0 B12R1.19 CC(=O)CC1=CC(=C(C=C1)Br)F Z1269186824 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.19 CC(=O)CC1=CC(=C(C=C1)O)Br Z1269192817 [0,0,0,0,0,0|1,0,0]=1 2 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Br)C Z30826447 [0,0,0,0,0,0|3,0,0]=3 3 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Br Z296850122 [0,0,0,0,0,0|3,0,0]=3 4 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)Cl Z28153679 [0,0,0,0,0,0|3,0,0]=3 5 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)F Z30955086 [0,0,0,0,0,0|3,0,0]=3 6 B12R1.19 CC(=O)NC1=CC(=C(C=C1)C)N Z274783012 [0,0,0,0,0,0|3,0,0]=3 7 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)Cl Z28128347 [0,0,0,0,0,0|3,0,0]=3 8 B12R1.19 CC(=O)NC1=CC(=C(C=C1)Cl)N Z239122040 [0,0,0,0,0,0|3,0,0]=3 9 B12R1.19 CC(=O)NC1=CC(=C(C=C1)F)N Z235362917 [0,0,0,0,0,0|3,0,0]=3 10 B12R1.19 CC(=O)NC1=CC(=C(C=C1)N)Cl Z425366400 [0,0,0,0,0,0|3,0,0]=3 11 B12R1.19 CC(=O)NC1=CC(=C(C=C1)O)F Z1216844087 [0,0,0,0,0,0|2,0,0]=2 12 B12R1.19 CC(=O)NC1=NC(=C(C=C1)Br)C Z57345368 [0,0,0,0,0,0|4,0,0]=4 13 B12R1.19 CC(=O)NC1=NC(=C(C=C1)I)C Z57296057 [0,0,0,0,0,0|4,0,0]=4 14 B12R1.19 CC(=O)NC1=NC=C(C(=C1)Cl)Cl Z1297118487 [0,0,0,0,0,0|4,0,0]=4 15 B12R1.19 CC(N)CC1=CC(=C(C=C1)F)Br Z285144030 [0,0,0,0,0,0|3,0,1]=4 16 B12R1.19 CC(N)CC1=CC(=C(C=C1)O)O Z1891776857 [0,0,0,0,0,0|1,0,1]=2 17 B12R1.19 CC(O)CC1=CC(=C(C=C1)Br)F Z1295686053 [0,0,0,0,0,0|2,0,2]=4 18 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Br Z1269160930 [0,0,0,0,0,0|3,0,0]=3 19 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)C Z56923286 [0,0,0,0,0,0|3,0,0]=3 20 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)Cl Z1198264457 [0,0,0,0,0,0|3,0,0]=3 21 B12R1.19 CC1=C(C=C(C=C1)CC(=O)O)O Z1198166108 [0,0,0,0,0,0|2,0,0]=2 22 B12R1.19 CC1=C(C=C(C=C1)CC(C)N)F Z4098107054 [0,0,0,0,0,0|3,0,1]=4 23 B12R1.19 CC1=C(C=C(C=C1)CN(C)C)N Z335289232 [0,0,0,0,0,0|4,0,0]=4 24 B12R1.19 CC1=C(C=C(C=C1)NC(=O)N)C Z107732966 [0,0,0,0,0,0|4,0,0]=4 25 B12R1.19 CC1=C(C=C(C=C1)NC(=O)N)F Z198194884 [0,0,0,0,0,0|4,0,0]=4 26 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)Br Z1269233833 [0,0,0,0,0,0|3,0,0]=3 27 B12R1.19 CC1=C(C=CC(=C1)CC(=O)O)O Z1198169209 [0,0,0,0,0,0|2,0,0]=2 28 B12R1.19 CC1=C(C=CC(=C1)CN(C)C)N Z335289244 [0,0,0,0,0,0|4,0,0]=4 29 B12R1.19 CC1=C(C=CC(=C1)NC(=O)N)Br Z198194748 [0,0,0,0,0,0|4,0,0]=4 30 B12R1.19 CC1=C(C=NC(=C1)CC(=O)O)Cl Z2677377810 [0,0,0,0,0,0|4,0,0]=4 31 B12R1.19 CN(C)CC1=CC(=C(C=C1)N)F Z1097100932 [0,0,0,0,0,0|4,0,0]=4 32 B12R1.19 CN(C)CC1=CC(=C(C=C1)O)Cl Z1945695050 [0,0,0,0,0,0|3,0,0]=3 33 B12R1.19 CS(=O)CC1=CC(=C(C=C1)Cl)N Z802580892 [0,0,0,0,0,0|3,0,0]=3 34 B12R1.19 NC(=O)CC1=CC(=C(C=C1)Cl)Cl Z33546666 [0,0,0,0,0,0|3,0,0]=3 35 B12R1.19 NC(=O)NC1=CC(=C(C=C1)Br)F Z1263540637 [0,0,0,0,0,0|4,0,0]=4 36 B12R1.19 NC(=O)NC1=CC(=C(C=C1)Cl)N Z239124000 [0,0,0,0,0,0|4,0,0]=4 37 B12R1.19 NC(=O)NC1=CC(=C(C=C1)F)Cl Z198194754 [0,0,0,0,0,0|4,0,0]=4 38 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Br Z1269150510 [0,0,0,0,0,0|3,0,0]=3 39 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)Cl Z1269109822 [0,0,0,0,0,0|3,0,0]=3 40 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Br)F Z1269111454 [0,0,0,0,0,0|3,0,0]=3 41 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Br Z1269184545 [0,0,0,0,0,0|3,0,0]=3 42 B12R1.19 O=C(O)CC1=CC(=C(C=C1)Cl)Cl Z104476066 [0,0,0,0,0,0|3,0,0]=3 43 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Br Z285131564 [0,0,0,0,0,0|3,0,0]=3 44 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)Cl Z362118814 [0,0,0,0,0,0|3,0,0]=3 45 B12R1.19 O=C(O)CC1=CC(=C(C=C1)F)F Z362118708 [0,0,0,0,0,0|3,0,0]=3 46 B12R1.19 O=C(O)CC1=CC(=C(C=C1)I)Br Z1269147843 [0,0,0,0,0,0|3,0,0]=3 47 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)Cl Z1205411134 [0,0,0,0,0,0|2,0,0]=2 48 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)F Z1255445925 [0,0,0,0,0,0|2,0,0]=2 49 B12R1.19 O=C(O)CC1=CC(=C(C=C1)O)O Z1255438427 [0,0,0,0,0,0|1,0,0]=1 50 B11R1.20 CC(=O)CC1=CC=C(C=C1)F Z329711590 [1,0,0,0,0,0|1,0,0]=2 51 B11R1.20 CC(=O)NC1=CC=C(C=C1)C Z28134680 [1,0,0,0,0,0|2,0,0]=3 52 B11R1.20 CC(=O)NC1=CC=C(C=C1)Cl Z28161730 [1,0,0,0,0,0|2,0,0]=3 53 B11R1.20 CC(=O)NC1=CC=C(C=C1)F Z27805821 [1,0,0,0,0,0|2,0,0]=3 54 B11R1.20 CC(=O)NC1=CC=C(C=C1)I Z30316374 [1,0,0,0,0,0|2,0,0]=3 55 B11R1.20 CC(=O)NC1=CC=C(C=C1)N Z56926521 [1,0,0,0,0,0|2,0,0]=3 56 B11R1.20 CC(=O)NC1=CC=C(C=C1)O Z56946051 [1,0,0,0,0,0|1,0,0]=2 57 B11R1.20 CC(=O)NC1=CC=C(C=C1)S Z104484984 [1,0,0,0,0,0|1,1,0]=3 58 B11R1.20 CC(=O)NC1=NC=C(C=C1)Cl Z71484766 [1,0,0,0,0,0|3,0,0]=4 59 B11R1.20 CC(=O)OC1=CC=C(C=C1)O Z1198155166 [1,0,0,0,0,0|1,0,0]=2 60 B11R1.20 CC(=S)NC1=CC=C(C=C1)F Z56756640 [1,0,0,0,0,0|2,1,0]=4 61 B11R1.20 CC(C)CC1=CC=C(C=C1)N Z1463350056 [1,0,0,0,0,0|2,0,1]=4 62 B11R1.20 CC(N)CC1=CC=C(C=C1)O Z57102382 [1,0,0,0,0,0|1,0,1]=3 63 B11R1.20 CC1=CC=C(C=C1)CC(=N)N Z3244909870 [1,0,0,0,0,0|3,0,0]=4 64 B11R1.20 CC1=CC=C(C=C1)CC(=O)O Z104507548 [1,0,0,0,0,0|2,0,0]=3 65 B11R1.20 CC1=CC=C(C=C1)NC(=O)N Z56754677 [1,0,0,0,0,0|3,0,0]=4 66 B11R1.20 CC1=NC=C(C=C1)CC(=O)O Z424795892 [1,0,0,0,0,0|3,0,0]=4 67 B11R1.20 CN(C)CC1=CC=C(C=C1)N Z228584348 [1,0,0,0,0,0|3,0,0]=4 68 B11R1.20 N=C(N)CC1=CC=C(C=C1)Br Z1518844582 [1,0,0,0,0,0|3,0,0]=4 69 B11R1.20 N=C(N)CC1=CC=C(C=C1)F Z415636754 [1,0,0,0,0,0|3,0,0]=4 70 B11R1.20 NC(=O)CC1=CC=C(C=C1)Br Z33546958 [1,0,0,0,0,0|2,0,0]=3 71 B11R1.20 NC(=O)CC1=CC=C(C=C1)Cl Z33546677 [1,0,0,0,0,0|2,0,0]=3 72 B11R1.20 NC(=O)CC1=CC=C(C=C1)F Z33546755 [1,0,0,0,0,0|2,0,0]=3 73 B11R1.20 NC(=O)CC1=CC=C(C=C1)N Z234895133 [1,0,0,0,0,0|2,0,0]=3 74 B11R1.20 NC(=O)NC1=CC=C(C=C1)Br Z89283357 [1,0,0,0,0,0|3,0,0]=4 75 B11R1.20 NC(=O)NC1=CC=C(C=C1)Cl Z56754682 [1,0,0,0,0,0|3,0,0]=4 76 B11R1.20 NC(=O)NC1=CC=C(C=C1)F Z166687094 [1,0,0,0,0,0|3,0,0]=4 77 B11R1.20 NC(=O)NC1=CC=C(C=C1)I Z56754684 [1,0,0,0,0,0|3,0,0]=4 78 B11R1.20 NC(=O)NC1=CC=C(C=C1)N Z239123648 [1,0,0,0,0,0|3,0,0]=4 79 B11R1.20 NC(=S)CC1=CC=C(C=C1)F Z285131734 [1,0,0,0,0,0|2,1,0]=4 80 B11R1.20 NC1=CC=C(C=C1)CC(=O)O Z104481066 [1,0,0,0,0,0|2,0,0]=3 81 B11R1.20 O=C(Cl)CC1=CC=C(C=C1)Cl Z217293314 [1,0,0,0,0,0|2,0,0]=3 82 B11R1.20 O=C(O)CC1=CC=C(C=C1)Br Z90121253 [1,0,0,0,0,0|2,0,0]=3 83 B11R1.20 O=C(O)CC1=CC=C(C=C1)Cl Z104477676 [1,0,0,0,0,0|2,0,0]=3 84 B11R1.20 O=C(O)CC1=CC=C(C=C1)F Z104477312 [1,0,0,0,0,0|2,0,0]=3 85 B11R1.20 O=C(O)CC1=CN=C(C=C1)Cl Z1165304038 [1,0,0,0,0,0|3,0,0]=4 86 B11R1.20 O=C(O)CC1=CNC(=O)C=C1 Z1198338224 [1,0,0,0,0,0|2,0,1]=4 87 B11R1.20 O=C(O)CC1=NC=C(C=C1)F Z1945984141 [1,0,0,0,0,0|3,0,0]=4 88 B11R1.157 CC(=O)CC1=CC(=CC=C1)Br Z513735382 [1,0,0,0,0,0|1,0,0]=2 89 B11R1.157 CC(=O)CC1=CC(=CC=C1)Cl Z513733552 [1,0,0,0,0,0|1,0,0]=2 90 B11R1.157 CC(=O)CC1=CC(=CC=C1)F Z329711550 [1,0,0,0,0,0|1,0,0]=2 91 B11R1.157 CC(=O)NC1=CC(=CC=C1)Br Z27788933 [1,0,0,0,0,0|2,0,0]=3 92 B11R1.157 CC(=O)NC1=CC(=CC=C1)I Z26432839 [1,0,0,0,0,0|2,0,0]=3 93 B11R1.157 CC(=O)NC1=CC(=CC=C1)N Z56926524 [1,0,0,0,0,0|2,0,0]=3 94 B11R1.157 CC(=O)NC1=CC(=CC=C1)O Z31717082 [1,0,0,0,0,0|1,0,0]=2 95 B11R1.157 CC(=O)NC1=CC(=NC=C1)Cl Z1201619919 [1,0,0,0,0,0|3,0,0]=4 96 B11R1.157 CC(=O)NC1=C[N+](=CC=C1)C Z56760720 [1,0,0,0,0,0|3,0,0]=4 97 B11R1.157 CC(=O)NC1=NC(=CC=C1)C Z183992496 [1,0,0,0,0,0|3,0,0]=4 98 B11R1.157 CC(C)CC1=CC(=CC=C1)I Z1618143122 [1,0,0,0,0,0|2,0,1]=4 99 B11R1.157 CC(C)NC1=CC(=CC=C1)O Z335562192 [1,0,0,0,0,0|2,0,1]=4 100 B11R1.157 CC(C)OC1=CC(=CC=C1)O Z381415570 [1,0,0,0,0,0|2,0,1]=4 101 B11R1.157 CC(N)CC1=CC(=CC=C1)Br Z1259341031 [1,0,0,0,0,0|2,0,1]=4 102 B11R1.157 CC(N)CC1=CC(=CC=C1)Cl Z425389644 [1,0,0,0,0,0|2,0,1]=4 103 B11R1.157 CC(N)CC1=CC(=CC=C1)O Z285144026 [1,0,0,0,0,0|1,0,1]=3 104 B11R1.157 CC(O)CC1=CC(=CC=C1)F Z513751286 [1,0,0,0,0,0|1,0,2]=4 105 B11R1.157 CC1=CC(=CN=C1)CC(=O)O Z1889997399 [1,0,0,0,0,0|3,0,0]=4 106 B11R1.157 CN(C)CC1=CC(=CC=C1)N Z285162888 [1,0,0,0,0,0|3,0,0]=4 107 B11R1.157 CS(=O)CC1=CC(=CC=C1)N Z802580778 [1,0,0,0,0,0|2,0,0]=3 108 B11R1.157 N=C(N)CC1=CC(=CC=C1)Br Z1636723568 [1,0,0,0,0,0|3,0,0]=4 109 B11R1.157 N=C(N)CC1=CC(=CC=C1)F Z1695709629 [1,0,0,0,0,0|3,0,0]=4 110 B11R1.157 NC(=O)CC1=CC(=CC=C1)Cl Z992289380 [1,0,0,0,0,0|2,0,0]=3 111 B11R1.157 NC(=O)CC1=CC(=CC=C1)I Z1419030795 [1,0,0,0,0,0|2,0,0]=3 112 B11R1.157 NC(=O)CC1=CC(=CC=C1)O Z816010252 [1,0,0,0,0,0|1,0,0]=2 113 B11R1.157 NC(=O)NC1=CC(=CC=C1)Br Z198194688 [1,0,0,0,0,0|3,0,0]=4 114 B11R1.157 NC(=O)NC1=CC(=CC=C1)Cl Z166687084 [1,0,0,0,0,0|3,0,0]=4 115 B11R1.157 NC(=O)NC1=CC(=CC=C1)I Z198194890 [1,0,0,0,0,0|3,0,0]=4 116 B11R1.157 NC(=O)NC1=CC(=CC=C1)N Z235352405 [1,0,0,0,0,0|3,0,0]=4 117 B11R1.157 NC(=O)NC1=CC(=CC=C1)O Z335810106 [1,0,0,0,0,0|2,0,0]=3 118 B11R1.157 NC(=S)NC1=CC(=CC=C1)O Z199466960 [1,0,0,0,0,0|2,1,0]=4 119 B11R1.157 NC1=CC(=CC=C1)CC(=O)O Z992267406 [1,0,0,0,0,0|2,0,0]=3 120 B11R1.157 NC1=NC=CC(=C1)CC(=O)O Z1197888454 [1,0,0,0,0,0|3,0,0]=4 121 B11R1.157 O=C(O)CC1=CC(=CC=C1)Br Z285131530 [1,0,0,0,0,0|2,0,0]=3 122 B11R1.157 O=C(O)CC1=CC(=CC=C1)Cl Z285184608 [1,0,0,0,0,0|2,0,0]=3 123 B11R1.157 O=C(O)CC1=CC(=CC=C1)F Z104486030 [1,0,0,0,0,0|2,0,0]=3 124 B11R1.157 O=C(O)CC1=CC(=CC=C1)I Z1269113140 [1,0,0,0,0,0|2,0,0]=3 125 B11R1.157 O=C(O)CC1=CC(=CC=C1)O Z816000338 [1,0,0,0,0,0|1,0,0]=2 126 B11R1.157 O=C(O)CC1=CC(=CN=C1)Br Z1269198419 [1,0,0,0,0,0|3,0,0]=4 127 B11R1.157 O=C(O)CC1=CC(=CN=C1)O Z1255437243 [1,0,0,0,0,0|2,0,0]=3 128 B11R1.157 O=C(O)CC1=CC(=NC=C1)O Z5003228420 [1,0,0,0,0,0|2,0,0]=3 129 B11R1.157 O=[N+]([O-])CC1=CC(=CC=C1)F Z2181775549 [1,0,0,0,0,0|3,0,0]=4 130 B11R1.192 CC1=C(C=C(C=C1)CC=O)C Z993017804 [1,0,0,0,0,0|2,0,0]=3 131 B11R1.192 CC1=C(C=CC(=C1)CC#N)O Z1255368240 [1,0,0,0,0,0|2,0,1]=4 132 B11R1.192 CC1=C(C=CC(=C1)CC=O)F Z1020779938 [1,0,0,0,0,0|2,0,0]=3 133 B11R1.192 CNCC1=CC(=C(C=C1)Br)Br Z6011701708 [1,0,0,0,0,0|3,0,0]=4 134 B11R1.192 CNCC1=CC(=C(C=C1)Br)Cl Z5321384345 [1,0,0,0,0,0|3,0,0]=4 135 B11R1.192 CNCC1=CC(=C(C=C1)C)C Z2238897979 [1,0,0,0,0,0|3,0,0]=4 136 B11R1.192 CNCC1=CC(=C(C=C1)C)Cl Z5390415454 [1,0,0,0,0,0|3,0,0]=4 137 B11R1.192 CNCC1=CC(=C(C=C1)C)F Z385447006 [1,0,0,0,0,0|3,0,0]=4 138 B11R1.192 CNCC1=CC(=C(C=C1)Cl)Cl Z56963342 [1,0,0,0,0,0|3,0,0]=4 139 B11R1.192 CNCC1=CC(=C(C=C1)F)C Z1873867371 [1,0,0,0,0,0|3,0,0]=4 140 B11R1.192 CNCC1=CC(=C(C=C1)F)F Z102767736 [1,0,0,0,0,0|3,0,0]=4 141 B11R1.192 CSCC1=CC(=C(C=C1)Cl)N Z732207352 [1,0,0,0,0,0|3,0,0]=4 142 B11R1.192 NCCC1=CC(=C(C=C1)O)O Z104474032 [1,0,0,0,0,0|1,0,1]=3 143 B11R1.192 O=CCC1=CC(=C(C=C1)Br)F Z1269156049 [1,0,0,0,0,0|2,0,0]=3 144 B11R1.192 O=CCC1=CC(=C(C=C1)F)F Z1020788676 [1,0,0,0,0,0|2,0,0]=3 145 B11R1.192 OCCC1=CC(=C(C=C1)O)Cl Z1250886915 [1,0,0,0,0,0|1,0,2]=4 146 B13R1.35 CC1=C(C=CC(=C1)CC(=O)O)CO Z1551958932 [0,1,0,0,0,0|2,0,0]=3 147 B13R1.35 CCC1=C(C=C(C=C1)CC(=O)O)F Z1551924486 [0,1,0,0,0,0|3,0,0]=4 148 B13R1.35 COC1=C(C=C(C=C1)CC(=N)N)F Z1263602367 [0,1,0,0,0,0|3,0,0]=4 149 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)Cl Z1205414415 [0,1,0,0,0,0|2,0,0]=3 150 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)F Z94598730 [0,1,0,0,0,0|2,0,0]=3 151 B13R1.35 COC1=C(C=C(C=C1)CC(=O)O)O Z1065613560 [0,1,0,0,0,0|1,0,0]=2 152 B13R1.35 COC1=C(C=C(C=C1)CC(C)N)O Z4574899614 [0,1,0,0,0,0|1,0,1]=3 153 B13R1.35 CSC1=C(C=C(C=C1)NC(=O)C)Cl Z1324842283 [0,1,0,0,0,0|2,1,0]=4 154 B13R1.52 CC(=O)NC1=CC(=C(C=C1)Cl)C#N Z203520874 [0,1,0,0,0,0|3,0,0]=4 155 B13R1.52 CCC1=C(C=CC(=C1)NC(=O)C)C Z1216820081 [0,1,0,0,0,0|3,0,0]=4 156 B13R1.52 COC1=C(C=CC(=C1)CC(=O)N)C Z194976376 [0,1,0,0,0,0|2,0,0]=3 157 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Br Z1269221903 [0,1,0,0,0,0|2,0,0]=3 158 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)C Z168876634 [0,1,0,0,0,0|2,0,0]=3 159 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)Cl Z1269148038 [0,1,0,0,0,0|2,0,0]=3 160 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)N Z4184587402 [0,1,0,0,0,0|2,0,0]=3 161 B13R1.52 COC1=C(C=CC(=C1)CC(=O)O)O Z1203162033 [0,1,0,0,0,0|1,0,0]=2 162 B13R1.52 COC1=C(C=CC(=C1)CC(C)N)O Z4119887033 [0,1,0,0,0,0|1,0,1]=3 163 B13R1.52 COC1=C(C=CC(=C1)CN(C)C)O Z2177030804 [0,1,0,0,0,0|2,0,0]=3 164 B13R1.52 COC1=C(C=CC(=C1)NC(=O)C)N Z278204678 [0,1,0,0,0,0|2,0,0]=3 165 B13R1.52 COC1=C(C=CC(=C1)NC(=O)N)Br Z1321379839 [0,1,0,0,0,0|3,0,0]=4 166 B13R1.52 COC1=C(C=CC(=C1)NC(=O)N)F Z1763025566 [0,1,0,0,0,0|3,0,0]=4 167 B13R1.52 O=CC1=C(C=CC(=C1)CC(=O)O)O Z1681376601 [0,1,0,0,0,0|1,0,1]=3 168 B13R1.510 C=C(C)C(N)C1=CC(=C(C=C1)F)F Z1723418853 [0,1,0,0,0,0|3,0,0]=4 169 B13R1.510 CC(C(=O)O)C1=CC(=C(C=C1)Cl)Cl Z992423142 [0,1,0,0,0,0|3,0,0]=4 170 B13R1.510 CC(C(=O)O)C1=CC(=C(C=C1)F)F Z792377186 [0,1,0,0,0,0|3,0,0]=4 171 B13R1.510 CC1=C(C=C(C=C1)C(C)C(=O)O)Br Z1813162631 [0,1,0,0,0,0|3,0,0]=4 172 B13R1.510 CC1=C(C=CC(=C1)C(C)C(=O)O)Br Z1813181647 [0,1,0,0,0,0|3,0,0]=4 173 B13R1.510 CC1=C(C=CC(=C1)C(N)C(=O)O)Cl Z1198640890 [0,1,0,0,0,0|3,0,0]=4 174 B13R1.510 NC(C(=O)O)C1=CC(=C(C=C1)Cl)Cl Z317024644 [0,1,0,0,0,0|3,0,0]=4 175 B13R1.510 NC(C(=O)O)C1=CC(=C(C=C1)Cl)F Z1696091766 [0,1,0,0,0,0|3,0,0]=4 176 B13R1.510 NC(C(=O)O)C1=CC(=C(C=C1)F)Cl Z1269179754 [0,1,0,0,0,0|3,0,0]=4 177 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)Cl)Br Z1269204407 [0,1,0,0,0,0|3,0,0]=4 178 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)Cl)Cl Z788000702 [0,1,0,0,0,0|3,0,0]=4 179 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)Cl)F Z838972312 [0,1,0,0,0,0|3,0,0]=4 180 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)F)Cl Z1269153543 [0,1,0,0,0,0|3,0,0]=4 181 B13R1.510 O=C(O)C(O)C1=CC(=C(C=C1)F)F Z788000624 [0,1,0,0,0,0|3,0,0]=4 182 B13R1.518 CC(C)(N)CC1=CC(=C(C=C1)F)O Z5336269159 [0,1,0,0,0,0|2,0,1]=4 183 B13R1.518 CS(=O)(=O)CC1=CC(=C(C=C1)N)F Z1389032807 [0,1,0,0,0,0|3,0,0]=4 184 B13R1.518 CS(=O)(=O)NC1=CC(=C(C=C1)O)Cl Z56919053 [0,1,0,0,0,0|3,0,0]=4 185 B13R1.876 CC(=O)NC1=C(C=C(C(=C1)C)Br)C Z1269178101 [0,1,0,0,0,0|3,0,0]=4 186 B13R1.876 CC(=O)NC1=C(C=C(C(=C1)Cl)O)F Z2099248840 [0,1,0,0,0,0|2,0,0]=3 187 B13R1.876 CC(=O)NC1=C(C=C(C(=C1)F)F)I Z1297431719 [0,1,0,0,0,0|3,0,0]=4 188 B13R1.876 CC(=O)NC1=C(C=C(C(=C1)F)F)N Z877740628 [0,1,0,0,0,0|3,0,0]=4 189 B13R1.876 CC(=O)NC1=C(C=C(C(=C1)N)F)F Z431584156 [0,1,0,0,0,0|3,0,0]=4 190 B13R1.876 CC(=O)NC1=C(C=C(C(=C1)O)Br)Br Z1815156752 [0,1,0,0,0,0|2,0,0]=3 191 B13R1.876 CC1=C(C=C(C(=C1)F)CC(=O)O)F Z2235790638 [0,1,0,0,0,0|3,0,0]=4 192 B13R1.876 NC1=C(C=C(C(=C1)Br)CC(=O)O)N Z3325861056 [0,1,0,0,0,0|3,0,0]=4 193 B13R1.876 NC1=C(C=C(C(=C1)F)CC(=O)O)F Z1255388005 [0,1,0,0,0,0|3,0,0]=4 194 B13R1.876 O=C(O)CC1=C(C=C(C(=C1)Cl)Br)F Z1939441447 [0,1,0,0,0,0|3,0,0]=4 195 B13R1.876 O=C(O)CC1=C(C=C(C(=C1)F)Cl)Br Z2755932792 [0,1,0,0,0,0|3,0,0]=4 196 B13R1.876 O=C(O)CC1=C(C=C(C(=C1)F)F)F Z1203162222 [0,1,0,0,0,0|3,0,0]=4 197 B13R1.2879 CC1=C(C=C(C=C1)NC(=O)CCl)Br Z56983144 [0,1,0,0,0,0|3,0,0]=4 198 B13R1.2879 CC1=C(C=C(C=C1)NC(=O)CCl)C Z56821871 [0,1,0,0,0,0|3,0,0]=4 199 B13R1.2879 CC1=C(C=C(C=C1)NC(=O)CCl)Cl Z56896162 [0,1,0,0,0,0|3,0,0]=4 200 B13R1.2879 CC1=C(C=C(C=C1)NC(=O)CCl)F Z56827285 [0,1,0,0,0,0|3,0,0]=4 201 B13R1.2879 CC1=C(C=C(C=C1)NC(=O)CCl)I Z199423526 [0,1,0,0,0,0|3,0,0]=4 202 B13R1.2879 CC1=C(C=C(C=C1)NC(=O)CO)Cl Z85927317 [0,1,0,0,0,0|3,0,0]=4 203 B13R1.2879 CC1=C(C=CC(=C1)NC(=O)CCl)Br Z56896297 [0,1,0,0,0,0|3,0,0]=4 204 B13R1.2879 CC1=C(C=CC(=C1)NC(=O)CN)Br Z1262250878 [0,1,0,0,0,0|3,0,0]=4 205 B13R1.2879 CCC(=O)NC1=CC(=C(C=C1)C)N Z274783014 [0,1,0,0,0,0|3,0,0]=4 206 B13R1.2879 CCC(=O)NC1=CC(=C(C=C1)Cl)N Z57727810 [0,1,0,0,0,0|3,0,0]=4 207 B13R1.2879 CCC(=O)NC1=CC(=C(C=C1)F)F Z30847226 [0,1,0,0,0,0|3,0,0]=4 208 B13R1.2879 CCC(=O)NC1=CC(=C(C=C1)O)C Z1462270632 [0,1,0,0,0,0|2,0,0]=3 209 B13R1.2879 CNC(=O)NC1=CC(=C(C=C1)Br)N Z1524590207 [0,1,0,0,0,0|3,0,0]=4 210 B13R1.2879 CNC(=O)NC1=CC(=C(C=C1)C)Cl Z56324726 [0,1,0,0,0,0|3,0,0]=4 211 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)Br)C Z1269181902 [0,1,0,0,0,0|2,0,0]=3 212 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)Br)Cl Z1269151508 [0,1,0,0,0,0|2,0,0]=3 213 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)Br)N Z1269164086 [0,1,0,0,0,0|2,0,0]=3 214 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)C)C Z25338237 [0,1,0,0,0,0|2,0,0]=3 215 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)F Z1255453601 [0,1,0,0,0,0|1,0,0]=2 216 B13R1.2879 COC(=O)CC1=CC(=C(C=C1)O)N Z1201622979 [0,1,0,0,0,0|1,0,0]=2 217 B13R1.2879 NCC(=O)NC1=CC(=C(C=C1)Br)Br Z4191134164 [0,1,0,0,0,0|3,0,0]=4 218 B13R1.2879 O=C(CCl)CC1=CC(=C(C=C1)Cl)Cl Z408178482 [0,1,0,0,0,0|2,0,0]=3 219 B13R1.2879 O=C(CCl)CC1=CC(=C(C=C1)F)F Z1269236760 [0,1,0,0,0,0|2,0,0]=3 220 B13R1.2879 O=C(CCl)NC1=CC(=C(C=C1)Cl)Cl Z56821872 [0,1,0,0,0,0|3,0,0]=4 221 B13R1.2879 O=C(CCl)NC1=CC(=C(C=C1)Cl)F Z445401080 [0,1,0,0,0,0|3,0,0]=4 222 B13R1.2879 O=C(CCl)NC1=CC(=C(C=C1)F)Cl Z56821913 [0,1,0,0,0,0|3,0,0]=4 223 B13R1.2879 O=C(CCl)NC1=CC(=C(C=C1)F)F Z56896202 [0,1,0,0,0,0|3,0,0]=4 224 B13R1.3528 CC(=O)NC1=C(C(=C(C=C1)O)F)F Z1216843975 [0,1,0,0,0,0|2,0,0]=3 225 B13R1.3528 CC1=C(C=CC(=C1Cl)Cl)CC(=O)O Z2311004283 [0,1,0,0,0,0|3,0,0]=4 226 B13R1.3528 O=C(O)CC1=C(C(=C(C=C1)Br)Cl)F Z1873778182 [0,1,0,0,0,0|3,0,0]=4 227 B13R1.3763 CC(=O)NC1=CC(=C(C(=C1)Cl)N)Cl Z198271514 [0,1,0,0,0,0|3,0,0]=4 228 B13R1.3763 CC(=O)NC1=CC(=C(C(=C1)F)I)F Z976260834 [0,1,0,0,0,0|3,0,0]=4 229 B13R2.1279 O=C(O)CC1=CC2=C(C=C1)CC2 Z1551937159 [0,0,0,1,0,0|3,0,0]=4 230 B13R2.3050 CC1=C(C=CC2=C1NC(=O)C2)Br Z1269161601 [0,0,0,1,0,0|3,0,0]=4 231 B13R2.3050 CC1=CC2=C(N1)C=CC(=C2F)O Z1198172122 [0,0,0,1,0,0|3,0,0]=4 232 B13R2.3050 O=C1CC2=C(N1)C(=C(C=C2)Br)F Z3244825035 [0,0,0,1,0,0|3,0,0]=4 233 B13R2.3050 O=C1CC2=C(N1)C=CC(=C2F)O Z1198223512 [0,0,0,1,0,0|2,0,0]=3 234 B13R2.13083 NC1=C(C=C2NC(=O)CC2=C1)Cl Z335455232 [0,0,0,1,0,0|3,0,0]=4 235 B13R2.13083 NC1=C(C=C2SC(=O)OC2=C1)O Z1551917573 [0,0,0,1,0,0|3,0,0]=4 236 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)Cl)Br Z425365108 [0,0,0,1,0,0|3,0,0]=4 237 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)Cl)F Z1198234271 [0,0,0,1,0,0|3,0,0]=4 238 B13R2.13083 O=C1CC2=CC(=C(C=C2N1)F)Br Z1629740138 [0,0,0,1,0,0|3,0,0]=4 239 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)Cl Z1513833014 [0,0,0,1,0,0|3,0,0]=4 240 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)I Z1551960387 [0,0,0,1,0,0|3,0,0]=4 241 B13R2.13083 O=C1OC2=CC(=C(C=C2S1)O)O Z1551923954 [0,0,0,1,0,0|2,0,0]=3 242 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)C Z1269191523 [0,0,0,0,1,0|2,0,0]=3 243 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)Cl Z1269244993 [0,0,0,0,1,0|2,0,0]=3 244 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)F Z1269159079 [0,0,0,0,1,0|2,0,0]=3 245 B11R1.21 CC(=O)C1=CC(=C(C=C1)Br)N Z1269218710 [0,0,0,0,1,0|2,0,0]=3 246 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)C Z104477440 [0,0,0,0,1,0|2,0,0]=3 247 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)F Z513735432 [0,0,0,0,1,0|2,0,0]=3 248 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)N Z1198175137 [0,0,0,0,1,0|2,0,0]=3 249 B11R1.21 CC(=O)C1=CC(=C(C=C1)C)O Z1198169413 [0,0,0,0,1,0|1,0,0]=2 250 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Br Z1269168018 [0,0,0,0,1,0|2,0,0]=3 251 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)Cl Z104475662 [0,0,0,0,1,0|2,0,0]=3 252 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)F Z1201622912 [0,0,0,0,1,0|2,0,0]=3 253 B11R1.21 CC(=O)C1=CC(=C(C=C1)Cl)N Z979493752 [0,0,0,0,1,0|2,0,0]=3 254 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Br Z199532232 [0,0,0,0,1,0|2,0,0]=3 255 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)C Z606338894 [0,0,0,0,1,0|2,0,0]=3 256 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)Cl Z335437578 [0,0,0,0,1,0|2,0,0]=3 257 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)F Z56968900 [0,0,0,0,1,0|2,0,0]=3 258 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)N Z1198150660 [0,0,0,0,1,0|2,0,0]=3 259 B11R1.21 CC(=O)C1=CC(=C(C=C1)F)O Z1201626572 [0,0,0,0,1,0|1,0,0]=2 260 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)N Z1255447249 [0,0,0,0,1,0|2,0,0]=3 261 B11R1.21 CC(=O)C1=CC(=C(C=C1)N)O Z1198158301 [0,0,0,0,1,0|1,0,0]=2 262 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Br Z1037557930 [0,0,0,0,1,0|1,0,0]=2 263 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)C Z57221419 [0,0,0,0,1,0|1,0,0]=2 264 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)Cl Z57905816 [0,0,0,0,1,0|1,0,0]=2 265 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)F Z385458772 [0,0,0,0,1,0|1,0,0]=2 266 B11R1.21 CC(=O)C1=CC(=C(C=C1)O)N Z1664347745 [0,0,0,0,1,0|1,0,0]=2 267 B11R1.21 CC(=O)C1=CC(=C(N=C1)Cl)C Z1255426822 [0,0,0,0,1,0|3,0,0]=4 268 B11R1.21 CC(=O)C1=CC(=C(N=C1)Cl)Cl Z1198277843 [0,0,0,0,1,0|3,0,0]=4 269 B11R1.21 CC(=O)C1=NC(=C(C=C1)C)F Z1255393952 [0,0,0,0,1,0|3,0,0]=4 270 B11R1.21 CC(C)C1=CC(=C(C=C1)O)N Z57441596 [0,0,0,0,1,0|2,0,1]=4 271 B11R1.21 CC(N)C1=CC(=C(C=C1)Br)O Z1551939587 [0,0,0,0,1,0|2,0,1]=4 272 B11R1.21 CC(N)C1=CC(=C(C=C1)O)O Z4958589100 [0,0,0,0,1,0|1,0,1]=3 273 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)Br Z57206544 [0,0,0,0,1,0|3,0,0]=4 274 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)F Z116821650 [0,0,0,0,1,0|3,0,0]=4 275 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)N Z57912417 [0,0,0,0,1,0|3,0,0]=4 276 B11R1.21 CC1=C(C=C(C=C1)C(=O)N)O Z323032498 [0,0,0,0,1,0|2,0,0]=3 277 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Br Z57204180 [0,0,0,0,1,0|3,0,0]=4 278 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)C Z104477078 [0,0,0,0,1,0|3,0,0]=4 279 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)Cl Z1097117588 [0,0,0,0,1,0|3,0,0]=4 280 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)F Z104510124 [0,0,0,0,1,0|3,0,0]=4 281 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)I Z239685220 [0,0,0,0,1,0|3,0,0]=4 282 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)N Z57127001 [0,0,0,0,1,0|3,0,0]=4 283 B11R1.21 CC1=C(C=C(C=C1)C(=O)O)O Z166652050 [0,0,0,0,1,0|2,0,0]=3 284 B11R1.21 CC1=C(C=C(C=C1)C(C)C)O Z104496566 [0,0,0,0,1,0|2,0,1]=4 285 B11R1.21 CC1=C(C=C(C=C1)[N+](=O)[O-])O Z415740552 [0,0,0,0,1,0|3,0,0]=4 286 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)I Z1118973913 [0,0,0,0,1,0|3,0,0]=4 287 B11R1.21 CC1=C(C=CC(=C1)C(=O)N)N Z239125318 [0,0,0,0,1,0|3,0,0]=4 288 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Br Z1269154857 [0,0,0,0,1,0|3,0,0]=4 289 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)Cl Z1201618086 [0,0,0,0,1,0|3,0,0]=4 290 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)F Z959335402 [0,0,0,0,1,0|3,0,0]=4 291 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)I Z239685242 [0,0,0,0,1,0|3,0,0]=4 292 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)N Z223458490 [0,0,0,0,1,0|3,0,0]=4 293 B11R1.21 CC1=C(C=CC(=C1)C(=O)O)O Z995149794 [0,0,0,0,1,0|2,0,0]=3 294 B11R1.21 CC1=C(C=CC(=C1)N(C)C)O Z4988450441 [0,0,0,0,1,0|3,0,0]=4 295 B11R1.21 CC1=C(C=CC(=C1)[N+](=O)[O-])O Z415740536 [0,0,0,0,1,0|3,0,0]=4 296 B11R1.21 CC1=C(N=C(C=C1)C(=O)O)O Z1255445643 [0,0,0,0,1,0|3,0,0]=4 297 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)F Z851822858 [0,0,0,0,1,0|3,0,0]=4 298 B11R1.21 NC(=O)C1=CC(=C(C=C1)Br)O Z1269119521 [0,0,0,0,1,0|2,0,0]=3 299 B11R1.21 NC(=O)C1=CC(=C(C=C1)Cl)N Z239125304 [0,0,0,0,1,0|3,0,0]=4 300 B11R1.21 NC(=O)C1=CC(=C(C=C1)F)F Z82670082 [0,0,0,0,1,0|3,0,0]=4 301 B11R1.21 NC(=O)C1=CC(=C(C=C1)F)N Z316119774 [0,0,0,0,1,0|3,0,0]=4 302 B11R1.21 NC(=O)C1=CC(=C(C=C1)I)Br Z394874930 [0,0,0,0,1,0|3,0,0]=4 303 B11R1.21 NC(=O)C1=CC(=C(C=C1)I)F Z1127744306 [0,0,0,0,1,0|3,0,0]=4 304 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)Br Z317054104 [0,0,0,0,1,0|3,0,0]=4 305 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)F Z995047024 [0,0,0,0,1,0|3,0,0]=4 306 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)N Z424798268 [0,0,0,0,1,0|3,0,0]=4 307 B11R1.21 NC(=O)C1=CC(=C(C=C1)N)O Z1126161217 [0,0,0,0,1,0|2,0,0]=3 308 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)Cl Z68591301 [0,0,0,0,1,0|2,0,0]=3 309 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)F Z1255448698 [0,0,0,0,1,0|2,0,0]=3 310 B11R1.21 NC(=O)C1=CC(=C(C=C1)O)O Z1198152898 [0,0,0,0,1,0|1,0,0]=2 311 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Br Z319214986 [0,0,0,0,1,0|3,0,0]=4 312 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)Cl Z1082868852 [0,0,0,0,1,0|3,0,0]=4 313 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)F Z756936498 [0,0,0,0,1,0|3,0,0]=4 314 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)N Z104484514 [0,0,0,0,1,0|3,0,0]=4 315 B11R1.21 NC1=C(C=C(C=C1)C(=O)O)O Z431554234 [0,0,0,0,1,0|2,0,0]=3 316 B11R1.21 NC1=C(C=C(C=N1)C(=O)O)O Z3325079213 [0,0,0,0,1,0|3,0,0]=4 317 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Br Z57127000 [0,0,0,0,1,0|3,0,0]=4 318 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)Cl Z104478358 [0,0,0,0,1,0|3,0,0]=4 319 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)F Z283856672 [0,0,0,0,1,0|3,0,0]=4 320 B11R1.21 NC1=C(C=CC(=C1)C(=O)O)I Z1079174176 [0,0,0,0,1,0|3,0,0]=4 321 B11R1.21 NC1=C(C=CC(=C1)[N+](=O)[O-])O Z56346992 [0,0,0,0,1,0|3,0,0]=4 322 B11R1.21 NC1=C(C=CC(=N1)C(=O)O)O Z1198313022 [0,0,0,0,1,0|3,0,0]=4 323 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)Cl Z1269111039 [0,0,0,0,1,0|3,0,0]=4 324 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)F Z756477072 [0,0,0,0,1,0|3,0,0]=4 325 B11R1.21 O=C(O)C1=CC(=C(C=C1)Br)O Z1269234103 [0,0,0,0,1,0|2,0,0]=3 326 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Br Z1269180540 [0,0,0,0,1,0|3,0,0]=4 327 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)Cl Z104474098 [0,0,0,0,1,0|3,0,0]=4 328 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)F Z636292752 [0,0,0,0,1,0|3,0,0]=4 329 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)I Z239685218 [0,0,0,0,1,0|3,0,0]=4 330 B11R1.21 O=C(O)C1=CC(=C(C=C1)Cl)O Z1201619372 [0,0,0,0,1,0|2,0,0]=3 331 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Br Z381356490 [0,0,0,0,1,0|3,0,0]=4 332 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)Cl Z1203161796 [0,0,0,0,1,0|3,0,0]=4 333 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)F Z104341246 [0,0,0,0,1,0|3,0,0]=4 334 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)I Z1269207858 [0,0,0,0,1,0|3,0,0]=4 335 B11R1.21 O=C(O)C1=CC(=C(C=C1)F)O Z1203161962 [0,0,0,0,1,0|2,0,0]=3 336 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Br Z382582728 [0,0,0,0,1,0|3,0,0]=4 337 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)Cl Z1269153522 [0,0,0,0,1,0|3,0,0]=4 338 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)F Z1115194701 [0,0,0,0,1,0|3,0,0]=4 339 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)I Z1269131507 [0,0,0,0,1,0|3,0,0]=4 340 B11R1.21 O=C(O)C1=CC(=C(C=C1)I)O Z1269202149 [0,0,0,0,1,0|2,0,0]=3 341 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Br Z57985393 [0,0,0,0,1,0|2,0,0]=3 342 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)Cl Z104503564 [0,0,0,0,1,0|2,0,0]=3 343 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)F Z57073754 [0,0,0,0,1,0|2,0,0]=3 344 B11R1.21 O=C(O)C1=CC(=C(C=C1)O)O Z104501142 [0,0,0,0,1,0|1,0,0]=2 345 B11R1.21 O=C(O)C1=CC(=C(C=C1)S)Br Z1269190145 [0,0,0,0,1,0|2,1,0]=4 346 B11R1.21 O=C(O)C1=CC(=C(N=C1)Br)O Z1269173146 [0,0,0,0,1,0|3,0,0]=4 347 B11R1.21 O=C(O)C1=CC(=C(N=C1)I)O Z1269115116 [0,0,0,0,1,0|3,0,0]=4 348 B11R1.21 O=C(O)C1=CC(=C(N=C1)O)F Z1255436475 [0,0,0,0,1,0|3,0,0]=4 349 B11R1.21 O=C(O)C1=CC(=O)N(C=C1)O Z3244880399 [0,0,0,0,1,0|2,0,1]=4 350 B11R1.21 O=C(O)C1=CC=C(C(=O)O1)O Z1262515745 [0,0,0,0,1,0|2,0,1]=4 351 B11R1.21 O=C(O)C1=CN(C(=O)C=C1)O Z1255463617 [0,0,0,0,1,0|2,0,1]=4 352 B11R1.21 O=C(O)C1=NC(=C(C=C1)Br)O Z1269135378 [0,0,0,0,1,0|3,0,0]=4 353 B11R1.21 O=C(O)C1=NC=C(C(=C1)O)Br Z1269108466 [0,0,0,0,1,0|3,0,0]=4 354 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)Cl)O Z57160128 [0,0,0,0,1,0|3,0,0]=4 355 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)Br Z442212768 [0,0,0,0,1,0|3,0,0]=4 356 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)Cl Z99601186 [0,0,0,0,1,0|3,0,0]=4 357 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)F Z382708858 [0,0,0,0,1,0|3,0,0]=4 358 B11R1.21 O=[N+]([O-])C1=CC(=C(C=C1)O)O Z1255450010 [0,0,0,0,1,0|2,0,0]=3 359 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)Cl)Cl Z406376846 [0,0,0,0,0,1|2,0,0]=3 360 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)F)F Z1021461268 [0,0,0,0,0,1|2,0,0]=3 361 B13R1.511 CC(=O)CCC1=CC(=C(C=C1)O)F Z1083021660 [0,0,0,0,0,1|1,0,0]=2 362 B13R1.511 CC(=O)COC1=CC(=C(C=C1)F)F Z427845606 [0,0,0,0,0,1|2,0,0]=3 363 B13R1.511 CC(=O)NCC1=CC(=C(C=C1)Cl)C Z1667602107 [0,0,0,0,0,1|2,0,0]=3 364 B13R1.511 CC(=O)NCC1=CC(=C(C=C1)F)C Z212644652 [0,0,0,0,0,1|2,0,0]=3 365 B13R1.511 CC(=O)OCC1=CC(=O)C(=CO1)O Z1235828823 [0,0,0,0,0,1|1,0,1]=3 366 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)C Z445853388 [0,0,0,0,0,1|3,0,0]=4 367 B13R1.511 CC1=C(C=C(C=C1)CCC(=O)O)Cl Z185153284 [0,0,0,0,0,1|3,0,0]=4 368 B13R1.511 CC1=C(C=C(C=C1)OCC(=O)N)C Z18468931 [0,0,0,0,0,1|3,0,0]=4 369 B13R1.511 CC1=C(C=C(C=C1)OCC(=O)O)C Z56820874 [0,0,0,0,0,1|3,0,0]=4 370 B13R1.511 CC1=C(C=C(C=C1)SCC(=O)N)C Z24835957 [0,0,0,0,0,1|3,0,0]=4 371 B13R1.511 CC1=C(C=C(C=C1)SCC(=O)O)C Z55903758 [0,0,0,0,0,1|3,0,0]=4 372 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)N)Br Z1359984894 [0,0,0,0,0,1|3,0,0]=4 373 B13R1.511 CC1=C(C=CC(=C1)CCC(=O)O)Br Z1269176292 [0,0,0,0,0,1|3,0,0]=4 374 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)N)Cl Z18758332 [0,0,0,0,0,1|3,0,0]=4 375 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)N)N Z239127644 [0,0,0,0,0,1|3,0,0]=4 376 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)O)Br Z57204188 [0,0,0,0,0,1|3,0,0]=4 377 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)O)Cl Z56823032 [0,0,0,0,0,1|3,0,0]=4 378 B13R1.511 CC1=C(C=CC(=C1)OCC(=O)O)F Z1262524725 [0,0,0,0,0,1|3,0,0]=4 379 B13R1.511 CN(C)CCC1=CC(=C(C=C1)O)O Z1501469796 [0,0,0,0,0,1|2,0,0]=3 380 B13R1.511 NC(=O)CCC1=CC(=C(C=C1)F)F Z365255896 [0,0,0,0,0,1|3,0,0]=4 381 B13R1.511 NC(=O)COC1=CC(=C(C=C1)Cl)Cl Z18431658 [0,0,0,0,0,1|3,0,0]=4 382 B13R1.511 NC(=O)COC1=CC(=C(C=C1)F)Cl Z18430744 [0,0,0,0,0,1|3,0,0]=4 383 B13R1.511 NC(=O)NCC1=CC(=C(C=C1)F)Cl Z992427188 [0,0,0,0,0,1|3,0,0]=4 384 B13R1.511 NC(=O)NCC1=CC(=C(C=C1)I)Cl Z2007148452 [0,0,0,0,0,1|3,0,0]=4 385 B13R1.511 NC(=O)NCC1=CC(=C(C=C1)O)F Z1244088772 [0,0,0,0,0,1|2,0,0]=3 386 B13R1.511 O=C(O)/C=C/C1=CC(=C(C=C1)O)O Z240113804 [0,0,0,0,0,1|1,0,1]=3 387 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Br)Cl Z57039611 [0,0,0,0,0,1|3,0,0]=4 388 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Cl)Cl Z237515176 [0,0,0,0,0,1|3,0,0]=4 389 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)Cl)F Z838969840 [0,0,0,0,0,1|3,0,0]=4 390 B13R1.511 O=C(O)CCC1=CC(=C(C=C1)O)Cl Z839165388 [0,0,0,0,0,1|2,0,0]=3 391 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)Cl Z65558737 [0,0,0,0,0,1|3,0,0]=4 392 B13R1.511 O=C(O)COC1=CC(=C(C=C1)Cl)F Z1486018170 [0,0,0,0,0,1|3,0,0]=4 393 B13R1.511 O=C(O)COC1=CC(=C(C=C1)F)Cl Z65577990 [0,0,0,0,0,1|3,0,0]=4 394 B13R1.511 O=C(O)COC1=CC(=C(C=C1)F)F Z228583518 [0,0,0,0,0,1|3,0,0]=4 395 B13R1.511 O=C(O)CSC1=CC(=C(C=C1)F)F Z92655191 [0,0,0,0,0,1|3,0,0]=4 396 B10R1.1 CC1=CC=C(C=C1)CC=O Z993017610 [2,0,0,0,0,0|1,0,0]=3 397 B10R1.1 CCCC1=CC=C(C=C1)Br Z299596168 [2,0,0,0,0,0|1,0,1]=4 398 B10R1.1 CCCC1=CC=C(C=C1)N Z104492166 [2,0,0,0,0,0|1,0,1]=4 399 B10R1.1 CCNC1=CC=C(C=C1)O Z1823256830 [2,0,0,0,0,0|1,0,1]=4 400 B10R1.1 CNCC1=CC=C(C=C1)Br Z56175269 [2,0,0,0,0,0|2,0,0]=4 401 B10R1.1 CNCC1=CC=C(C=C1)C Z56944115 [2,0,0,0,0,0|2,0,0]=4 402 B10R1.1 CNCC1=CC=C(C=C1)Cl Z56956070 [2,0,0,0,0,0|2,0,0]=4 403 B10R1.1 CNCC1=CC=C(C=C1)F Z56963340 [2,0,0,0,0,0|2,0,0]=4 404 B10R1.1 CNCC1=CC=C(C=C1)I Z4242747560 [2,0,0,0,0,0|2,0,0]=4 405 B10R1.1 COCC1=CC=C(C=C1)N Z240084568 [2,0,0,0,0,0|2,0,0]=4 406 B10R1.1 CSCC1=CC=C(C=C1)Br Z19854469 [2,0,0,0,0,0|2,0,0]=4 407 B10R1.1 CSCC1=CC=C(C=C1)N Z732207336 [2,0,0,0,0,0|2,0,0]=4 408 B10R1.1 N#CCC1=CC=C(C=C1)O Z90120144 [2,0,0,0,0,0|1,0,1]=4 409 B10R1.1 NCCC1=CC=C(C=C1)O Z744729058 [2,0,0,0,0,0|1,0,1]=4 410 B10R1.1 O=CCC1=CC=C(C=C1)Br Z1079442512 [2,0,0,0,0,0|1,0,0]=3 411 B10R1.1 O=CCC1=CC=C(C=C1)Cl Z993017718 [2,0,0,0,0,0|1,0,0]=3 412 B10R1.1 O=CCC1=CC=C(C=C1)F Z993017752 [2,0,0,0,0,0|1,0,0]=3 413 B10R1.1 O=CNC1=CC=C(C=C1)O Z87002541 [2,0,0,0,0,0|1,0,0]=3 414 B10R1.1 OCCC1=CC=C(C=C1)O Z1250886919 [2,0,0,0,0,0|0,0,2]=4 415 B10R1.18 CC(=O)CC1=CC=NC=C1 Z992409812 [2,0,0,0,0,0|1,0,0]=3 416 B10R1.18 CC(=O)CC1=NC=CN=C1 Z1098219337 [2,0,0,0,0,0|2,0,0]=4 417 B10R1.18 CC(=O)NC1=CC=CC=C1 Z27782600 [2,0,0,0,0,0|1,0,0]=3 418 B10R1.18 CC(=O)NC1=CN=CC=C1 Z31791378 [2,0,0,0,0,0|2,0,0]=4 419 B10R1.18 CC(C)CC1=CC=CC=C1 Z104486386 [2,0,0,0,0,0|1,0,1]=4 420 B10R1.18 CC(O)CC1=CC=CC=C1 Z513749298 [2,0,0,0,0,0|0,0,2]=4 421 B10R1.18 N=C(N)CC1=CC=CC=C1 Z600428462 [2,0,0,0,0,0|2,0,0]=4 422 B10R1.18 NC(=O)CC1=CC=CC=C1 Z33546508 [2,0,0,0,0,0|1,0,0]=3 423 B10R1.18 NC(=O)CC1=CC=NC=C1 Z234895093 [2,0,0,0,0,0|2,0,0]=4 424 B10R1.18 NC(=O)OC1=CC=CC=C1 Z33547080 [2,0,0,0,0,0|2,0,0]=4 425 B10R1.18 NC(=S)CC1=CC=CC=C1 Z56928578 [2,0,0,0,0,0|1,1,0]=4 426 B10R1.18 O=C(O)CC1=CC=NC=C1 Z271099418 [2,0,0,0,0,0|2,0,0]=4 427 B10R1.18 O=C(O)CC1=CN=CC=C1 Z285131558 [2,0,0,0,0,0|2,0,0]=4 428 B10R1.18 O=S(O)CC1=CC=CC=C1 Z3211806022 [2,0,0,0,0,0|2,0,0]=4 429 B10R1.18 O=[N+]([O-])CC1=CC=CC=C1 Z995236210 [2,0,0,0,0,0|2,0,0]=4 430 B10R1.10 CCCC1=CC(=CC=C1)Br Z1541586975 [2,0,0,0,0,0|1,0,1]=4 431 B10R1.10 CNCC1=CC(=CC=C1)C Z102766992 [2,0,0,0,0,0|2,0,0]=4 432 B10R1.10 CNCC1=CC(=CC=C1)Cl Z56963343 [2,0,0,0,0,0|2,0,0]=4 433 B10R1.10 CNCC1=CC(=CC=C1)F Z56946085 [2,0,0,0,0,0|2,0,0]=4 434 B10R1.10 CNCC1=CC(=CC=C1)I Z3302798080 [2,0,0,0,0,0|2,0,0]=4 435 B10R1.10 CNCC1=CC(=CC=C1)O Z102766970 [2,0,0,0,0,0|1,0,0]=3 436 B10R1.10 COCC1=CC(=CC=C1)N Z285163816 [2,0,0,0,0,0|2,0,0]=4 437 B10R1.10 COCC1=CC(=CC=C1)O Z821093526 [2,0,0,0,0,0|1,0,0]=3 438 B10R1.10 CSCC1=CC(=CC=C1)Br Z17129082 [2,0,0,0,0,0|2,0,0]=4 439 B10R1.10 CSCC1=CC(=CC=C1)N Z732207152 [2,0,0,0,0,0|2,0,0]=4 440 B10R1.10 N#CCC1=CC=CC(=C1)O Z1198161712 [2,0,0,0,0,0|1,0,1]=4 441 B10R1.10 NC1=CC(=CC=C1)NC=O Z1203578959 [2,0,0,0,0,0|2,0,0]=4 442 B10R1.10 NCCC1=CC(=CC=C1)O Z935140764 [2,0,0,0,0,0|1,0,1]=4 443 B10R1.10 O=CCC1=CC=CC(=C1)Br Z1079442816 [2,0,0,0,0,0|1,0,0]=3 444 B10R1.10 O=CCC1=CC=CC(=C1)Cl Z993017836 [2,0,0,0,0,0|1,0,0]=3 445 B10R1.10 O=CNC1=CC=CC(=C1)O Z56886391 [2,0,0,0,0,0|1,0,0]=3 446 B10R1.176 CC1=C(C=C(C=C1)C=O)Br Z1198165094 [2,0,0,0,0,0|2,0,0]=4 447 B10R1.176 CC1=C(C=C(C=C1)C=O)C Z147641440 [2,0,0,0,0,0|2,0,0]=4 448 B10R1.176 CC1=C(C=C(C=C1)C=O)Cl Z1097119562 [2,0,0,0,0,0|2,0,0]=4 449 B10R1.176 CC1=C(C=C(C=C1)C=O)F Z1079442530 [2,0,0,0,0,0|2,0,0]=4 450 B10R1.176 CC1=C(C=C(C=C1)C=O)O Z1198157218 [2,0,0,0,0,0|1,0,0]=3 451 B10R1.176 CC1=C(C=C(C=C1)CN)O Z3951014909 [2,0,0,0,0,0|2,0,0]=4 452 B10R1.176 CC1=C(C=CC(=C1)C=O)Br Z1198175071 [2,0,0,0,0,0|2,0,0]=4 453 B10R1.176 CC1=C(C=CC(=C1)C=O)Cl Z1201621734 [2,0,0,0,0,0|2,0,0]=4 454 B10R1.176 CC1=C(C=CC(=C1)C=O)F Z732814060 [2,0,0,0,0,0|2,0,0]=4 455 B10R1.176 CC1=C(C=CC(=C1)C=O)I Z1269181559 [2,0,0,0,0,0|2,0,0]=4 456 B10R1.176 CC1=C(C=CC(=C1)C=O)O Z1082846778 [2,0,0,0,0,0|1,0,0]=3 457 B10R1.176 CC1=C(C=CC(=N1)C=O)O Z1255405992 [2,0,0,0,0,0|2,0,0]=4 458 B10R1.176 CC1=C(N=CC(=C1)C=O)O Z1415926172 [2,0,0,0,0,0|2,0,0]=4 459 B10R1.176 CCC1=CC(=C(C=C1)Br)Cl Z1551924078 [2,0,0,0,0,0|2,0,0]=4 460 B10R1.176 CCC1=CC(=C(C=C1)Br)N Z2753220544 [2,0,0,0,0,0|2,0,0]=4 461 B10R1.176 CCC1=CC(=C(C=C1)N)F Z1255421063 [2,0,0,0,0,0|2,0,0]=4 462 B10R1.176 CCC1=CC(=C(C=C1)N)N Z1198311235 [2,0,0,0,0,0|2,0,0]=4 463 B10R1.176 CCC1=CC(=C(C=C1)O)C Z1255463943 [2,0,0,0,0,0|1,0,0]=3 464 B10R1.176 CCC1=CC(=C(C=C1)O)N Z1318147478 [2,0,0,0,0,0|1,0,0]=3 465 B10R1.176 COC1=CC(=C(C=C1)C)O Z1255384359 [2,0,0,0,0,0|2,0,0]=4 466 B10R1.176 COC1=CC(=C(C=C1)O)C Z1198310476 [2,0,0,0,0,0|2,0,0]=4 467 B10R1.176 COC1=CC(=C(C=C1)O)N Z57727878 [2,0,0,0,0,0|2,0,0]=4 468 B10R1.176 CSC1=CC(=C(C=C1)Br)O Z1269146558 [2,0,0,0,0,0|2,0,0]=4 469 B10R1.176 NC1=C(C=C(C=C1)C=O)Cl Z1198314265 [2,0,0,0,0,0|2,0,0]=4 470 B10R1.176 NCC1=CC(=C(C=C1)F)O Z2786079401 [2,0,0,0,0,0|2,0,0]=4 471 B10R1.176 NCC1=CC(=C(C=C1)O)Br Z1436472846 [2,0,0,0,0,0|2,0,0]=4 472 B10R1.176 NCC1=CC(=C(C=C1)O)Cl Z2757555437 [2,0,0,0,0,0|2,0,0]=4 473 B10R1.176 NCC1=CC(=C(C=C1)O)F Z1250080941 [2,0,0,0,0,0|2,0,0]=4 474 B10R1.176 NCC1=CC(=C(C=C1)O)O Z1272096628 [2,0,0,0,0,0|1,0,0]=3 475 B10R1.176 O=CC1=CC(=C(C=C1)Br)Br Z1269188996 [2,0,0,0,0,0|2,0,0]=4 476 B10R1.176 O=CC1=CC(=C(C=C1)Br)Cl Z1269162864 [2,0,0,0,0,0|2,0,0]=4 477 B10R1.176 O=CC1=CC(=C(C=C1)Br)F Z1079442824 [2,0,0,0,0,0|2,0,0]=4 478 B10R1.176 O=CC1=CC(=C(C=C1)Cl)Br Z1269163997 [2,0,0,0,0,0|2,0,0]=4 479 B10R1.176 O=CC1=CC(=C(C=C1)Cl)Cl Z57887872 [2,0,0,0,0,0|2,0,0]=4 480 B10R1.176 O=CC1=CC(=C(C=C1)Cl)F Z838969200 [2,0,0,0,0,0|2,0,0]=4 481 B10R1.176 O=CC1=CC(=C(C=C1)Cl)O Z1255452805 [2,0,0,0,0,0|1,0,0]=3 482 B10R1.176 O=CC1=CC(=C(C=C1)F)Br Z104489526 [2,0,0,0,0,0|2,0,0]=4 483 B10R1.176 O=CC1=CC(=C(C=C1)F)Cl Z586248502 [2,0,0,0,0,0|2,0,0]=4 484 B10R1.176 O=CC1=CC(=C(C=C1)F)F Z104477800 [2,0,0,0,0,0|2,0,0]=4 485 B10R1.176 O=CC1=CC(=C(C=C1)F)I Z1269142176 [2,0,0,0,0,0|2,0,0]=4 486 B10R1.176 O=CC1=CC(=C(C=C1)O)Br Z56960236 [2,0,0,0,0,0|1,0,0]=3 487 B10R1.176 O=CC1=CC(=C(C=C1)O)Cl Z57313902 [2,0,0,0,0,0|1,0,0]=3 488 B10R1.176 O=CC1=CC(=C(C=C1)O)F Z385458796 [2,0,0,0,0,0|1,0,0]=3 489 B10R1.176 O=CC1=CC(=C(C=C1)O)O Z56957508 [2,0,0,0,0,0|0,0,0]=2 490 B10R1.176 O=CC1=CC(=C(N=C1)O)Br Z1269204264 [2,0,0,0,0,0|2,0,0]=4 491 B10R1.176 O=CC1=NC(=C(C=C1)O)O Z3243070108 [2,0,0,0,0,0|1,0,0]=3 492 B10R1.176 OCC1=CC(=C(C=C1)I)O Z1269159331 [2,0,0,0,0,0|1,0,1]=4 493 B10R1.176 OCC1=CC(=C(C=C1)O)Cl Z839172284 [2,0,0,0,0,0|1,0,1]=4 494 B10R1.176 OCC1=CC(=C(C=C1)O)F Z385458838 [2,0,0,0,0,0|1,0,1]=4 495 B10R1.176 OCC1=NC=C(C(=C1)O)O Z3003010756 [2,0,0,0,0,0|1,0,1]=4 496 B12R1.4 C#CC1=CC=C(C=C1)NC(=O)C Z1509142033 [1,1,0,0,0,0|2,0,0]=4 497 B12R1.4 CC(=O)NC1=CC=C(C=C1)C#N Z30612220 [1,1,0,0,0,0|2,0,0]=4 498 B12R1.4 CC(=O)NC1=CC=C(C=C1)C=O Z104472864 [1,1,0,0,0,0|1,0,1]=4 499 B12R1.4 CC(=O)NC1=CC=C(C=C1)CN Z235336571 [1,1,0,0,0,0|2,0,0]=4 500 B12R1.4 CC(=O)NC1=CC=C(C=C1)CO Z228585230 [1,1,0,0,0,0|1,0,0]=3 501 B12R1.4 CC(=O)OC1=CC=C(C=C1)C=O Z57887890 [1,1,0,0,0,0|1,0,1]=4 502 B12R1.4 CC(=O)OC1=CC=C(C=C1)CCl Z1255365081 [1,1,0,0,0,0|2,0,0]=4 503 B12R1.4 CC(=O)OC1=CC=C(C=C1)CN Z2216303143 [1,1,0,0,0,0|2,0,0]=4 504 B12R1.4 CC(C)CC1=CC=C(C=C1)CO Z385370338 [1,1,0,0,0,0|1,0,1]=4 505 B12R1.4 CCC1=CC=C(C=C1)CC(=O)O Z274782844 [1,1,0,0,0,0|2,0,0]=4 506 B12R1.4 CCC1=CC=C(C=C1)NC(=O)C Z30917832 [1,1,0,0,0,0|2,0,0]=4 507 B12R1.4 CN(C)CC1=CC=C(C=C1)CO Z336081024 [1,1,0,0,0,0|2,0,0]=4 508 B12R1.4 CNC1=CC=C(C=C1)NC(=O)C Z335252368 [1,1,0,0,0,0|2,0,0]=4 509 B12R1.4 COC1=CC=C(C=C1)CC(=O)N Z33546648 [1,1,0,0,0,0|1,0,0]=3 510 B12R1.4 COC1=CC=C(C=C1)CC(=O)O Z104476074 [1,1,0,0,0,0|1,0,0]=3 511 B12R1.4 COC1=CC=C(C=C1)CC(C)O Z228586162 [1,1,0,0,0,0|0,0,2]=4 512 B12R1.4 COC1=CC=C(C=C1)NC(=O)C Z28138902 [1,1,0,0,0,0|1,0,0]=3 513 B12R1.4 COC1=CC=C(C=C1)NC(=O)N Z56754681 [1,1,0,0,0,0|2,0,0]=4 514 B12R1.4 COC1=CC=C(C=C1)OC(=O)C Z30195429 [1,1,0,0,0,0|1,0,0]=3 515 B12R1.4 COC1=CN=C(C=C1)CC(=O)O Z1913661249 [1,1,0,0,0,0|2,0,0]=4 516 B12R1.4 COC1=NC=C(C=C1)CC(=O)C Z1216822629 [1,1,0,0,0,0|1,0,0]=3 517 B12R1.4 COC1=NC=C(C=C1)NC(=O)C Z26413930 [1,1,0,0,0,0|2,0,0]=4 518 B12R1.4 CSC1=CC=C(C=C1)CC(=O)O Z1212966448 [1,1,0,0,0,0|1,1,0]=4 519 B12R1.4 CSC1=CC=C(C=C1)NC(=O)C Z25066204 [1,1,0,0,0,0|1,1,0]=4 520 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)N Z982774006 [1,1,0,0,0,0|2,0,0]=4 521 B12R1.4 N#CC1=CC=C(C=C1)CC(=O)O Z362118788 [1,1,0,0,0,0|2,0,0]=4 522 B12R1.4 O=CC1=CC=C(C=C1)CC(=O)O Z1198269767 [1,1,0,0,0,0|1,0,1]=4 523 B12R1.20 C=C(C)C(=O)C1=CC=C(C=C1)O Z1513599636 [1,1,0,0,0,0|1,0,1]=4 524 B12R1.20 CC(=O)C(C)C1=CC=C(C=C1)Cl Z1276728135 [1,1,0,0,0,0|1,0,0]=3 525 B12R1.20 CC(=O)C(Cl)C1=CC=C(C=C1)F Z1255439681 [1,1,0,0,0,0|1,0,0]=3 526 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)N Z147641478 [1,1,0,0,0,0|2,0,0]=4 527 B12R1.20 CC(=O)N(C)C1=CC=C(C=C1)O Z335806634 [1,1,0,0,0,0|1,0,0]=3 528 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Br Z1259342200 [1,1,0,0,0,0|2,0,0]=4 529 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)Cl Z982129848 [1,1,0,0,0,0|2,0,0]=4 530 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)F Z792377290 [1,1,0,0,0,0|2,0,0]=4 531 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)I Z1269218602 [1,1,0,0,0,0|2,0,0]=4 532 B12R1.20 CC(C(=O)O)C1=CC=C(C=C1)N Z2935001159 [1,1,0,0,0,0|2,0,0]=4 533 B12R1.20 CC1=CC=C(C=C1)C(C)C(=O)O Z792377274 [1,1,0,0,0,0|2,0,0]=4 534 B12R1.20 CC1=CC=C(C=C1)C(N)C(=O)O Z317024662 [1,1,0,0,0,0|2,0,0]=4 535 B12R1.20 CN(C(=O)N)C1=CC=C(C=C1)O Z285211056 [1,1,0,0,0,0|2,0,0]=4 536 B12R1.20 NC(=O)C(Br)C1=CC=C(C=C1)F Z198750878 [1,1,0,0,0,0|2,0,0]=4 537 B12R1.20 NC(=O)C(Cl)C1=CC=C(C=C1)Br Z56791849 [1,1,0,0,0,0|2,0,0]=4 538 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Br Z57069227 [1,1,0,0,0,0|2,0,0]=4 539 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)Cl Z1255523404 [1,1,0,0,0,0|2,0,0]=4 540 B12R1.20 NC(=O)C(N)C1=CC=C(C=C1)F Z220512688 [1,1,0,0,0,0|2,0,0]=4 541 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Br Z317024668 [1,1,0,0,0,0|2,0,0]=4 542 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)Cl Z317024646 [1,1,0,0,0,0|2,0,0]=4 543 B12R1.20 NC(C(=O)O)C1=CC=C(C=C1)F Z317024670 [1,1,0,0,0,0|2,0,0]=4 544 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(C=C1)O Z1198149764 [1,1,0,0,0,0|1,0,0]=3 545 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)F Z1255390982 [1,1,0,0,0,0|2,0,0]=4 546 B12R1.20 N[C@H](C(=O)O)C1=CC=C(C=C1)O Z1255364887 [1,1,0,0,0,0|1,0,0]=3 547 B12R1.20 O=C(O)C(=O)C1=CC=C(C=C1)O Z2472464309 [1,1,0,0,0,0|1,0,1]=4 548 B12R1.20 O=C(O)C(F)C1=CC=C(C=C1)F Z1318255176 [1,1,0,0,0,0|2,0,0]=4 549 B12R1.20 O=C(O)C(O)C1=CC=C(C=C1)Br Z788000726 [1,1,0,0,0,0|2,0,0]=4 550 B12R1.49 C/C(=C\C1=CC=C(C=C1)Cl)/C=O Z1251359146 [1,1,0,0,0,0|1,0,1]=4 551 B12R1.49 CC1=CC=C(C=C1)CC(=O)CCl Z316174762 [1,1,0,0,0,0|1,0,0]=3 552 B12R1.49 CC1=CC=C(C=C1)CC(=O)NO Z90728587 [1,1,0,0,0,0|2,0,0]=4 553 B12R1.49 CC1=CC=C(C=C1)NC(=O)CCl Z56862730 [1,1,0,0,0,0|2,0,0]=4 554 B12R1.49 CC1=CC=C(C=C1)NC(=O)CO Z228585410 [1,1,0,0,0,0|2,0,0]=4 555 B12R1.49 CCC(=O)CC1=CC=C(C=C1)Br Z513733694 [1,1,0,0,0,0|1,0,0]=3 556 B12R1.49 CCC(=O)CC1=CC=C(C=C1)C Z513735300 [1,1,0,0,0,0|1,0,0]=3 557 B12R1.49 CCC(=O)NC1=CC=C(C=C1)F Z27805867 [1,1,0,0,0,0|2,0,0]=4 558 B12R1.49 CCC(=O)NC1=CC=C(C=C1)I Z30316420 [1,1,0,0,0,0|2,0,0]=4 559 B12R1.49 CCC(=O)NC1=CC=C(C=C1)N Z432066898 [1,1,0,0,0,0|2,0,0]=4 560 B12R1.49 CCC(=O)NC1=CC=C(C=C1)O Z223656304 [1,1,0,0,0,0|1,0,0]=3 561 B12R1.49 CCC(N)CC1=CC=C(C=C1)O Z1815149210 [1,1,0,0,0,0|1,0,1]=4 562 B12R1.49 CNC(=O)CC1=CC=C(C=C1)Br Z30272406 [1,1,0,0,0,0|1,0,0]=3 563 B12R1.49 CNC(=O)CC1=CC=C(C=C1)N Z239124750 [1,1,0,0,0,0|1,0,0]=3 564 B12R1.49 CNC(=O)CC1=CC=C(C=C1)O Z135505392 [1,1,0,0,0,0|0,0,0]=2 565 B12R1.49 CNC(=O)NC1=CC=C(C=C1)Cl Z55293750 [1,1,0,0,0,0|2,0,0]=4 566 B12R1.49 CNC(=O)NC1=CC=C(C=C1)F Z55293762 [1,1,0,0,0,0|2,0,0]=4 567 B12R1.49 CNC(=O)NC1=CC=C(C=C1)N Z246671880 [1,1,0,0,0,0|2,0,0]=4 568 B12R1.49 COC(=O)CC1=CC=C(C=C1)Br Z18830099 [1,1,0,0,0,0|1,0,0]=3 569 B12R1.49 COC(=O)CC1=CC=C(C=C1)Cl Z18425668 [1,1,0,0,0,0|1,0,0]=3 570 B12R1.49 COC(=O)CC1=CC=C(C=C1)N Z285139238 [1,1,0,0,0,0|1,0,0]=3 571 B12R1.49 COC(=O)NC1=CC=C(C=C1)Br Z56758690 [1,1,0,0,0,0|2,0,0]=4 572 B12R1.49 COC(=O)NC1=CC=C(C=C1)N Z319610150 [1,1,0,0,0,0|2,0,0]=4 573 B12R1.49 COC(=O)NC1=CC=C(C=C1)O Z335810072 [1,1,0,0,0,0|1,0,0]=3 574 B12R1.49 NCC(=O)CC1=CC=C(C=C1)F Z1889902528 [1,1,0,0,0,0|1,0,0]=3 575 B12R1.49 NCC(=O)NC1=CC=C(C=C1)Br Z594272012 [1,1,0,0,0,0|2,0,0]=4 576 B12R1.49 NCC(=O)NC1=CC=C(C=C1)Cl Z803145238 [1,1,0,0,0,0|2,0,0]=4 577 B12R1.49 NCC(=O)NC1=CC=C(C=C1)N Z2895972079 [1,1,0,0,0,0|2,0,0]=4 578 B12R1.49 NCC(=O)NC1=CC=C(C=C1)O Z1262237164 [1,1,0,0,0,0|1,0,0]=3 579 B12R1.49 NNC(=O)CC1=CC=C(C=C1)Cl Z56346881 [1,1,0,0,0,0|2,0,0]=4 580 B12R1.49 NNC(=O)CC1=CC=C(C=C1)F Z56347387 [1,1,0,0,0,0|2,0,0]=4 581 B12R1.49 N[C@@H](CO)CC1=CC=C(C=C1)O Z295456854 [1,1,0,0,0,0|1,0,1]=4 582 B12R1.49 N[C@H](CO)CC1=CC=C(C=C1)O Z203038576 [1,1,0,0,0,0|1,0,1]=4 583 B12R1.49 O=C(CC1=CC=C(C=C1)Br)NO Z59182179 [1,1,0,0,0,0|2,0,0]=4 584 B12R1.49 O=C(CC1=CC=C(C=C1)Cl)NO Z59182084 [1,1,0,0,0,0|2,0,0]=4 585 B12R1.49 O=C(CC1=CC=C(C=C1)F)NO Z59182031 [1,1,0,0,0,0|2,0,0]=4 586 B12R1.49 O=C(CC1=CC=C(C=C1)O)NO Z135512374 [1,1,0,0,0,0|1,0,0]=3 587 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Br Z408178414 [1,1,0,0,0,0|1,0,0]=3 588 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)Cl Z316174770 [1,1,0,0,0,0|1,0,0]=3 589 B12R1.49 O=C(CCl)CC1=CC=C(C=C1)F Z316174768 [1,1,0,0,0,0|1,0,0]=3 590 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)Br Z56899212 [1,1,0,0,0,0|2,0,0]=4 591 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)Cl Z56867253 [1,1,0,0,0,0|2,0,0]=4 592 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)F Z56755193 [1,1,0,0,0,0|2,0,0]=4 593 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)I Z56869425 [1,1,0,0,0,0|2,0,0]=4 594 B12R1.49 O=C(CCl)NC1=CC=C(C=C1)O Z166646964 [1,1,0,0,0,0|1,0,0]=3 595 B12R1.49 O=C(CO)CC1=CC=C(C=C1)F Z906206828 [1,1,0,0,0,0|1,0,0]=3 596 B12R1.49 O=C(CO)NC1=CC=C(C=C1)Cl Z228585484 [1,1,0,0,0,0|2,0,0]=4 597 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)Br Z416908782 [1,1,0,0,0,0|2,0,0]=4 598 B12R1.106 CS(=O)(=O)CC1=CC=C(C=C1)N Z732208132 [1,1,0,0,0,0|2,0,0]=4 599 B12R1.106 CS(=O)(=O)NC1=CC=C(C=C1)O Z45652935 [1,1,0,0,0,0|2,0,0]=4 600 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Br)F Z992965764 [1,1,0,0,0,0|1,0,0]=3 601 B12R1.233 CC(=O)CC1=C(C=C(C=C1)Cl)F Z1198331241 [1,1,0,0,0,0|1,0,0]=3 602 B12R1.233 CC(=O)CC1=C(C=C(C=C1)F)Br Z992965738 [1,1,0,0,0,0|1,0,0]=3 603 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)C Z26621747 [1,1,0,0,0,0|2,0,0]=4 604 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)Cl Z29819536 [1,1,0,0,0,0|2,0,0]=4 605 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)F Z30824336 [1,1,0,0,0,0|2,0,0]=4 606 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Br)N Z362832080 [1,1,0,0,0,0|2,0,0]=4 607 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)Br Z26522737 [1,1,0,0,0,0|2,0,0]=4 608 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)C Z27801599 [1,1,0,0,0,0|2,0,0]=4 609 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)N Z274782976 [1,1,0,0,0,0|2,0,0]=4 610 B12R1.233 CC(=O)NC1=C(C=C(C=C1)C)O Z33451994 [1,1,0,0,0,0|2,0,0]=4 611 B12R1.233 CC(=O)NC1=C(C=C(C=C1)Cl)N Z239120680 [1,1,0,0,0,0|2,0,0]=4 612 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)Br Z361888984 [1,1,0,0,0,0|2,0,0]=4 613 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)C Z29827980 [1,1,0,0,0,0|2,0,0]=4 614 B12R1.233 CC(=O)NC1=C(C=C(C=C1)F)F Z30802596 [1,1,0,0,0,0|2,0,0]=4 615 B12R1.233 CC(=O)NC1=C(C=C(C=C1)I)C Z30179236 [1,1,0,0,0,0|2,0,0]=4 616 B12R1.233 CC(=O)NC1=C(C=C(C=C1)I)Cl Z394383940 [1,1,0,0,0,0|2,0,0]=4 617 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)C Z239121088 [1,1,0,0,0,0|2,0,0]=4 618 B12R1.233 CC(=O)NC1=C(C=C(C=C1)N)Cl Z223844400 [1,1,0,0,0,0|2,0,0]=4 619 B12R1.233 CC(=O)OC1=C(C=C(C=C1)Br)C Z1516170019 [1,1,0,0,0,0|2,0,0]=4 620 B12R1.233 CC(=O)OC1=C(C=C(C=C1)Br)Cl Z26745892 [1,1,0,0,0,0|2,0,0]=4 621 B12R1.233 CC(C)CC1=C(C=C(C=C1)O)O Z1513805538 [1,1,0,0,0,0|1,0,1]=4 622 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)N Z1617965385 [1,1,0,0,0,0|2,0,0]=4 623 B12R1.233 CC1=C(C=CC(=C1)Br)CC(=O)O Z1269213926 [1,1,0,0,0,0|2,0,0]=4 624 B12R1.233 CC1=C(C=CC(=C1)F)CC(=O)O Z982130478 [1,1,0,0,0,0|2,0,0]=4 625 B12R1.233 CC1=CC(=C(C=C1)CC(=O)O)Br Z1269232519 [1,1,0,0,0,0|2,0,0]=4 626 B12R1.233 NC(=O)CC1=C(C=C(C=C1)Br)Cl Z2692246846 [1,1,0,0,0,0|2,0,0]=4 627 B12R1.233 NC1=CC(=C(C=C1)CC(=O)O)F Z1198183551 [1,1,0,0,0,0|2,0,0]=4 628 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)Cl Z1269137680 [1,1,0,0,0,0|2,0,0]=4 629 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)I Z1269231484 [1,1,0,0,0,0|2,0,0]=4 630 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Br)O Z1269204929 [1,1,0,0,0,0|2,0,0]=4 631 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Br Z1187934893 [1,1,0,0,0,0|2,0,0]=4 632 B12R1.233 O=C(O)CC1=C(C=C(C=C1)Cl)Cl Z104477206 [1,1,0,0,0,0|2,0,0]=4 633 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Br Z285184632 [1,1,0,0,0,0|2,0,0]=4 634 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)Cl Z285184620 [1,1,0,0,0,0|2,0,0]=4 635 B12R1.233 O=C(O)CC1=C(C=C(C=C1)F)F Z362118706 [1,1,0,0,0,0|2,0,0]=4 636 B12R1.233 O=C(O)CC1=C(C=C(C=C1)O)Cl Z1198307592 [1,1,0,0,0,0|1,0,0]=3 637 B12R1.50 CC1=CC(=CC=C1)CC(=O)CCl Z276118998 [1,1,0,0,0,0|1,0,0]=3 638 B12R1.50 CC1=CC(=CC=C1)NC(=O)CCl Z56862383 [1,1,0,0,0,0|2,0,0]=4 639 B12R1.50 CC1=CC(=CC=C1)NC(=O)CO Z431952658 [1,1,0,0,0,0|2,0,0]=4 640 B12R1.50 CCC(=O)NC1=CC(=CC=C1)Br Z27788979 [1,1,0,0,0,0|2,0,0]=4 641 B12R1.50 CCC(=O)NC1=CC(=CC=C1)F Z28143170 [1,1,0,0,0,0|2,0,0]=4 642 B12R1.50 CCC(=O)NC1=CC(=CC=C1)N Z57243699 [1,1,0,0,0,0|2,0,0]=4 643 B12R1.50 CCS(=O)CC1=CC(=CC=C1)Br Z1618064713 [1,1,0,0,0,0|2,0,0]=4 644 B12R1.50 CNC(=O)CC1=CC(=CC=C1)O Z816010790 [1,1,0,0,0,0|0,0,0]=2 645 B12R1.50 CNC(=O)NC1=CC(=CC=C1)I Z177091564 [1,1,0,0,0,0|2,0,0]=4 646 B12R1.50 CNC(=O)NC1=CC(=CC=C1)N Z254059098 [1,1,0,0,0,0|2,0,0]=4 647 B12R1.50 CNC(=O)OC1=CC(=CC=C1)O Z1509352023 [1,1,0,0,0,0|1,0,0]=3 648 B12R1.50 COC(=O)CC1=CC(=CC=C1)Br Z905185712 [1,1,0,0,0,0|1,0,0]=3 649 B12R1.50 COC(=O)CC1=CC(=CC=C1)N Z1250132316 [1,1,0,0,0,0|1,0,0]=3 650 B12R1.50 COC(=O)CC1=CC(=CC=C1)O Z816010254 [1,1,0,0,0,0|0,0,0]=2 651 B12R1.50 COC(=O)CC1=CC(=CN=C1)Br Z1269220704 [1,1,0,0,0,0|2,0,0]=4 652 B12R1.50 COC(=O)NC1=CC(=CC=C1)C Z371333120 [1,1,0,0,0,0|2,0,0]=4 653 B12R1.50 COC(=O)NC1=CC(=CC=C1)Cl Z56754690 [1,1,0,0,0,0|2,0,0]=4 654 B12R1.50 COC(=O)NC1=CC(=CC=C1)N Z319610162 [1,1,0,0,0,0|2,0,0]=4 655 B12R1.50 COC(=O)NC1=CC(=CC=C1)O Z335810160 [1,1,0,0,0,0|1,0,0]=3 656 B12R1.50 NC1=CC(=CC=C1)NC(=O)CO Z385458324 [1,1,0,0,0,0|2,0,0]=4 657 B12R1.50 NCC(=O)CC1=CC(=CC=C1)Br Z1981870420 [1,1,0,0,0,0|1,0,0]=3 658 B12R1.50 NCC(=O)NC1=CC(=CC=C1)Br Z46280185 [1,1,0,0,0,0|2,0,0]=4 659 B12R1.50 NCC(=O)NC1=CC(=CC=C1)F Z46280394 [1,1,0,0,0,0|2,0,0]=4 660 B12R1.50 O=C(CC1=CC(=CC=C1)F)NO Z59182830 [1,1,0,0,0,0|2,0,0]=4 661 B12R1.50 O=C(CC1=CC(=CC=C1)O)NO Z816010210 [1,1,0,0,0,0|1,0,0]=3 662 B12R1.50 O=C(CCl)CC1=CC(=CC=C1)Br Z408178442 [1,1,0,0,0,0|1,0,0]=3 663 B12R1.50 O=C(CCl)CC1=CC(=CC=C1)Cl Z316174772 [1,1,0,0,0,0|1,0,0]=3 664 B12R1.50 O=C(CCl)CC1=CC=CC(=C1)F Z316174766 [1,1,0,0,0,0|1,0,0]=3 665 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)Br Z56896266 [1,1,0,0,0,0|2,0,0]=4 666 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)Cl Z56869410 [1,1,0,0,0,0|2,0,0]=4 667 B12R1.50 O=C(CCl)NC1=CC(=CC=C1)I Z56824475 [1,1,0,0,0,0|2,0,0]=4 668 B12R1.50 O=C(CCl)NC1=CC=CC(=C1)F Z56889137 [1,1,0,0,0,0|2,0,0]=4 669 B12R1.101 CC(=O)NC1=CC(=CC(=C1)C)C Z30889668 [1,1,0,0,0,0|2,0,0]=4 670 B12R1.101 CC(=O)NC1=CC(=CC(=C1)Cl)Cl Z30181347 [1,1,0,0,0,0|2,0,0]=4 671 B12R1.101 CC(=O)NC1=CC(=CC(=C1)I)I Z2078739597 [1,1,0,0,0,0|2,0,0]=4 672 B12R1.101 CC1=CC(=CC(=C1)CC(=O)O)C Z274447882 [1,1,0,0,0,0|2,0,0]=4 673 B12R1.101 NC1=CC(=CC(=C1)Br)CC(=O)O Z2732612288 [1,1,0,0,0,0|2,0,0]=4 674 B12R1.101 O=C(O)CC1=CC(=CC(=C1)Cl)Cl Z1269159102 [1,1,0,0,0,0|2,0,0]=4 675 B12R1.101 O=C(O)CC1=CC(=CC(=C1)F)Br Z1269139128 [1,1,0,0,0,0|2,0,0]=4 676 B12R1.101 O=C(O)CC1=CC(=CC(=C1)I)I Z1269132492 [1,1,0,0,0,0|2,0,0]=4 677 B12R1.101 O=C(O)CC1=CC(=CC(=C1)O)Br Z1269195529 [1,1,0,0,0,0|1,0,0]=3 678 B12R1.119 CS(=O)(=O)CC1=CC(=CC=C1)N Z732207952 [1,1,0,0,0,0|2,0,0]=4 679 B12R1.119 CS(=O)(=O)NC1=CC(=CC=C1)O Z45637535 [1,1,0,0,0,0|2,0,0]=4 680 B12R1.127 CC(=O)CC1=C(C=CC(=C1)F)Br Z992965748 [1,1,0,0,0,0|1,0,0]=3 681 B12R1.127 CC(=O)CN1C=C(C=CC1=O)Br Z1863617790 [1,1,0,0,0,0|2,0,0]=4 682 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)C Z448251216 [1,1,0,0,0,0|2,0,0]=4 683 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Br)Cl Z1037552282 [1,1,0,0,0,0|2,0,0]=4 684 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Br Z56827897 [1,1,0,0,0,0|2,0,0]=4 685 B12R1.127 CC(=O)NC1=C(C=CC(=C1)C)Cl Z276567178 [1,1,0,0,0,0|2,0,0]=4 686 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)C Z27065719 [1,1,0,0,0,0|2,0,0]=4 687 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)Cl Z28136791 [1,1,0,0,0,0|2,0,0]=4 688 B12R1.127 CC(=O)NC1=C(C=CC(=C1)Cl)N Z239121632 [1,1,0,0,0,0|2,0,0]=4 689 B12R1.127 CC(=O)NC1=C(C=CC(=C1)F)C Z30904143 [1,1,0,0,0,0|2,0,0]=4 690 B12R1.127 CC(=O)NC1=C(C=CC(=C1)I)Cl Z1408462342 [1,1,0,0,0,0|2,0,0]=4 691 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)C Z239120816 [1,1,0,0,0,0|2,0,0]=4 692 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)Cl Z431580096 [1,1,0,0,0,0|2,0,0]=4 693 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)F Z235362233 [1,1,0,0,0,0|2,0,0]=4 694 B12R1.127 CC(=O)NC1=C(C=CC(=C1)N)O Z1198342725 [1,1,0,0,0,0|2,0,0]=4 695 B12R1.127 CC1=C(C=C(C=C1)Br)CC(=O)O Z1269235842 [1,1,0,0,0,0|2,0,0]=4 696 B12R1.127 CC1=CC(=C(C=C1)Br)CC(=O)O Z1269198963 [1,1,0,0,0,0|2,0,0]=4 697 B12R1.127 CC1=CC(=C(C=C1)C)CC(=O)O Z234894443 [1,1,0,0,0,0|2,0,0]=4 698 B12R1.127 CC1=CC(=C(C=C1)F)CC(=O)O Z982130030 [1,1,0,0,0,0|2,0,0]=4 699 B12R1.127 CS(=O)CC1=C(C=CC(=C1)N)Cl Z802580894 [1,1,0,0,0,0|2,0,0]=4 700 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Br Z1269185355 [1,1,0,0,0,0|2,0,0]=4 701 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)Cl Z1269155132 [1,1,0,0,0,0|2,0,0]=4 702 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Br)F Z285225836 [1,1,0,0,0,0|2,0,0]=4 703 B12R1.127 O=C(O)CC1=C(C=CC(=C1)Cl)Br Z1269132555 [1,1,0,0,0,0|2,0,0]=4 704 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)Br Z285131566 [1,1,0,0,0,0|2,0,0]=4 705 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)F Z362118692 [1,1,0,0,0,0|2,0,0]=4 706 B12R1.127 O=C(O)CC1=C(C=CC(=C1)F)O Z1255403749 [1,1,0,0,0,0|2,0,0]=4 707 B12R1.127 O=C(O)CC1=C(C=CC(=C1)I)Br Z1269158801 [1,1,0,0,0,0|2,0,0]=4 708 B12R1.127 O=C(O)CC1=C(C=CC(=C1)O)Br Z1269121921 [1,1,0,0,0,0|1,0,0]=3 709 B12R1.224 CC(=O)NC1=C(C(=CC=C1)Br)Cl Z2017822392 [1,1,0,0,0,0|2,0,0]=4 710 B12R1.224 CC(=O)NC1=C(C(=CC=C1)Cl)C Z28292377 [1,1,0,0,0,0|2,0,0]=4 711 B12R1.224 CC(=O)NC1=C(C(=CC=C1)N)C Z239122448 [1,1,0,0,0,0|2,0,0]=4 712 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Br Z1269227300 [1,1,0,0,0,0|2,0,0]=4 713 B12R1.224 CC1=C(C(=CC=C1)CC(=O)O)Cl Z1198264659 [1,1,0,0,0,0|2,0,0]=4 714 B12R1.224 CC1=C(C=CC=C1Br)CC(=O)O Z1269111906 [1,1,0,0,0,0|2,0,0]=4 715 B12R1.224 CC1=C(C=CC=C1N)CS(=O)C Z802581006 [1,1,0,0,0,0|2,0,0]=4 716 B12R1.224 NC(=O)CC1=C(C(=CC=C1)Cl)F Z2169650265 [1,1,0,0,0,0|2,0,0]=4 717 B12R1.224 NC1=C(C(=CC=C1)CC(=O)O)N Z1551954875 [1,1,0,0,0,0|2,0,0]=4 718 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)Cl Z1269150472 [1,1,0,0,0,0|2,0,0]=4 719 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Br)I Z1269162570 [1,1,0,0,0,0|2,0,0]=4 720 B12R1.224 O=C(O)CC1=C(C(=CC=C1)Cl)Cl Z982129970 [1,1,0,0,0,0|2,0,0]=4 721 B12R1.224 O=C(O)CC1=C(C(=CC=C1)F)F Z445167096 [1,1,0,0,0,0|2,0,0]=4 722 B12R1.224 O=C(O)CC1=C(C(=CC=C1)O)F Z1198218753 [1,1,0,0,0,0|1,0,0]=3 723 B12R1.224 O=C(O)CN1C=CC=C(C1=O)O Z1262513138 [1,1,0,0,0,0|2,0,0]=4 724 B12R1.225 CC(=O)C(O)C1=CC(=CC=C1)Cl Z1255467340 [1,1,0,0,0,0|1,0,0]=3 725 B12R1.225 CC(=O)N(C)C1=CC(=CC=C1)N Z802628524 [1,1,0,0,0,0|2,0,0]=4 726 B12R1.225 CC(C(=O)O)C1=CC(=CC=C1)F Z792377330 [1,1,0,0,0,0|2,0,0]=4 727 B12R1.225 CC(C1=CC(=CC=C1)O)N(C)C Z1176485649 [1,1,0,0,0,0|2,0,0]=4 728 B12R1.225 CC1=CC(=CC=C1)C(N)C(=O)O Z317024596 [1,1,0,0,0,0|2,0,0]=4 729 B12R1.225 CC1=CC(=CC=C1)C(O)C(=O)O Z788000614 [1,1,0,0,0,0|2,0,0]=4 730 B12R1.225 CC1=CC=CC(=C1)C(C)C(=O)O Z802854000 [1,1,0,0,0,0|2,0,0]=4 731 B12R1.225 C[C@@H](C1=CC(=CC=C1)O)N(C)C Z1198169241 [1,1,0,0,0,0|2,0,0]=4 732 B12R1.225 C[C@H](N)[C@H](O)C1=CC(=CC=C1)O Z2050038784 [1,1,0,0,0,0|1,0,1]=4 733 B12R1.225 NC(=O)C(N)C1=CC(=CC=C1)Br Z477338262 [1,1,0,0,0,0|2,0,0]=4 734 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Br Z317024672 [1,1,0,0,0,0|2,0,0]=4 735 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)Cl Z317024654 [1,1,0,0,0,0|2,0,0]=4 736 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)F Z317024592 [1,1,0,0,0,0|2,0,0]=4 737 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)I Z3477438782 [1,1,0,0,0,0|2,0,0]=4 738 B12R1.225 NC(C(=O)O)C1=CC(=CC=C1)O Z1532541074 [1,1,0,0,0,0|1,0,0]=3 739 B12R1.225 NC1=CC(=CC=C1)C(O)C(=O)O Z1262512603 [1,1,0,0,0,0|2,0,0]=4 740 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Br Z788000730 [1,1,0,0,0,0|2,0,0]=4 741 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)Cl Z788000712 [1,1,0,0,0,0|2,0,0]=4 742 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)F Z788000610 [1,1,0,0,0,0|2,0,0]=4 743 B12R1.225 O=C(O)C(O)C1=CC(=CC=C1)I Z1269151011 [1,1,0,0,0,0|2,0,0]=4 744 B12R1.438 CC(=O)NC1=CC(=CC=C1)C#N Z26548069 [1,1,0,0,0,0|2,0,0]=4 745 B12R1.438 CC(=O)NC1=CC(=CC=C1)C=O Z1238570824 [1,1,0,0,0,0|1,0,1]=4 746 B12R1.438 CC(=O)NC1=CC(=CC=C1)CN Z239097364 [1,1,0,0,0,0|2,0,0]=4 747 B12R1.438 CC(=O)NC1=CC(=CC=C1)CO Z28913035 [1,1,0,0,0,0|1,0,0]=3 748 B12R1.438 CCC1=CC(=CC=C1)CC(=O)O Z1198264513 [1,1,0,0,0,0|2,0,0]=4 749 B12R1.438 CN(C)CC1=CC(=CC=C1)CO Z336081030 [1,1,0,0,0,0|2,0,0]=4 750 B12R1.438 COC1=CC(=CC=C1)CC(=N)N Z951367838 [1,1,0,0,0,0|2,0,0]=4 751 B12R1.438 COC1=CC(=CC=C1)CC(=O)N Z33547068 [1,1,0,0,0,0|1,0,0]=3 752 B12R1.438 COC1=CC(=CC=C1)CC(=O)O Z104478986 [1,1,0,0,0,0|1,0,0]=3 753 B12R1.438 COC1=CC(=CC=C1)NC(=O)C Z27795266 [1,1,0,0,0,0|1,0,0]=3 754 B12R1.438 COC1=NC=CC(=C1)CC(=O)O Z2186882871 [1,1,0,0,0,0|2,0,0]=4 755 B12R1.438 N#CC1=CC=CC(=C1)CC(=O)O Z982130150 [1,1,0,0,0,0|2,0,0]=4 756 B12R1.438 O=CC1=CC=CC(=C1)CC(=O)O Z1262512246 [1,1,0,0,0,0|1,0,1]=4 757 B12R1.286 C/C=C/C1=CC(=C(C=C1)O)OC Z57953030 [1,1,0,0,0,0|0,0,1]=3 758 B12R1.286 C=CCC1=CC(=C(C=C1)O)OC Z56347226 [1,1,0,0,0,0|0,0,1]=3 759 B12R1.286 CCCC1=CC(=C(C=C1)O)CO Z1513840121 [1,1,0,0,0,0|0,0,1]=3 760 B12R1.286 CNCC1=CC(=C(C=C1)O)OC Z425387552 [1,1,0,0,0,0|1,0,0]=3 761 B12R1.286 COC1=C(C=CC(=C1)CCN)O Z1268152336 [1,1,0,0,0,0|1,0,1]=4 762 B12R1.286 NCCC1=CC(=C(C=C1)O)CO Z1262658266 [1,1,0,0,0,0|1,0,1]=4 763 B12R1.288 CCCC1=CC(=C(C=C1)OC)O Z87001810 [1,1,0,0,0,0|0,0,1]=3 764 B12R1.288 CNCC1=CC(=C(C=C1)OC)Br Z3243654223 [1,1,0,0,0,0|2,0,0]=4 765 B12R1.288 CNCC1=CC(=C(C=C1)OC)C Z1101435075 [1,1,0,0,0,0|2,0,0]=4 766 B12R1.288 CNCC1=CC(=C(C=C1)OC)Cl Z839166898 [1,1,0,0,0,0|2,0,0]=4 767 B12R1.288 CNCC1=CC(=C(C=C1)OC)F Z85956704 [1,1,0,0,0,0|2,0,0]=4 768 B12R1.288 CNCC1=CC(=C(C=C1)OC)O Z57842333 [1,1,0,0,0,0|1,0,0]=3 769 B12R1.288 COC1=C(C=C(C=C1)CCO)O Z1198339386 [1,1,0,0,0,0|0,0,2]=4 770 B12R1.367 CC(C=O)C1=CC(=C(C=C1)Br)Cl Z2733489170 [1,1,0,0,0,0|2,0,0]=4 771 B12R1.367 CCC(C)C1=CC(=C(C=C1)O)N Z57441610 [1,1,0,0,0,0|1,0,1]=4 772 B12R1.385 CCCCC1=CC(=C(C=C1)O)C Z1416171318 [1,1,0,0,0,0|1,0,1]=4 773 B12R1.385 CNCCC1=CC(=C(C=C1)O)Br Z3710478807 [1,1,0,0,0,0|1,0,1]=4 774 B12R1.385 COCCC1=CC(=C(C=C1)O)Cl Z1513901493 [1,1,0,0,0,0|1,0,1]=4 775 B12R1.385 O=CCCC1=CC(=C(C=C1)Cl)Cl Z993017630 [1,1,0,0,0,0|2,0,0]=4 776 B12R1.385 O=CCCC1=CC(=C(C=C1)Cl)F Z1198182696 [1,1,0,0,0,0|2,0,0]=4 777 B12R1.385 O=CCCC1=CC(=C(C=C1)F)F Z1198182685 [1,1,0,0,0,0|2,0,0]=4 778 B12R1.23 CC(C)(C)C1=CC(=C(C=C1)O)O Z104476062 [0,1,0,0,1,0|1,0,1]=4 779 B12R1.23 CC1=C(C=CC(=C1)S(=O)(=O)C)O Z1486003588 [0,1,0,0,1,0|2,0,0]=4 780 B12R1.23 CS(=O)(=O)C1=CC(=C(C=C1)O)N Z57187730 [0,1,0,0,1,0|2,0,0]=4 781 B12R1.48 CC(=O)C1=CC(=C(C=C1)C#N)F Z1198275545 [0,1,0,0,1,0|2,0,0]=4 782 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)Br Z57042009 [0,1,0,0,1,0|1,0,0]=3 783 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)C Z415732058 [0,1,0,0,1,0|1,0,0]=3 784 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)Cl Z331027654 [0,1,0,0,1,0|1,0,0]=3 785 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)F Z85921976 [0,1,0,0,1,0|1,0,0]=3 786 B12R1.48 COC1=C(C=C(C=C1)C(=O)C)O Z1255365043 [0,1,0,0,1,0|0,0,0]=2 787 B12R1.48 COC1=C(C=C(C=C1)C(=O)N)Br Z101186024 [0,1,0,0,1,0|2,0,0]=4 788 B12R1.48 COC1=C(C=C(C=C1)C(=O)N)F Z87615059 [0,1,0,0,1,0|2,0,0]=4 789 B12R1.48 COC1=C(C=C(C=C1)C(=O)N)N Z239125322 [0,1,0,0,1,0|2,0,0]=4 790 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)Br Z57663652 [0,1,0,0,1,0|2,0,0]=4 791 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)Cl Z57790676 [0,1,0,0,1,0|2,0,0]=4 792 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)F Z57169536 [0,1,0,0,1,0|2,0,0]=4 793 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)I Z57200689 [0,1,0,0,1,0|2,0,0]=4 794 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)N Z274783176 [0,1,0,0,1,0|2,0,0]=4 795 B12R1.48 COC1=C(C=C(C=C1)C(=O)O)O Z381356676 [0,1,0,0,1,0|1,0,0]=3 796 B12R1.48 COC1=C(C=C(C=C1)C(C)C)O Z1255440315 [0,1,0,0,1,0|1,0,1]=4 797 B12R1.48 COC1=C(C=C(C=N1)C(=O)C)Cl Z1255495809 [0,1,0,0,1,0|2,0,0]=4 798 B12R1.48 CSC1=C(C=C(C=C1)C(=O)C)F Z732207810 [0,1,0,0,1,0|1,1,0]=4 799 B12R1.48 N#CC1=C(C=C(C=C1)C(=O)O)O Z1255367441 [0,1,0,0,1,0|2,0,0]=4 800 B12R1.48 NCC1=C(C=C(C=C1)C(=O)O)O Z3413989910 [0,1,0,0,1,0|2,0,0]=4 801 B12R1.48 O=C(O)C1=CC(=C(C=C1)CO)Cl Z1551918094 [0,1,0,0,1,0|2,0,0]=4 802 B12R1.48 O=C(O)C1=CC(=C(C=C1)CO)F Z1080722404 [0,1,0,0,1,0|2,0,0]=4 803 B12R1.48 O=CC1=C(C=C(C=C1)C(=O)O)O Z1255365429 [0,1,0,0,1,0|1,0,1]=4 804 B12R1.56 CC(=O)C1=CC(=C(C=C1)Br)C=O Z3325945410 [0,1,0,0,1,0|1,0,1]=4 805 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)C#N Z1198160291 [0,1,0,0,1,0|1,0,0]=3 806 B12R1.56 CC(=O)C1=CC(=C(C=C1)O)CCl Z56896221 [0,1,0,0,1,0|1,0,0]=3 807 B12R1.56 CC1=C(C=C(C=C1)C(=O)O)CO Z1262538882 [0,1,0,0,1,0|2,0,0]=4 808 B12R1.56 CCC1=C(C=CC(=C1)C(=O)O)O Z1255420244 [0,1,0,0,1,0|2,0,0]=4 809 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)Cl Z1198331246 [0,1,0,0,1,0|1,0,0]=3 810 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)F Z1201620068 [0,1,0,0,1,0|1,0,0]=3 811 B12R1.56 COC1=C(C=CC(=C1)C(=O)C)O Z57234303 [0,1,0,0,1,0|0,0,0]=2 812 B12R1.56 COC1=C(C=CC(=C1)C(=O)N)F Z1198168690 [0,1,0,0,1,0|2,0,0]=4 813 B12R1.56 COC1=C(C=CC(=C1)C(=O)N)N Z1126160967 [0,1,0,0,1,0|2,0,0]=4 814 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)C Z104511172 [0,1,0,0,1,0|2,0,0]=4 815 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)Cl Z1741972864 [0,1,0,0,1,0|2,0,0]=4 816 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)F Z1201620067 [0,1,0,0,1,0|2,0,0]=4 817 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)I Z1269139629 [0,1,0,0,1,0|2,0,0]=4 818 B12R1.56 COC1=C(C=CC(=C1)C(=O)O)O Z381356666 [0,1,0,0,1,0|1,0,0]=3 819 B12R1.56 COC1=C(C=CC(=C1)[N+](=O)[O-])O Z415740558 [0,1,0,0,1,0|2,0,0]=4 820 B12R1.56 COC1=C(N=CC(=C1)C(=O)O)O Z1201626480 [0,1,0,0,1,0|2,0,0]=4 821 B12R1.56 O=C(O)C1=CC(=C(C=C1)O)CO Z1262519174 [0,1,0,0,1,0|1,0,0]=3 822 B12R1.56 O=CC1=C(C=CC(=C1)C(=O)O)O Z1255434815 [0,1,0,0,1,0|1,0,1]=4 823 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Br)F)N Z2311264915 [0,1,0,0,1,0|2,0,0]=4 824 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Br)F)O Z1269206113 [0,1,0,0,1,0|2,0,0]=4 825 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)Br)O Z1269152570 [0,1,0,0,1,0|2,0,0]=4 826 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)C)Cl Z1258978241 [0,1,0,0,1,0|2,0,0]=4 827 B12R1.232 CC(=O)C1=C(C=C(C(=C1)C)C)O Z57784029 [0,1,0,0,1,0|2,0,0]=4 828 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Cl)C)Cl Z2310995571 [0,1,0,0,1,0|2,0,0]=4 829 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Cl)C)O Z57789902 [0,1,0,0,1,0|2,0,0]=4 830 B12R1.232 CC(=O)C1=C(C=C(C(=C1)Cl)Cl)O Z1269151638 [0,1,0,0,1,0|2,0,0]=4 831 B12R1.232 CC(=O)C1=C(C=C(C(=C1)F)Br)F Z1203660544 [0,1,0,0,1,0|2,0,0]=4 832 B12R1.232 CC(=O)C1=C(C=C(C(=C1)F)Br)O Z1269151731 [0,1,0,0,1,0|2,0,0]=4 833 B12R1.232 CC(=O)C1=C(C=C(C(=C1)F)Cl)Cl Z104496298 [0,1,0,0,1,0|2,0,0]=4 834 B12R1.232 CC(=O)C1=C(C=C(C(=C1)F)N)Br Z1269234772 [0,1,0,0,1,0|2,0,0]=4 835 B12R1.232 CC(=O)C1=C(C=C(C(=C1)O)F)F Z2310996536 [0,1,0,0,1,0|1,0,0]=3 836 B12R1.232 CC(=O)C1=C(C=C(C(=C1)O)O)O Z274502124 [0,1,0,0,1,0|0,0,0]=2 837 B12R1.232 CC1=C(C=C(C(=C1)O)O)C(=O)O Z1255427529 [0,1,0,0,1,0|1,0,0]=3 838 B12R1.232 NC1=C(C=C(C(=C1)F)O)C(=O)O Z905174978 [0,1,0,0,1,0|2,0,0]=4 839 B12R1.232 O=C(O)C1=C(C=C(C(=C1)Br)O)F Z1939443092 [0,1,0,0,1,0|2,0,0]=4 840 B12R1.893 CC(=O)C1=C(C(=C(C=C1)C)C)O Z1094698502 [0,1,0,0,1,0|2,0,0]=4 841 B12R1.893 CC(=O)C1=C(C(=C(C=C1)Cl)Cl)Cl Z104480064 [0,1,0,0,1,0|2,0,0]=4 842 B12R1.893 CC(=O)C1=C(C(=C(C=C1)Cl)Cl)O Z1021471392 [0,1,0,0,1,0|2,0,0]=4 843 B12R1.893 CC(=O)C1=C(C(=C(C=C1)Cl)F)F Z2311115615 [0,1,0,0,1,0|2,0,0]=4 844 B12R1.893 CC(=O)C1=C(C(=C(C=C1)F)F)O Z1201626570 [0,1,0,0,1,0|2,0,0]=4 845 B12R1.893 CC(=O)C1=C(C(=C(C=C1)F)O)F Z1255444801 [0,1,0,0,1,0|1,0,0]=3 846 B12R1.893 CC(=O)C1=C(C(=C(C=C1)O)O)O Z57124116 [0,1,0,0,1,0|0,0,0]=2 847 B12R1.893 CC1=C(C(=C(C=C1)C(=O)O)O)O Z367679376 [0,1,0,0,1,0|2,0,0]=4 848 B12R1.893 CC1=C(C=CC(=C1C)C(=O)O)O Z1262516396 [0,1,0,0,1,0|2,0,0]=4 849 B12R1.893 NC1=C(C=CC(=C1O)Cl)C(=O)O Z1262513945 [0,1,0,0,1,0|2,0,0]=4 850 B12R1.893 O=C(O)C1=C(C(=C(C=C1)F)O)F Z1198170692 [0,1,0,0,1,0|2,0,0]=4 851 B12R1.893 O=C(O)C1=C(C(=C(C=C1)O)F)F Z1201621018 [0,1,0,0,1,0|2,0,0]=4 852 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)C)F)C Z1247368644 [0,1,0,0,1,0|2,0,0]=4 853 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)C)O)O Z1513616099 [0,1,0,0,1,0|0,0,0]=2 854 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)F)F)F Z838972696 [0,1,0,0,1,0|2,0,0]=4 855 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)F)N)F Z1198179821 [0,1,0,0,1,0|2,0,0]=4 856 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)N)O)F Z2865634737 [0,1,0,0,1,0|1,0,0]=3 857 B12R1.1005 CC(=O)C1=CC(=C(C(=C1)O)O)O Z1255416032 [0,1,0,0,1,0|0,0,0]=2 858 B12R1.1005 CC1=C(C(=CC(=C1)C(=O)O)N)O Z3098876941 [0,1,0,0,1,0|2,0,0]=4 859 B12R1.1005 NC1=C(C(=CC(=C1)C(=O)O)F)O Z2719327202 [0,1,0,0,1,0|2,0,0]=4 860 B12R1.1005 NC1=C(C(=CC(=C1)C(=O)O)O)Cl Z1262544602 [0,1,0,0,1,0|2,0,0]=4 861 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)Br)O)Br Z1269227546 [0,1,0,0,1,0|2,0,0]=4 862 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)O)Br Z2310160029 [0,1,0,0,1,0|2,0,0]=4 863 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)O)Cl Z1262519254 [0,1,0,0,1,0|2,0,0]=4 864 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)F)O)F Z1097087058 [0,1,0,0,1,0|2,0,0]=4 865 B12R1.1005 O=C(O)C1=CC(=C(C(=C1)O)O)O Z104501122 [0,1,0,0,1,0|1,0,0]=3 866 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(=O)O)O Z56782558 [0,1,0,0,0,1|1,0,1]=4 867 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)C)O Z1255442373 [0,1,0,0,0,1|0,0,0]=2 868 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)Cl Z1269146778 [0,1,0,0,0,1|2,0,0]=4 869 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)O Z317038020 [0,1,0,0,0,1|1,0,0]=3 870 B14R1.42 COC1=C(C=CC(=C1)CCC(C)N)O Z3324923673 [0,1,0,0,0,1|1,0,1]=4 871 B14R1.42 O=CC1=C(C=CC(=C1)CCC(=O)O)O Z1262519251 [0,1,0,0,0,1|1,0,1]=4 872 B14R1.684 C[N+](C)(C)CCC1=CC(=C(C=C1)O)O Z1416163905 [0,1,0,0,0,1|2,0,0]=4 873 B14R1.685 CN(C)CC(=O)C1=CC(=C(C=C1)O)O Z1492781231 [0,1,0,0,0,1|2,0,0]=4 874 B14R1.686 CC(CC1=CC(=C(C=C1)O)O)C(=O)O Z1198162859 [0,1,0,0,0,1|1,0,0]=3 875 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)Br)C(=O)O Z1269188313 [0,1,0,0,0,1|2,0,0]=4 876 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)I)C(=O)O Z1269198907 [0,1,0,0,0,1|2,0,0]=4 877 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)O)C(=O)O Z756440064 [0,1,0,0,0,1|1,0,0]=3 878 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)O)C(=O)O Z1255419382 [0,1,0,0,0,1|1,0,0]=3 879 B14R1.833 CC1=C(C=C(C=C1)CNC(=O)CCl)F Z199423744 [0,1,0,0,0,1|2,0,0]=4 880 B14R1.833 CC1=C(C=C(C=C1)CNC(=O)CO)F Z431952198 [0,1,0,0,0,1|2,0,0]=4 881 B14R1.833 CC1=C(C=CC(=C1)CNC(=O)CCl)F Z258588542 [0,1,0,0,0,1|2,0,0]=4 882 B14R1.833 CCC(=O)NCC1=CC(=C(C=C1)C)F Z169813574 [0,1,0,0,0,1|2,0,0]=4 883 B14R1.833 CCC(=O)NCC1=CC(=C(C=C1)Cl)C Z1667609305 [0,1,0,0,0,1|2,0,0]=4 884 B14R1.833 CCC(=O)NCC1=CC(=C(C=C1)F)C Z212644980 [0,1,0,0,0,1|2,0,0]=4 885 B14R1.833 CNC(=O)CCC1=CC(=C(C=C1)Br)C Z1360063138 [0,1,0,0,0,1|2,0,0]=4 886 B14R1.833 CNC(=O)CNC1=CC(=C(C=C1)C)Cl Z104643514 [0,1,0,0,0,1|2,0,0]=4 887 B14R1.833 CNC(=O)COC1=CC(=C(C=C1)N)C Z285226610 [0,1,0,0,0,1|2,0,0]=4 888 B14R1.833 CNC(=O)COC1=CC(=C(C=C1)N)F Z839157436 [0,1,0,0,0,1|2,0,0]=4 889 B14R1.833 CNC(=O)CSC1=CC(=C(C=C1)C)C Z24835396 [0,1,0,0,0,1|2,0,0]=4 890 B14R1.833 CNC(=O)CSC1=CC(=C(C=C1)Cl)Cl Z1273018018 [0,1,0,0,0,1|2,0,0]=4 891 B14R1.833 CNC(=O)OCC1=CC(=C(C=C1)Cl)Cl Z1269139786 [0,1,0,0,0,1|2,0,0]=4 892 B14R1.833 COC(=O)CCC1=CC(=C(C=C1)O)N Z1509418737 [0,1,0,0,0,1|1,0,0]=3 893 B14R1.833 COC(=O)CNC1=CC(=C(C=C1)Br)C Z297588574 [0,1,0,0,0,1|2,0,0]=4 894 B14R1.833 COC(=O)CNC1=CC(=C(C=C1)Cl)Cl Z297574394 [0,1,0,0,0,1|2,0,0]=4 895 B14R1.833 COC(=O)COC1=CC(=C(C=C1)N)C Z239127646 [0,1,0,0,0,1|2,0,0]=4 896 B14R1.833 O=C(CO)NCC1=CC(=C(C=C1)F)Cl Z1551784377 [0,1,0,0,0,1|2,0,0]=4 897 B14R1.833 O=C(CO)NCC1=CC(=C(C=C1)I)Cl Z2004789665 [0,1,0,0,0,1|2,0,0]=4 898 B14R1.3653 COC1=C(C=C(C=C1)/C=C/C(=O)O)O Z2693271860 [0,1,0,0,0,1|1,0,1]=4 899 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)C)O Z1268633028 [0,1,0,0,0,1|0,0,0]=2 900 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)Br Z303635158 [0,1,0,0,0,1|2,0,0]=4 901 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)Cl Z235345357 [0,1,0,0,0,1|2,0,0]=4 902 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)N Z1251354132 [0,1,0,0,0,1|2,0,0]=4 903 B14R1.3653 COC1=C(C=C(C=C1)CCC(=O)O)O Z317038026 [0,1,0,0,0,1|1,0,0]=3 904 B14R1.3653 COC1=C(C=C(C=C1)OCC(=O)O)C Z1430609738 [0,1,0,0,0,1|2,0,0]=4 905 B14R1.3653 COC1=C(N=C(N=C1)CNC(=O)C)O Z2963943906 [0,1,0,0,0,1|2,0,0]=4 906 B14R1.6036 CC1=C(C=C(C(=C1)Cl)O)OCC(=O)O Z1209414410 [0,1,0,0,0,1|2,0,0]=4 907 B14R1.140 CCOC1=C(C=C(C=C1)NC(=O)C)Br Z56827184 [0,2,0,0,0,0|2,0,0]=4 908 B14R1.2284 COC1=C(C=C(C(=C1)C)CC(=O)O)F Z3243603313 [0,2,0,0,0,0|2,0,0]=4 909 B14R1.2284 COC1=C(C=C(C(=C1)Cl)CC(=O)O)F Z3325825930 [0,2,0,0,0,0|2,0,0]=4 910 B14R1.3275 COC1=C(C=C(C=C1)CS(=O)(=O)C)N Z2065464293 [0,2,0,0,0,0|2,0,0]=4 911 B14R1.3276 CCC(=O)NC1=CC(=C(C=C1)OC)Cl Z26743827 [0,2,0,0,0,0|2,0,0]=4 912 B14R1.3276 CNC(=O)CC1=CC(=C(C=C1)OC)F Z100643770 [0,2,0,0,0,0|1,0,0]=3 913 B14R1.3276 COC1=C(C=C(C=C1)CC(C)C=O)F Z1238838025 [0,2,0,0,0,0|1,0,1]=4 914 B14R1.3276 COC1=C(C=C(C=C1)NC(=O)CCl)Cl Z56896204 [0,2,0,0,0,0|2,0,0]=4 915 B14R1.3651 COC1=C(C=C(C=C1)CC(=O)N)OC Z33546771 [0,2,0,0,0,0|1,0,0]=3 916 B14R1.3651 COC1=C(C=C(C=C1)CC(=O)O)OC Z56924495 [0,2,0,0,0,0|1,0,0]=3 917 B14R1.3651 COC1=C(C=C(C=C1)CC(=S)N)OC Z235363001 [0,2,0,0,0,0|1,1,0]=4 918 B14R1.3651 COC1=C(C=C(C=C1)NC(=O)C)OC Z30849291 [0,2,0,0,0,0|1,0,0]=3 919 B14R1.3651 COC1=C(C=C(C=C1)NC(=S)C)OC Z56757210 [0,2,0,0,0,0|1,1,0]=4 920 B14R1.3652 COC1=C(C=C(C=C1)C(C)C(=O)O)F Z792377220 [0,2,0,0,0,0|2,0,0]=4 921 B14R1.3652 COC1=C(C=C(C=C1)C(N)C(=O)O)F Z1198160556 [0,2,0,0,0,0|2,0,0]=4 922 B14R1.3652 COC1=C(C=C(C=C1)C(O)C(=O)O)Br Z788000944 [0,2,0,0,0,0|2,0,0]=4 923 B14R1.5801 CC(=O)NC1=CC(=C(C=C1)C(=O)O)Cl Z816002218 [0,2,0,0,0,0|2,0,0]=4 924 B14R1.5801 CC(=O)NC1=CC(=C(C=C1)C(=O)O)F Z1255375392 [0,2,0,0,0,0|2,0,0]=4 925 B14R1.12535 COC1=C(C=C(C=C1Br)CC(=O)O)Br Z1725937091 [0,2,0,0,0,0|2,0,0]=4 926 B14R1.705 CC(=O)NC1=CC(=C(C=C1)C)C(=O)O Z1143322507 [0,2,0,0,0,0|2,0,0]=4 927 B14R1.705 CC(=O)NC1=CC(=C(C=C1)Cl)C(=O)O Z364361266 [0,2,0,0,0,0|2,0,0]=4 928 B14R1.705 CC(=O)NC1=CC(=C(C=C1)F)C(=O)O Z364321922 [0,2,0,0,0,0|2,0,0]=4 929 B14R1.705 CC(=O)NC1=CC(=C(C=C1)N)C(=O)O Z196931010 [0,2,0,0,0,0|2,0,0]=4 930 B14R1.705 CC(=O)NC1=CC(=C(C=C1)O)C(=O)O Z239128440 [0,2,0,0,0,0|1,0,0]=3 931 B14R1.705 CC(=O)NC1=CC(=C(C=C1)O)[N+](=O)[O-] Z1255419116 [0,2,0,0,0,0|1,0,1]=4 932 B14R1.705 CC(=O)NC1=CC(=C(N=C1)O)C(=O)O Z1262530954 [0,2,0,0,0,0|2,0,0]=4 933 B14R1.705 O=C(O)CC1=CC(=C(C=C1)O)[N+](=O)[O-] Z1203162039 [0,2,0,0,0,0|1,0,1]=4 934 B14R1.881 COC1=C(C=C(C(=C1)CC(=O)O)F)O Z1416167707 [0,2,0,0,0,0|1,0,0]=3 935 B14R1.3405 CNC(=O)CC1=CC(=C(C=C1)C)OC Z196429244 [0,2,0,0,0,0|1,0,0]=3 936 B14R1.3405 CNC(=O)NC1=CC(=C(C=C1)Br)OC Z1321376335 [0,2,0,0,0,0|2,0,0]=4 937 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)Br)OC Z1269111416 [0,2,0,0,0,0|1,0,0]=3 938 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)N)OC Z4188012656 [0,2,0,0,0,0|1,0,0]=3 939 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)O)C=O Z1198165266 [0,2,0,0,0,0|0,0,1]=3 940 B14R1.3405 COC(=O)CC1=CC(=C(C=C1)O)OC Z1198150768 [0,2,0,0,0,0|0,0,0]=2 941 B14R1.3405 COC1=C(C=CC(=C1)CC(=O)CO)O Z1513806392 [0,2,0,0,0,0|0,0,0]=2 942 B14R1.3405 COC1=C(C=CC(=C1)NC(=O)CO)F Z1768428644 [0,2,0,0,0,0|2,0,0]=4 943 B14R1.1003 COC(=O)C(N)C1=CC(=C(C=C1)C)C Z1704732775 [0,2,0,0,0,0|2,0,0]=4 944 B14R1.1003 COC(=O)C(N)C1=CC(=C(C=C1)O)Br Z2967330104 [0,2,0,0,0,0|1,0,0]=3 945 B14R1.1003 COC(=O)C(N)C1=CC(=C(C=C1)O)O Z3679593836 [0,2,0,0,0,0|0,0,0]=2 946 B14R1.1003 COC(=O)C(O)C1=CC(=C(C=C1)Cl)Br Z1599266110 [0,2,0,0,0,0|2,0,0]=4 947 B14R1.1003 COC(=O)C(O)C1=CC(=C(C=C1)Cl)Cl Z965047522 [0,2,0,0,0,0|2,0,0]=4 948 B14R1.1003 COC(=O)C(O)C1=CC(=C(C=C1)F)Cl Z1436294923 [0,2,0,0,0,0|2,0,0]=4 949 B14R1.15551 CC1=CC(=CC(=C1O)C)C(N)C(=O)O Z361432018 [0,2,0,0,0,0|2,0,0]=4 950 B14R1.20236 O=C(CO)NC1=C(C=C(C(=C1)Cl)O)F Z2099225324 [0,2,0,0,0,0|2,0,0]=4 951 B14R1.967 CCOC(=O)CC1=CC(=C(C=C1)Br)F Z1269194860 [0,2,0,0,0,0|2,0,0]=4 952 B14R1.967 CCOC(=O)CC1=CC(=C(C=C1)N)Cl Z1269164666 [0,2,0,0,0,0|2,0,0]=4 953 B14R1.967 COCC(=O)NC1=CC(=C(C=C1)F)O Z5022866327 [0,2,0,0,0,0|2,0,0]=4 954 B14R1.967 CONC(=O)CC1=CC(=C(C=C1)Cl)Cl Z193289708 [0,2,0,0,0,0|2,0,0]=4 955 B14R1.8824 COC(=O)CC1=C(C(=C(C=C1)Br)F)F Z2044753148 [0,2,0,0,0,0|2,0,0]=4 956 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O Z1198147837 [1,0,0,1,0,0|2,0,0]=4 957 B12R2.606 CC1=NC2=C(N1)C=CC(=C2)O Z1255462447 [1,0,0,1,0,0|2,0,0]=4 958 B12R2.606 CC1=NC2=C(O1)C=C(C=C2)O Z1201620245 [1,0,0,1,0,0|1,0,1]=4 959 B12R2.606 CC1=NC2=C(S1)C=CC(=C2)O Z1203159861 [1,0,0,1,0,0|2,0,0]=4 960 B12R2.606 NC1=CC2=C(C=C1)CC(=O)N2 Z2805701617 [1,0,0,1,0,0|2,0,0]=4 961 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 Z2768165443 [1,0,0,1,0,0|2,0,0]=4 962 B12R2.606 O=C1CC2=C(N1)C=C(C=C2)Cl Z56922083 [1,0,0,1,0,0|2,0,0]=4 963 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Br Z299596076 [1,0,0,1,0,0|2,0,0]=4 964 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)Cl Z104477028 [1,0,0,1,0,0|2,0,0]=4 965 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)F Z1255450667 [1,0,0,1,0,0|2,0,0]=4 966 B12R2.606 O=C1CC2=C(N1)C=CC(=C2)O Z1198147431 [1,0,0,1,0,0|1,0,0]=3 967 B12R2.606 O=C1NC2=C(O1)C=CC(=C2)O Z1198314975 [1,0,0,1,0,0|2,0,0]=4 968 B12R2.606 O=C1OC2=C(O1)C=C(C=C2)O Z1198726972 [1,0,0,1,0,0|2,0,0]=4 969 B12R2.606 O=C1OC2=C(S1)C=C(C=C2)O Z56801267 [1,0,0,1,0,0|2,0,0]=4 970 B12R2.606 O=C1OC2=C(S1)C=CC(=C2)O Z104483034 [1,0,0,1,0,0|2,0,0]=4 971 B12R2.606 OC1=CC2=C(C=C1)CC(C2)O Z1198729229 [1,0,0,1,0,0|0,0,2]=4 972 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 Z1198159857 [1,0,0,1,0,0|2,0,0]=4 973 B12R2.202 NC1=C2NC(=O)CC2=CC=C1 Z1203579747 [1,0,0,1,0,0|2,0,0]=4 974 B12R2.202 O=C1CC2=C(C=CC=C2N1)Br Z1269158294 [1,0,0,1,0,0|2,0,0]=4 975 B12R2.202 O=C1CC2=C(C=CC=C2N1)O Z1198161564 [1,0,0,1,0,0|1,0,0]=3 976 B12R2.202 O=C1CC2=CC=CC(=C2N1)Br Z1269179204 [1,0,0,1,0,0|2,0,0]=4 977 B12R2.202 O=C1CC2=CC=CC(=C2O1)Br Z2489234207 [1,0,0,1,0,0|2,0,0]=4 978 B12R2.202 O=C1NC2=CC=CC(=C2N1)O Z1504677969 [1,0,0,1,0,0|2,0,0]=4 979 B12R2.82 CC1=C(C2=C(C=C1)CCC2)O Z1255490620 [1,0,0,1,0,0|1,0,1]=4 980 B12R2.100 OC1=C(C=C2COCC2=C1)O Z3243446774 [1,0,0,1,0,0|1,0,0]=3 981 B12R2.291 OC1=C(C=C(C=C1)C2CC2)Cl Z1575344265 [1,0,0,1,0,0|1,0,1]=4 982 B14R2.7933 O=C(O)C1CC2=C1C=C(C(=C2)F)O Z4959121917 [0,0,0,1,0,1|2,0,0]=4 983 B14R2.8239 NC1=C(C=C2NC(=O)CCC2=C1)O Z425351774 [0,0,0,1,0,1|2,0,0]=4 984 B14R2.1008 CC(=O)NC1=CC2=C(C=C1)OCO2 Z27647423 [0,1,0,1,0,0|1,0,0]=3 985 B14R2.1008 CC(=S)NC1=CC2=C(C=C1)OCO2 Z56764111 [0,1,0,1,0,0|1,1,0]=4 986 B14R2.1008 C[C@@H](O)CC1=CC2=C(C=C1)OCO2 Z1198314644 [0,1,0,1,0,0|0,0,2]=4 987 B14R2.1008 C[C@H](O)CC1=CC2=C(C=C1)OCO2 Z1650168507 [0,1,0,1,0,0|0,0,2]=4 988 B14R2.1008 NC(=O)NC1=CC2=C(C=C1)OCO2 Z107732962 [0,1,0,1,0,0|2,0,0]=4 989 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)COC2 Z1262549592 [0,1,0,1,0,0|2,0,0]=4 990 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCC2 Z220565334 [0,1,0,1,0,0|2,0,0]=4 991 B14R2.1008 O=C(O)CC1=CC2=C(C=C1)OCO2 Z274782846 [0,1,0,1,0,0|1,0,0]=3 992 B14R2.1008 O=C(O)CC1=CC2=C(C=CO2)C=C1 Z1262520127 [0,1,0,1,0,0|2,0,0]=4 993 B14R2.1008 O=C(O)CC1=CC2=NON=C2C=C1 Z1416182953 [0,1,0,1,0,0|2,0,0]=4 994 B10R1.13 CC(=O)C1=CC=C(C=C1)Br Z57127459 [1,0,0,0,1,0|1,0,0]=3 995 B10R1.13 CC(=O)C1=CC=C(C=C1)C Z57127458 [1,0,0,0,1,0|1,0,0]=3 996 B10R1.13 CC(=O)C1=CC=C(C=C1)Cl Z57127462 [1,0,0,0,1,0|1,0,0]=3 997 B10R1.13 CC(=O)C1=CC=C(C=C1)F Z57127466 [1,0,0,0,1,0|1,0,0]=3 998 B10R1.13 CC(=O)C1=CC=C(C=C1)I Z57073725 [1,0,0,0,1,0|1,0,0]=3 999 B10R1.13 CC(=O)C1=CC=C(C=C1)N Z57127377 [1,0,0,0,1,0|1,0,0]=3 1000 B10R1.13 CC(=O)C1=CC=C(C=C1)O Z57040434 [1,0,0,0,1,0|0,0,0]=2 1001 B10R1.13 CC(=O)C1=CN=C(C=C1)Br Z1269224642 [1,0,0,0,1,0|2,0,0]=4 1002 B10R1.13 CC(=O)C1=CN=C(C=C1)Cl Z1201622182 [1,0,0,0,1,0|2,0,0]=4 1003 B10R1.13 CC(=O)C1=CN=C(C=C1)F Z1198173101 [1,0,0,0,1,0|2,0,0]=4 1004 B10R1.13 CC(=O)C1=NC=C(C=C1)Br Z1945984212 [1,0,0,0,1,0|2,0,0]=4 1005 B10R1.13 CC(=O)C1=NC=C(C=C1)Cl Z1198173098 [1,0,0,0,1,0|2,0,0]=4 1006 B10R1.13 CC(=O)C1=NC=C(C=C1)F Z1575143877 [1,0,0,0,1,0|2,0,0]=4 1007 B10R1.13 CC(C)C1=CC=C(C=C1)O Z56347200 [1,0,0,0,1,0|1,0,1]=4 1008 B10R1.13 CC(N)C1=CC=C(C=C1)O Z1741968989 [1,0,0,0,1,0|1,0,1]=4 1009 B10R1.13 CC1=CC=C(C=C1)C(=O)O Z57902424 [1,0,0,0,1,0|2,0,0]=4 1010 B10R1.13 CN(C)C1=CC=C(C=C1)O Z137981254 [1,0,0,0,1,0|2,0,0]=4 1011 B10R1.13 CS(=O)C1=CC=C(C=C1)N Z609944508 [1,0,0,0,1,0|2,0,0]=4 1012 B10R1.13 C[C@H](N)C1=CC=C(C=C1)O Z3183546879 [1,0,0,0,1,0|1,0,1]=4 1013 B10R1.13 N=C(N)C1=CC=C(C=C1)O Z1262398570 [1,0,0,0,1,0|2,0,0]=4 1014 B10R1.13 NC(=O)C1=CC=C(C=C1)Br Z33546526 [1,0,0,0,1,0|2,0,0]=4 1015 B10R1.13 NC(=O)C1=CC=C(C=C1)F Z33546459 [1,0,0,0,1,0|2,0,0]=4 1016 B10R1.13 NC(=O)C1=CC=C(C=C1)I Z33546486 [1,0,0,0,1,0|2,0,0]=4 1017 B10R1.13 NC(=O)C1=CC=C(C=C1)N Z104474782 [1,0,0,0,1,0|2,0,0]=4 1018 B10R1.13 NC(=O)C1=CC=C(C=C1)O Z104502228 [1,0,0,0,1,0|1,0,0]=3 1019 B10R1.13 NC(=S)C1=CC=C(C=C1)O Z90124534 [1,0,0,0,1,0|1,1,0]=4 1020 B10R1.13 NC1=CC=C(C=C1)C(=O)O Z57127446 [1,0,0,0,1,0|2,0,0]=4 1021 B10R1.13 O=C(O)C1=CC=C(C=C1)Br Z57127530 [1,0,0,0,1,0|2,0,0]=4 1022 B10R1.13 O=C(O)C1=CC=C(C=C1)Cl Z104473324 [1,0,0,0,1,0|2,0,0]=4 1023 B10R1.13 O=C(O)C1=CC=C(C=C1)F Z57367354 [1,0,0,0,1,0|2,0,0]=4 1024 B10R1.13 O=C(O)C1=CC=C(C=C1)I Z57636572 [1,0,0,0,1,0|2,0,0]=4 1025 B10R1.13 O=C(O)C1=CC=C(C=C1)O Z104498098 [1,0,0,0,1,0|1,0,0]=3 1026 B10R1.13 O=C(O)C1=CC=C(C=C1)S Z223639246 [1,0,0,0,1,0|1,1,0]=4 1027 B10R1.13 O=C(O)C1=CN=C(C=C1)O Z104500708 [1,0,0,0,1,0|2,0,0]=4 1028 B10R1.13 O=[N+]([O-])C1=CC=C(C=C1)O Z57127483 [1,0,0,0,1,0|2,0,0]=4 1029 B10R1.113 C=C(C)C1=CC(=CC=C1)N Z1203585283 [1,0,0,0,1,0|2,0,0]=4 1030 B10R1.113 CC(=O)C1=CC(=CC=C1)Br Z104472956 [1,0,0,0,1,0|1,0,0]=3 1031 B10R1.113 CC(=O)C1=CC(=CC=C1)C Z104482920 [1,0,0,0,1,0|1,0,0]=3 1032 B10R1.113 CC(=O)C1=CC(=CC=C1)Cl Z104477350 [1,0,0,0,1,0|1,0,0]=3 1033 B10R1.113 CC(=O)C1=CC(=CC=C1)N Z57127443 [1,0,0,0,1,0|1,0,0]=3 1034 B10R1.113 CC(=O)C1=CC(=CN=C1)C Z1198331406 [1,0,0,0,1,0|2,0,0]=4 1035 B10R1.113 CC(=O)C1=CC(=CN=C1)Cl Z1255491584 [1,0,0,0,1,0|2,0,0]=4 1036 B10R1.113 CC(=O)C1=CC(=NC=C1)Br Z3234972143 [1,0,0,0,1,0|2,0,0]=4 1037 B10R1.113 CC(=O)C1=CC(=NC=C1)Cl Z1201624144 [1,0,0,0,1,0|2,0,0]=4 1038 B10R1.113 CC(=O)C1=CC(=NC=C1)F Z1198219263 [1,0,0,0,1,0|2,0,0]=4 1039 B10R1.113 CC(=O)C1=CC(=O)NC=C1 Z1216849381 [1,0,0,0,1,0|1,0,1]=4 1040 B10R1.113 CC(=O)C1=NC(=CC=C1)Br Z1269164937 [1,0,0,0,1,0|2,0,0]=4 1041 B10R1.113 CC(=O)C1=NC(=CC=C1)Cl Z1198173097 [1,0,0,0,1,0|2,0,0]=4 1042 B10R1.113 CC(=O)C1=NC(=CC=C1)F Z1198219245 [1,0,0,0,1,0|2,0,0]=4 1043 B10R1.113 CC(=O)C1=NC=CC(=C1)Br Z1269133346 [1,0,0,0,1,0|2,0,0]=4 1044 B10R1.113 CC(C)C1=CC(=CC=C1)O Z104492878 [1,0,0,0,1,0|1,0,1]=4 1045 B10R1.113 CC(N)C1=CC(=CC=C1)O Z426041632 [1,0,0,0,1,0|1,0,1]=4 1046 B10R1.113 CC(O)C1=CC(=CC=C1)O Z335245176 [1,0,0,0,1,0|0,0,2]=4 1047 B10R1.113 CC1=CC(=CC=C1)C(=O)N Z33546925 [1,0,0,0,1,0|2,0,0]=4 1048 B10R1.113 CC1=CC(=CC=C1)C(=O)O Z57913535 [1,0,0,0,1,0|2,0,0]=4 1049 B10R1.113 CS(=O)C1=CC(=CC=C1)N Z609980392 [1,0,0,0,1,0|2,0,0]=4 1050 B10R1.113 C[C@@H](O)C1=CC(=CC=C1)O Z959151708 [1,0,0,0,1,0|0,0,2]=4 1051 B10R1.113 C[C@H](O)C1=CC(=CC=C1)O Z959151706 [1,0,0,0,1,0|0,0,2]=4 1052 B10R1.113 N=C(N)C1=CC(=CC=C1)O Z1592024758 [1,0,0,0,1,0|2,0,0]=4 1053 B10R1.113 NC(=O)C1=CC(=CC=C1)Br Z33546517 [1,0,0,0,1,0|2,0,0]=4 1054 B10R1.113 NC(=O)C1=CC(=CC=C1)Cl Z33546479 [1,0,0,0,1,0|2,0,0]=4 1055 B10R1.113 NC(=O)C1=CC(=CC=C1)I Z33546647 [1,0,0,0,1,0|2,0,0]=4 1056 B10R1.113 NC(=O)C1=CC(=CC=C1)N Z118530082 [1,0,0,0,1,0|2,0,0]=4 1057 B10R1.113 NC(=O)C1=CC(=CC=C1)O Z33546460 [1,0,0,0,1,0|1,0,0]=3 1058 B10R1.113 NC(=O)C1=CC(=CC=C1)S Z1255359534 [1,0,0,0,1,0|1,1,0]=4 1059 B10R1.113 NC(=O)C1=CC(=CN=C1)O Z1160905298 [1,0,0,0,1,0|2,0,0]=4 1060 B10R1.113 NC1=CC(=CC=C1)C(=O)O Z57127542 [1,0,0,0,1,0|2,0,0]=4 1061 B10R1.113 O=C(O)C1=CC(=CC=C1)Br Z104475790 [1,0,0,0,1,0|2,0,0]=4 1062 B10R1.113 O=C(O)C1=CC(=CC=C1)Cl Z104474062 [1,0,0,0,1,0|2,0,0]=4 1063 B10R1.113 O=C(O)C1=CC(=CC=C1)F Z104477304 [1,0,0,0,1,0|2,0,0]=4 1064 B10R1.113 O=C(O)C1=CC(=CC=C1)I Z56924537 [1,0,0,0,1,0|2,0,0]=4 1065 B10R1.113 O=C(O)C1=CC(=CC=C1)O Z56919254 [1,0,0,0,1,0|1,0,0]=3 1066 B10R1.113 O=C(O)C1=CC(=CC=C1)S Z1201630948 [1,0,0,0,1,0|1,1,0]=4 1067 B10R1.113 O=C(O)C1=CC(=CN=C1)O Z57124104 [1,0,0,0,1,0|2,0,0]=4 1068 B10R1.113 O=C(O)C1=NC=CC(=C1)O Z385458378 [1,0,0,0,1,0|2,0,0]=4 1069 B10R1.113 O=[N+]([O-])C1=CC=CC(=C1)O Z57160187 [1,0,0,0,1,0|2,0,0]=4 1070 B12R1.21 CC(=O)/C=C/C1=CC=C(C=C1)F Z1201619760 [1,0,0,0,0,1|1,0,1]=4 1071 B12R1.21 CC(=O)CCC1=CC=C(C=C1)C Z406376788 [1,0,0,0,0,1|1,0,0]=3 1072 B12R1.21 CC(=O)CCC1=CC=C(C=C1)F Z406376784 [1,0,0,0,0,1|1,0,0]=3 1073 B12R1.21 CC(=O)CCC1=CC=C(C=C1)I Z1263632422 [1,0,0,0,0,1|1,0,0]=3 1074 B12R1.21 CC(=O)NCC1=CC=C(C=C1)Br Z816034502 [1,0,0,0,0,1|1,0,0]=3 1075 B12R1.21 CC(=O)NCC1=CC=C(C=C1)N Z600391558 [1,0,0,0,0,1|1,0,0]=3 1076 B12R1.21 CC(=O)NNC1=CC=C(C=C1)F Z30877183 [1,0,0,0,0,1|2,0,0]=4 1077 B12R1.21 CC(C)COC1=CC=C(C=C1)O Z381414742 [1,0,0,0,0,1|1,0,1]=4 1078 B12R1.21 CC(N)CCC1=CC=C(C=C1)O Z220327456 [1,0,0,0,0,1|1,0,1]=4 1079 B12R1.21 CC(O)CCC1=CC=C(C=C1)O Z57921369 [1,0,0,0,0,1|0,0,2]=4 1080 B12R1.21 CC1=CC=C(C=C1)CCC(=O)N Z194976512 [1,0,0,0,0,1|2,0,0]=4 1081 B12R1.21 CC1=CC=C(C=C1)CCC(=O)O Z169855336 [1,0,0,0,0,1|2,0,0]=4 1082 B12R1.21 CC1=CC=C(C=C1)CNC(=O)N Z198194838 [1,0,0,0,0,1|2,0,0]=4 1083 B12R1.21 CC1=CC=C(C=C1)OCC(=O)N Z19732046 [1,0,0,0,0,1|2,0,0]=4 1084 B12R1.21 CC1=CC=C(C=C1)OCC(=O)O Z56812739 [1,0,0,0,0,1|2,0,0]=4 1085 B12R1.21 CC1=CC=C(C=C1)SCC(=O)N Z18770000 [1,0,0,0,0,1|2,0,0]=4 1086 B12R1.21 CC1=CC=C(C=C1)SCC(=O)O Z55903478 [1,0,0,0,0,1|2,0,0]=4 1087 B12R1.21 NC(=O)CCC1=CC=C(C=C1)F Z87614992 [1,0,0,0,0,1|2,0,0]=4 1088 B12R1.21 NC(=O)CCC1=CC=C(C=C1)N Z414316852 [1,0,0,0,0,1|2,0,0]=4 1089 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Br Z104586672 [1,0,0,0,0,1|2,0,0]=4 1090 B12R1.21 NC(=O)CNC1=CC=C(C=C1)Cl Z104647358 [1,0,0,0,0,1|2,0,0]=4 1091 B12R1.21 NC(=O)CNC1=CC=C(C=C1)I Z104728120 [1,0,0,0,0,1|2,0,0]=4 1092 B12R1.21 NC(=O)COC1=CC=C(C=C1)Br Z19725712 [1,0,0,0,0,1|2,0,0]=4 1093 B12R1.21 NC(=O)COC1=CC=C(C=C1)F Z19734788 [1,0,0,0,0,1|2,0,0]=4 1094 B12R1.21 NC(=O)COC1=CC=C(C=C1)I Z25086979 [1,0,0,0,0,1|2,0,0]=4 1095 B12R1.21 NC(=O)COC1=CC=C(C=C1)N Z239127428 [1,0,0,0,0,1|2,0,0]=4 1096 B12R1.21 NC(=O)COC1=CC=C(C=C1)O Z381414726 [1,0,0,0,0,1|1,0,0]=3 1097 B12R1.21 NC(=O)CSC1=CC=C(C=C1)Br Z18744574 [1,0,0,0,0,1|2,0,0]=4 1098 B12R1.21 NC(=O)CSC1=CC=C(C=C1)F Z16034821 [1,0,0,0,0,1|2,0,0]=4 1099 B12R1.21 NC(=O)NCC1=CC=C(C=C1)F Z198194834 [1,0,0,0,0,1|2,0,0]=4 1100 B12R1.21 NC(=O)NCC1=CC=C(C=C1)N Z600391988 [1,0,0,0,0,1|2,0,0]=4 1101 B12R1.21 NC1=CC=C(C=C1)CCC(=O)O Z336079452 [1,0,0,0,0,1|2,0,0]=4 1102 B12R1.21 NC1=CC=C(C=C1)OCC(=O)O Z3241275736 [1,0,0,0,0,1|2,0,0]=4 1103 B12R1.21 O=C(O)/C=C/C1=CC=C(C=C1)O Z56911963 [1,0,0,0,0,1|1,0,1]=4 1104 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Br Z118438622 [1,0,0,0,0,1|2,0,0]=4 1105 B12R1.21 O=C(O)CCC1=CC=C(C=C1)Cl Z178961272 [1,0,0,0,0,1|2,0,0]=4 1106 B12R1.21 O=C(O)CCC1=CC=C(C=C1)F Z89264973 [1,0,0,0,0,1|2,0,0]=4 1107 B12R1.21 O=C(O)CCC1=CC=C(C=C1)O Z317038012 [1,0,0,0,0,1|1,0,0]=3 1108 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Br Z274534708 [1,0,0,0,0,1|2,0,0]=4 1109 B12R1.21 O=C(O)CNC1=CC=C(C=C1)Cl Z274534702 [1,0,0,0,0,1|2,0,0]=4 1110 B12R1.21 O=C(O)CNC1=CC=C(C=C1)O Z57127481 [1,0,0,0,0,1|1,0,0]=3 1111 B12R1.21 O=C(O)COC1=CC=C(C=C1)Br Z56812736 [1,0,0,0,0,1|2,0,0]=4 1112 B12R1.21 O=C(O)COC1=CC=C(C=C1)Cl Z57181989 [1,0,0,0,0,1|2,0,0]=4 1113 B12R1.21 O=C(O)COC1=CC=C(C=C1)F Z56978034 [1,0,0,0,0,1|2,0,0]=4 1114 B12R1.21 O=C(O)COC1=CC=C(C=C1)I Z56943814 [1,0,0,0,0,1|2,0,0]=4 1115 B12R1.21 O=C(O)COC1=CC=C(C=C1)O Z1192367471 [1,0,0,0,0,1|1,0,0]=3 1116 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Br Z55903477 [1,0,0,0,0,1|2,0,0]=4 1117 B12R1.21 O=C(O)CSC1=CC=C(C=C1)Cl Z55179956 [1,0,0,0,0,1|2,0,0]=4 1118 B12R1.21 O=C(O)CSC1=CC=C(C=C1)F Z55903650 [1,0,0,0,0,1|2,0,0]=4 1119 B12R1.21 O=C(O)CSC1=CC=C(C=C1)O Z733878444 [1,0,0,0,0,1|1,0,0]=3 1120 B12R1.226 CC(=O)CCC1=CC(=CC=C1)C Z406376778 [1,0,0,0,0,1|1,0,0]=3 1121 B12R1.226 CC(=O)CCC1=CC(=CC=C1)F Z406376716 [1,0,0,0,0,1|1,0,0]=3 1122 B12R1.226 CC(=O)NCC1=CC(=CC=C1)Br Z340632658 [1,0,0,0,0,1|1,0,0]=3 1123 B12R1.226 CC(=O)NCC1=CC(=CC=C1)F Z340527618 [1,0,0,0,0,1|1,0,0]=3 1124 B12R1.226 CC(=O)NNC1=CC(=CC=C1)C Z30552180 [1,0,0,0,0,1|2,0,0]=4 1125 B12R1.226 CC(C)CNC1=CC(=CC=C1)O Z335562026 [1,0,0,0,0,1|1,0,1]=4 1126 B12R1.226 CC1=CC(=CC=C1)CCC(=O)N Z194976514 [1,0,0,0,0,1|2,0,0]=4 1127 B12R1.226 CC1=CC(=CC=C1)CCC(=O)O Z169993866 [1,0,0,0,0,1|2,0,0]=4 1128 B12R1.226 CC1=CC(=CC=C1)NCC(=O)N Z104589324 [1,0,0,0,0,1|2,0,0]=4 1129 B12R1.226 CC1=CC(=CC=C1)OCC(=O)N Z19732960 [1,0,0,0,0,1|2,0,0]=4 1130 B12R1.226 CC1=CC(=CC=C1)OCC(=O)O Z56899056 [1,0,0,0,0,1|2,0,0]=4 1131 B12R1.226 CC1=CC(=CC=C1)SCC(=O)O Z778642574 [1,0,0,0,0,1|2,0,0]=4 1132 B12R1.226 NC(=O)CCC1=CC(=CC=C1)N Z414316850 [1,0,0,0,0,1|2,0,0]=4 1133 B12R1.226 NC(=O)CNC1=CC(=CC=C1)Br Z104587998 [1,0,0,0,0,1|2,0,0]=4 1134 B12R1.226 NC(=O)CNC1=CC(=CC=C1)F Z104640682 [1,0,0,0,0,1|2,0,0]=4 1135 B12R1.226 NC(=O)COC1=CC(=CC=C1)F Z19755608 [1,0,0,0,0,1|2,0,0]=4 1136 B12R1.226 NC(=O)COC1=CC(=CC=C1)I Z25076202 [1,0,0,0,0,1|2,0,0]=4 1137 B12R1.226 NC(=O)COC1=CC(=CC=C1)N Z235344273 [1,0,0,0,0,1|2,0,0]=4 1138 B12R1.226 NC(=O)COC1=CC(=CC=C1)O Z381415558 [1,0,0,0,0,1|1,0,0]=3 1139 B12R1.226 NC(=O)NCC1=CC(=CC=C1)F Z362629554 [1,0,0,0,0,1|2,0,0]=4 1140 B12R1.226 O=C(O)/C=C/C1=CC(=CC=C1)O Z247613734 [1,0,0,0,0,1|1,0,1]=4 1141 B12R1.226 O=C(O)CCC1=CC(=CC=C1)Br Z56943439 [1,0,0,0,0,1|2,0,0]=4 1142 B12R1.226 O=C(O)CCC1=CC(=CC=C1)F Z185153196 [1,0,0,0,0,1|2,0,0]=4 1143 B12R1.226 O=C(O)CCC1=CC(=CC=C1)O Z317038038 [1,0,0,0,0,1|1,0,0]=3 1144 B12R1.226 O=C(O)CCC1=CC(=CN=C1)O Z1504676734 [1,0,0,0,0,1|2,0,0]=4 1145 B12R1.226 O=C(O)CNC1=CC(=CC=C1)Cl Z274534700 [1,0,0,0,0,1|2,0,0]=4 1146 B12R1.226 O=C(O)COC1=CC(=CC=C1)Br Z56812737 [1,0,0,0,0,1|2,0,0]=4 1147 B12R1.226 O=C(O)COC1=CC(=CC=C1)Cl Z57008935 [1,0,0,0,0,1|2,0,0]=4 1148 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Br Z255149890 [1,0,0,0,0,1|2,0,0]=4 1149 B12R1.226 O=C(O)CSC1=CC(=CC=C1)Cl Z994465872 [1,0,0,0,0,1|2,0,0]=4 1150 B12R1.226 O=C(O)CSC1=CC(=CC=C1)F Z1198220671 [1,0,0,0,0,1|2,0,0]=4 1151 B12R1.226 O=C(O)CSC1=CC(=CC=C1)O Z1262555002 [1,0,0,0,0,1|1,0,0]=3 1152 B14R1.687 CC(=O)NCCC1=CC(=C(C=C1)O)O Z68159731 [0,0,0,0,0,2|0,0,0]=2