]=3 422 B12R1.385 COCCC1=CC(=C(C=C1)O)Cl Z1513901493 [1,1,0,0,0,0|1,0,0]=3 423 B12R1.385 NCCOC1=CC(=C(C=C1)Cl)F Z2235790693 [1,1,0,0,0,0|2,0,0]=4 424 B12R1.385 NCCOC1=CC(=C(C=C1)F)F Z1263820280 [1,1,0,0,0,0|2,0,0]=4 425 B12R1.385 OCCCC1=CC(=C(C=C1)Cl)Cl Z993012522 [1,1,0,0,0,0|2,0,0]=4 426 B12R1.544 CC1=C(C=CC(=C1Cl)Cl)CCN Z4970349053 [1,1,0,0,0,0|2,0,0]=4 427 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)I)O Z1269154708 [0,1,0,0,1,0|2,0,0]=4 428 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)N)O Z2004548136 [0,1,0,0,1,0|2,0,0]=4 429 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)O)O Z104476062 [0,1,0,0,1,0|1,0,0]=3 430 B12R1.23 CC(C)(N)C1=CC(=C(C=C1)Cl)Cl Z725146798 [0,1,0,0,1,0|2,0,0]=4 431 B12R1.23 CC(C)(N)C1=CC(=C(C=C1)F)F Z1020787660 [0,1,0,0,1,0|2,0,0]=4 432 B12R1.48 CC1=C(C=CC(=C1)C(C)N)C#N Z4876961979 [0,1,0,0,1,0|2,0,0]=4 433 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)O Z1255365043 [0,1,0,0,1,0|1,0,1]=4 434 B12R1.48 COC1=C(C=C(C=C1)C(C)C)O Z1255440315 [0,1,0,0,1,0|1,0,0]=3 435 B12R1.48 COC1=C(C=C(C=C1)C(C)O)Cl Z756121270 [0,1,0,0,1,0|2,0,0]=4 436 B12R1.48 COC1=C(C=C(C=C1)C(C)O)F Z220335558 [0,1,0,0,1,0|2,0,0]=4 437 B12R1.48 COC1=C(C=C(C=C1)[C@@H](C)O)Br Z360056130 [0,1,0,0,1,0|2,0,0]=4 438 B12R1.56 CC(C)C1=CC(=C(C=C1)O)C=O Z336080488 [0,1,0,0,1,0|1,0,1]=4 439 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)O Z57234303 [0,1,0,0,1,0|1,0,1]=4 440 B12R1.56 COC1=C(C=CC(=C1)C(C)C)C Z54854001 [0,1,0,0,1,0|2,0,0]=4 441 B12R1.56 COC1=C(C=CC(=C1)C(C)N)F Z1198747325 [0,1,0,0,1,0|1,0,0]=3 442 B12R1.232 CC(=O)C1=C(C=C(C(=C1)O)O)O Z274502124 [0,1,0,0,1,0|1,0,1]=4 443 B12R1.232 CC(N)C1=C(C=C(C(=C1)F)Br)F Z2677964710 [0,1,0,0,1,0|2,0,0]=4 444 B12R1.232 CC(N)C1=C(C=C(C(=C1)F)Cl)Cl Z56347485 [0,1,0,0,1,0|2,0,0]=4 445 B12R1.232 CC1=CC(=C(C=C1Cl)C(C)N)O Z4921616835 [0,1,0,0,1,0|2,0,0]=4 446 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)Cl Z104495034 [0,1,0,0,1,0|2,0,0]=4 447 B12R1.232 CC1=CC(=C(C=C1O)C(C)C)O Z1198148655 [0,1,0,0,1,0|2,0,0]=4 448 B12R1.893 CC(=O)C1=C(C(=C(C=C1)O)O)O Z57124116 [0,1,0,0,1,0|1,0,1]=4 449 B12R1.893 CC1=C(C=CC(=C1Cl)C(C)N)Cl Z5001901844 [0,1,0,0,1,0|2,0,0]=4 450 B12R1.893 C[C@@H](N)C1=C(C(=C(C=C1)Cl)Cl)Cl Z1696091842 [0,1,0,0,1,0|2,0,0]=4 451 B12R1.893 C[C@H](N)C1=C(C(=C(C=C1)Cl)Cl)Cl Z1217910574 [0,1,0,0,1,0|2,0,0]=4 452 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)C)O)O Z1513616099 [0,1,0,0,1,0|1,0,1]=4 453 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)O)O)O Z1255416032 [0,1,0,0,1,0|1,0,1]=4 454 B12R1.1005 CC(N)C1=CC(=C(C(=C1)F)F)F Z1266854852 [0,1,0,0,1,0|2,0,0]=4 455 B12R1.1005 CC1=CC(=CC(=C1F)C)C(C)N Z1259089737 [0,1,0,0,1,0|2,0,0]=4 456 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(C)O)O Z1513917280 [0,1,0,0,0,1|1,0,1]=4 457 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)C)O Z1255442373 [0,1,0,0,0,1|1,0,1]=4 458 B14R1.42 COC1=C(C=CC(=C1)CCC(C)N)O Z3324923673 [0,1,0,0,0,1|0,0,0]=2 459 B14R1.684 CC1=C(C=CC(=C1)NCC(C)(C)C)O Z1255458335 [0,1,0,0,0,1|2,0,0]=4 460 B14R1.684 C[N+](C)(C)CCC1=CC(=C(C=C1)O)O Z1416163905 [0,1,0,0,0,1|2,0,0]=4 461 B14R1.685 CC(C)NC(=O)C1=CC(=C(C=C1)O)O Z1625091152 [0,1,0,0,0,1|1,0,1]=4 462 B14R1.685 CC(C)OC(=O)C1=CC(=C(C=C1)O)O Z292797840 [0,1,0,0,0,1|1,0,1]=4 463 B14R1.685 CN(C)CC(=O)C1=CC(=C(C=C1)O)O Z1492781231 [0,1,0,0,0,1|2,0,0]=4 464 B14R1.833 CCC(N)CSC1=CC(=C(C=C1)C)C Z1238723572 [0,1,0,0,0,1|2,0,0]=4 465 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)C)O Z1268633028 [0,1,0,0,0,1|1,0,1]=4 466 B14R1.3276 COC1=C(C=C(C=C1)CC(C)C=O)F Z1238838025 [0,2,0,0,0,0|2,0,0]=4 467 B14R1.3276 COC1=C(C=C(C=C1)CC(C)CO)F Z1238840553 [0,2,0,0,0,0|2,0,0]=4 468 B14R1.3651 COC1=C(C=C(C=C1)CC(=O)N)OC Z33546771 [0,2,0,0,0,0|1,0,1]=4 469 B14R1.3651 COC1=C(C=C(C=C1)CC(=S)N)OC Z235363001 [0,2,0,0,0,0|1,0,1]=4 470 B14R1.3651 COC1=C(C=C(C=C1)NC(C)C)OC Z266654414 [0,2,0,0,0,0|2,0,0]=4 471 B14R1.5801 CC(C)CC1=CC(=C(C=C1)B(O)O)F Z1551961068 [0,2,0,0,0,0|2,0,0]=4 472 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)O)OC Z1198150768 [0,2,0,0,0,0|1,0,1]=4 473 B14R1.3405 COC1=C(C=CC(=C1)CC(=O)CO)O Z1513806392 [0,2,0,0,0,0|1,0,1]=4 474 B14R1.1003 COC(=O)C(N)C1=CC(=C(C=C1)O)O Z3679593836 [0,2,0,0,0,0|1,0,1]=4 475 B14R1.4398 NCC(CO)CC1=CC(=C(C=C1)F)Br Z2237318085 [0,2,0,0,0,0|2,0,0]=4 476 B12R2.79 CC1=CC=C(C=C1)[C@@H]2C[C@H]2N Z2380468351 [1,0,0,1,0,0|1,0,0]=3 477 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)Cl Z3074487523 [1,0,0,1,0,0|2,0,0]=4 478 B12R2.79 C[C@@H]1O[C@H]1C2=CC=C(C=C2)F Z2527567177 [1,0,0,1,0,0|2,0,0]=4 479 B12R2.79 NC1CC1C2=CC=C(C=C2)F Z1266823169 [1,0,0,1,0,0|1,0,0]=3 480 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Br Z2298098036 [1,0,0,1,0,0|1,0,0]=3 481 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(C=C2)Cl Z2298098012 [1,0,0,1,0,0|1,0,0]=3 482 B12R2.294 BrC1=CC=C(C=C1)CC2CO2 Z2523466484 [1,0,0,1,0,0|2,0,0]=4 483 B12R2.294 FC1=CC=C(C=C1)CC2CO2 Z1495386285 [1,0,0,1,0,0|2,0,0]=4 484 B12R2.294 OC1=CC=C(C=C1)OC2CC2 Z1255401633 [1,0,0,1,0,0|2,0,0]=4 485 B12R2.606 CC1CC2=C(O1)C=CC(=C2)O Z1513815985 [1,0,0,1,0,0|2,0,0]=4 486 B12R2.606 NC1=CC2=C(C=C1)CC(C2)O Z1203581059 [1,0,0,1,0,0|2,0,0]=4 487 B12R2.606 NC1CC2=C(C1)C=C(C=C2)Br Z1741978324 [1,0,0,1,0,0|1,0,0]=3 488 B12R2.606 NC1CC2=C(C1)N=CC(=C2)Br Z3466011318 [1,0,0,1,0,0|2,0,0]=4 489 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [1,0,0,1,0,0|1,0,0]=3 490 B12R2.606 OC1CC2=C(C1)C=C(C=C2)Cl Z1489210921 [1,0,0,1,0,0|2,0,0]=4 491 B12R2.606 OC1CC2=C(C1)C=C(C=C2)F Z1862026143 [1,0,0,1,0,0|2,0,0]=4 492 B12R2.80 C[C@@H]1O[C@H]1C2=CC(=CC=C2)Cl Z2525216417 [1,0,0,1,0,0|2,0,0]=4 493 B12R2.80 NC1CC1C2=CC(=CC=C2)Br Z1266823142 [1,0,0,1,0,0|1,0,0]=3 494 B12R2.80 N[C@@H]1C[C@H]1C2=CC(=CC=C2)Cl Z2298098009 [1,0,0,1,0,0|1,0,0]=3 495 B12R2.202 CC1CC2=C(O1)C(=CC=C2)Cl Z803153168 [1,0,0,1,0,0|2,0,0]=4 496 B12R2.1286 ClC1=CC(=CC=C1)CC2CO2 Z1495386153 [1,0,0,1,0,0|2,0,0]=4 497 B12R2.1286 FC1=CC(=CC=C1)CC2CO2 Z1495386186 [1,0,0,1,0,0|2,0,0]=4 498 B12R2.1286 OC1=CC(=CC=C1)OC2CC2 Z1255397767 [1,0,0,1,0,0|2,0,0]=4 499 B12R2.82 CC1=C(C2=C(C=C1)CCC2)O Z1255490620 [1,0,0,1,0,0|1,0,0]=3 500 B12R2.82 CC1=C(C2=C(C=C1)CCN2)Br Z4966512463 [1,0,0,1,0,0|2,0,0]=4 501 B12R2.82 CC1=C(C=CC2=C1NCC2)Br Z1509171355 [1,0,0,1,0,0|2,0,0]=4 502 B12R2.82 FC1=C(C2=C(C=C1)CCN2)F Z2235823250 [1,0,0,1,0,0|2,0,0]=4 503 B12R2.100 CC1=C(C=C2NCCC2=C1)C Z1203734724 [1,0,0,1,0,0|2,0,0]=4 504 B12R2.100 ClC1=C(C=C2CCCC2=C1)Br Z2617652037 [1,0,0,1,0,0|2,0,0]=4 505 B12R2.100 ClC1=C(C=C2CCCC2=C1)I Z4151692158 [1,0,0,1,0,0|2,0,0]=4 506 B12R2.100 ClC1=C(C=C2CCNC2=C1)Br Z2327128596 [1,0,0,1,0,0|2,0,0]=4 507 B12R2.100 FC1=C(C=C2CCNC2=C1)Br Z5063074443 [1,0,0,1,0,0|2,0,0]=4 508 B12R2.100 FC1=C(C=C2CCNC2=C1)Cl Z5076484958 [1,0,0,1,0,0|2,0,0]=4 509 B12R2.100 NC1=C(C=C2CCCC2=C1)Br Z1509386718 [1,0,0,1,0,0|2,0,0]=4 510 B12R2.100 OC1=C(C=C2COCC2=C1)O Z3243446774 [1,0,0,1,0,0|1,0,0]=3 511 B12R2.291 NC1=C(C=C(C=C1)C2CC2)F Z2738366539 [1,0,0,1,0,0|2,0,0]=4 512 B12R2.291 NC1=C(C=C(C=C1)C2CC2)N Z1203652960 [1,0,0,1,0,0|2,0,0]=4 513 B12R2.291 NC1=C(C=CC(=C1)C2CC2)Cl Z1037551094 [1,0,0,1,0,0|2,0,0]=4 514 B12R2.291 NC1=C(C=CC(=C1)C2CC2)F Z4777520691 [1,0,0,1,0,0|2,0,0]=4 515 B12R2.291 OC1=C(C=C(C=C1)C2CC2)Cl Z1575344265 [1,0,0,1,0,0|1,0,0]=3 516 B14R2.931 NC1CC(C1)C2=CC(=C(C=C2)F)Br Z1266933845 [0,0,0,1,0,1|2,0,0]=4 517 B14R2.1008 C[C@@H](O)CC1=CC2=C(C=C1)OCO2 Z1198314644 [0,1,0,1,0,0|1,0,0]=3 518 B14R2.1008 C[C@H](O)CC1=CC2=C(C=C1)OCO2 Z1650168507 [0,1,0,1,0,0|1,0,0]=3 519 B14R2.932 CC1=C(C=CC(=C1)CC2(CC2)N)F Z3277807373 [0,1,0,1,0,0|2,0,0]=4 520 B14R2.10607 FC1=C(C=C(C=C1)CC2CNC2)F Z285233266 [0,1,0,1,0,0|2,0,0]=4 521 B14R2.29369 CC1CC2=C(CN1)C(=C(C=C2)F)Br Z2235192400 [0,1,0,1,0,0|2,0,0]=4 522 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [1,0,0,0,1,0|1,0,1]=4 523 B10R1.13 CC(C)C1=CC=C(C=C1)Br Z732229746 [1,0,0,0,1,0|2,0,0]=4 524 B10R1.13 CC(C)C1=CC=C(C=C1)Cl Z1255372793 [1,0,0,0,1,0|2,0,0]=4 525 B10R1.13 CC(C)C1=CC=C(C=C1)N Z104476320 [1,0,0,0,1,0|2,0,0]=4 526 B10R1.13 CC(C)C1=CC=C(C=C1)O Z56347200 [1,0,0,0,1,0|1,0,0]=3 527 B10R1.13 CC(N)C1=CC=C(C=C1)Br Z56347162 [1,0,0,0,1,0|1,0,0]=3 528 B10R1.13 CC(N)C1=CC=C(C=C1)Cl Z56347112 [1,0,0,0,1,0|1,0,0]=3 529 B10R1.13 CC(N)C1=CC=C(C=C1)O Z1741968989 [1,0,0,0,1,0|0,0,0]=2 530 B10R1.13 CC(N)C1=CN=C(C=C1)O Z4423361180 [1,0,0,0,1,0|1,0,0]=3 531 B10R1.13 CC(O)C1=CC=C(C=C1)Br Z335244904 [1,0,0,0,1,0|2,0,0]=4 532 B10R1.13 CC(O)C1=CC=C(C=C1)Cl Z104479788 [1,0,0,0,1,0|2,0,0]=4 533 B10R1.13 CC(O)C1=CC=C(C=C1)F Z56347219 [1,0,0,0,1,0|2,0,0]=4 534 B10R1.13 CC(O)C1=CC=C(C=C1)I Z228586282 [1,0,0,0,1,0|2,0,0]=4 535 B10R1.13 CC1=CC=C(C=C1)C(C)C Z104497772 [1,0,0,0,1,0|2,0,0]=4 536 B10R1.13 CC1=CC=C(C=C1)[C@@H](C)O Z1127664396 [1,0,0,0,1,0|2,0,0]=4 537 B10R1.13 CC1=CC=C(C=C1)[C@H](C)O Z1127664278 [1,0,0,0,1,0|2,0,0]=4 538 B10R1.13 CN(C)C1=CC=C(C=C1)O Z137981254 [1,0,0,0,1,0|2,0,0]=4 539 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)Br Z850973968 [1,0,0,0,1,0|2,0,0]=4 540 B10R1.13 C[C@@H](O)C1=CC=C(C=C1)I Z360055808 [1,0,0,0,1,0|2,0,0]=4 541 B10R1.13 C[C@H](N)C1=CC=C(C=C1)Br Z1869802525 [1,0,0,0,1,0|1,0,0]=3 542 B10R1.13 C[C@H](N)C1=CC=C(C=C1)I Z1696091699 [1,0,0,0,1,0|1,0,0]=3 543 B10R1.13 C[C@H](N)C1=CC=C(C=C1)O Z3183546879 [1,0,0,0,1,0|0,0,0]=2 544 B10R1.13 C[C@H](N)C1=NC=C(C=C1)Cl Z1753033020 [1,0,0,0,1,0|2,0,0]=4 545 B10R1.13 C[C@H](O)C1=CC=C(C=C1)Br Z850973970 [1,0,0,0,1,0|2,0,0]=4 546 B10R1.13 C[C@H](O)C1=CC=C(C=C1)I Z360055806 [1,0,0,0,1,0|2,0,0]=4 547 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [1,0,0,0,1,0|1,0,1]=4 548 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [1,0,0,0,1,0|1,0,1]=4 549 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [1,0,0,0,1,0|1,0,1]=4 550 B10R1.54 CC1=CC=C(S1)CC(C)N Z381678020 [1,0,0,0,1,0|2,0,0]=4 551 B10R1.113 CC(C)C1=CC(=CC=C1)O Z104492878 [1,0,0,0,1,0|1,0,0]=3 552 B10R1.113 CC(C)C1=NC=CC(=C1)O Z1255384308 [1,0,0,0,1,0|2,0,0]=4 553 B10R1.113 CC(N)C1=CC(=CC=C1)Br Z239626864 [1,0,0,0,1,0|1,0,0]=3 554 B10R1.113 CC(N)C1=CC(=CC=C1)Cl Z56347061 [1,0,0,0,1,0|1,0,0]=3 555 B10R1.113 CC(N)C1=CC(=CC=C1)F Z56347483 [1,0,0,0,1,0|1,0,0]=3 556 B10R1.113 CC(N)C1=CC(=CC=C1)O Z426041632 [1,0,0,0,1,0|0,0,0]=2 557 B10R1.113 CC(N)C1=NC=CC(=C1)Br Z4573023597 [1,0,0,0,1,0|2,0,0]=4 558 B10R1.113 CC(O)C1=CC(=CC=C1)Cl Z335244960 [1,0,0,0,1,0|2,0,0]=4 559 B10R1.113 CC(O)C1=CC(=CC=C1)F Z335245218 [1,0,0,0,1,0|2,0,0]=4 560 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [1,0,0,0,1,0|1,0,0]=3 561 B10R1.113 CC1=CC=CC(=C1)C(C)N Z2284390656 [1,0,0,0,1,0|1,0,0]=3 562 B10R1.113 CC1=CC=CC(=C1)C(C)O Z445987122 [1,0,0,0,1,0|2,0,0]=4 563 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)N Z1626921284 [1,0,0,0,1,0|1,0,0]=3 564 B10R1.113 CC1=CC=CC(=C1)[C@@H](C)O Z1127664487 [1,0,0,0,1,0|2,0,0]=4 565 B10R1.113 CC1=CC=CC(=C1)[C@H](C)N Z1626921239 [1,0,0,0,1,0|1,0,0]=3 566 B10R1.113 CC1=CC=CC(=C1)[C@H](C)O Z1127664373 [1,0,0,0,1,0|2,0,0]=4 567 B10R1.113 CC1=CC=CC(=N1)[C@@H](C)N Z1492797078 [1,0,0,0,1,0|2,0,0]=4 568 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Br Z803153182 [1,0,0,0,1,0|2,0,0]=4 569 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)Cl Z360055382 [1,0,0,0,1,0|2,0,0]=4 570 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [1,0,0,0,1,0|1,0,0]=3 571 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Br Z803153180 [1,0,0,0,1,0|2,0,0]=4 572 B10R1.113 C[C@H](O)C1=CC(=CC=C1)Cl Z360055386 [1,0,0,0,1,0|2,0,0]=4 573 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [1,0,0,0,1,0|1,0,0]=3 574 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [1,0,0,0,1,0|1,0,1]=4 575 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [1,0,0,0,1,0|1,0,1]=4 576 B12R1.21 CC(C)CCC1=CC=C(C=C1)N Z424736042 [1,0,0,0,0,1|2,0,0]=4 577 B12R1.21 CC(C)CNC1=CC=C(C=C1)Cl Z1695729058 [1,0,0,0,0,1|2,0,0]=4 578 B12R1.21 CC(C)COC1=CC=C(C=C1)O Z381414742 [1,0,0,0,0,1|1,0,0]=3 579 B12R1.21 CC(C)NCC1=CC=C(C=C1)Br Z86129856 [1,0,0,0,0,1|2,0,0]=4 580 B12R1.21 CC(C)NCC1=CC=C(C=C1)F Z86129862 [1,0,0,0,0,1|2,0,0]=4 581 B12R1.21 CC(C)OCC1=CC=C(C=C1)Br Z823855528 [1,0,0,0,0,1|2,0,0]=4 582 B12R1.21 CC(C)OCC1=CC=C(C=C1)N Z285178068 [1,0,0,0,0,1|2,0,0]=4 583 B12R1.21 CC(C)SCC1=CC=C(C=C1)Br Z54548572 [1,0,0,0,0,1|2,0,0]=4 584 B12R1.21 CC(N)CCC1=CC=C(C=C1)Br Z235361851 [1,0,0,0,0,1|1,0,0]=3 585 B12R1.21 CC(N)CCC1=CC=C(C=C1)I Z1947443961 [1,0,0,0,0,1|1,0,0]=3 586 B12R1.21 CC(N)CCC1=CC=C(C=C1)O Z220327456 [1,0,0,0,0,1|0,0,0]=2 587 B12R1.21 CC(N)COC1=CC=C(C=C1)F Z271017038 [1,0,0,0,0,1|1,0,0]=3 588 B12R1.21 CC(O)CCC1=CC=C(C=C1)O Z57921369 [1,0,0,0,0,1|1,0,0]=3 589 B12R1.21 CC1=CC=C(C=C1)NCC(C)C Z334955606 [1,0,0,0,0,1|2,0,0]=4 590 B12R1.21 CC1=CC=C(C=C1)OCC(C)N Z285166960 [1,0,0,0,0,1|1,0,0]=3 591 B12R1.21 CC1=CC=C(C=C1)SCC(C)N Z1238717325 [1,0,0,0,0,1|1,0,0]=3 592 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [1,0,0,0,0,1|1,0,1]=4 593 B12R1.226 CC(C)CNC1=CC(=CC=C1)Cl Z2236582079 [1,0,0,0,0,1|2,0,0]=4 594 B12R1.226 CC(C)CNC1=CC(=CC=C1)O Z335562026 [1,0,0,0,0,1|1,0,0]=3 595 B12R1.226 CC(C)COC1=CC(=CC=C1)N Z223656242 [1,0,0,0,0,1|2,0,0]=4 596 B12R1.226 CC(C)CSC1=CC(=CN=C1)O Z2182038538 [1,0,0,0,0,1|2,0,0]=4 597 B12R1.226 CC(C)NCC1=CC(=CC=C1)Br Z86129864 [1,0,0,0,0,1|2,0,0]=4 598 B12R1.226 CC(C)NCC1=CC(=CC=C1)Cl Z86129878 [1,0,0,0,0,1|2,0,0]=4 599 B12R1.226 CC(C)NCC1=CC(=CC=C1)F Z86129899 [1,0,0,0,0,1|2,0,0]=4 600 B12R1.226 CC(C)OCC1=CC(=CC=C1)Br Z823855536 [1,0,0,0,0,1|2,0,0]=4 601 B12R1.226 CC(C)OCC1=CC(=CC=C1)N Z285178238 [1,0,0,0,0,1|2,0,0]=4 602 B12R1.226 CC(C)SCC1=CC(=CC=C1)N Z600446400 [1,0,0,0,0,1|2,0,0]=4 603 B12R1.226 CC(N)CCC1=CC(=CC=C1)F Z406452418 [1,0,0,0,0,1|1,0,0]=3 604 B12R1.226 CC(N)COC1=CC(=CC=C1)F Z271017410 [1,0,0,0,0,1|1,0,0]=3 605 B12R1.226 CC(O)COC1=CC(=CC=C1)F Z854226860 [1,0,0,0,0,1|2,0,0]=4 606 B12R1.226 CC1=CC=CC(=C1)OCC(C)N Z271016790 [1,0,0,0,0,1|1,0,0]=3 607 B12R1.226 NC(=O)COC1=CC(=CC=C1)O Z381415558 [1,0,0,0,0,1|1,0,1]=4 608 B14R1.687 CC(=O)NCCC1=CC(=C(C=C1)O)O Z68159731 [0,0,0,0,0,2|1,0,1]=4