0 B9R1.69 C1=C(C(=NC=C1Br)Cl)Cl 8489 [0,0,0,0,0,0|3,0,1]=4 1 B9R1.69 C1=C(C(=NC=C1Br)Cl)F 6501 [0,0,0,0,0,0|3,0,1]=4 2 B9R1.69 C1=C(C(=NC=C1Br)Cl)N 9545 [0,0,0,0,0,0|3,0,1]=4 3 B9R1.69 C1=C(C(=NC=C1Br)F)F 8605 [0,0,0,0,0,0|3,0,1]=4 4 B9R1.69 C1=C(C(=NC=C1Cl)Cl)N 9721 [0,0,0,0,0,0|3,0,1]=4 5 B9R1.69 C1=C(C(=NC=C1Cl)F)F 5021 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.69 C1=C(C=NC(=C1Br)Cl)Br 10691 [0,0,0,0,0,0|3,0,1]=4 7 B9R1.69 C1=C(C=NC(=C1Br)Cl)Cl 6691 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.69 C1=C(C=NC(=C1Br)N)Cl 6631 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.69 C1=C(C=NC(=C1Cl)Br)Cl 10512 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.69 C1=C(C=NC(=C1Cl)F)Cl 10235 [0,0,0,0,0,0|3,0,1]=4 11 B9R1.69 C1=C(C=NC(=C1Cl)N)Cl 8490 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.69 C1=C(C=NC(=C1F)N)F 6681 [0,0,0,0,0,0|3,0,1]=4 13 B9R1.69 C1=C(C=NC(=C1I)N)Br 9030 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.69 C1=CC(=C(C=C1Br)Br)F 6201 [0,0,0,0,0,0|4,0,0]=4 15 B9R1.69 C1=CC(=C(C=C1Br)Br)N 6160 [0,0,0,0,0,0|4,0,0]=4 16 B9R1.69 C1=CC(=C(C=C1Br)Cl)Cl 5098 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.69 C1=CC(=C(C=C1Br)Cl)F 5541 [0,0,0,0,0,0|4,0,0]=4 18 B9R1.69 C1=CC(=C(C=C1Br)Cl)I 8228 [0,0,0,0,0,0|4,0,0]=4 19 B9R1.69 C1=CC(=C(C=C1Br)F)Br 5609 [0,0,0,0,0,0|4,0,0]=4 20 B9R1.69 C1=CC(=C(C=C1Br)F)Cl 5073 [0,0,0,0,0,0|4,0,0]=4 21 B9R1.69 C1=CC(=C(C=C1Br)F)Cl 6178 [0,0,0,0,0,0|4,0,0]=4 22 B9R1.69 C1=CC(=C(C=C1Br)F)F 6000 [0,0,0,0,0,0|4,0,0]=4 23 B9R1.69 C1=CC(=C(C=C1Br)F)I 5546 [0,0,0,0,0,0|4,0,0]=4 24 B9R1.69 C1=CC(=C(C=C1Br)F)N 5271 [0,0,0,0,0,0|4,0,0]=4 25 B9R1.69 C1=CC(=C(C=C1Br)F)N 5547 [0,0,0,0,0,0|4,0,0]=4 26 B9R1.69 C1=CC(=C(C=C1Br)F)O 5337 [0,0,0,0,0,0|3,0,1]=4 27 B9R1.69 C1=CC(=C(C=C1Br)N)N 5041 [0,0,0,0,0,0|4,0,0]=4 28 B9R1.69 C1=CC(=C(C=C1Br)N)O 8620 [0,0,0,0,0,0|3,0,1]=4 29 B9R1.69 C1=CC(=C(C=C1Cl)Br)F 6484 [0,0,0,0,0,0|4,0,0]=4 30 B9R1.69 C1=CC(=C(C=C1Cl)Br)N 8533 [0,0,0,0,0,0|4,0,0]=4 31 B9R1.69 C1=CC(=C(C=C1Cl)Cl)Br 6522 [0,0,0,0,0,0|4,0,0]=4 32 B9R1.69 C1=CC(=C(C=C1Cl)Cl)F 5400 [0,0,0,0,0,0|4,0,0]=4 33 B9R1.69 C1=CC(=C(C=C1Cl)Cl)S 6151 [0,0,0,0,0,0|3,1,0]=4 34 B9R1.69 C1=CC(=C(C=C1Cl)F)Br 6177 [0,0,0,0,0,0|4,0,0]=4 35 B9R1.69 C1=CC(=C(C=C1Cl)F)I 9921 [0,0,0,0,0,0|4,0,0]=4 36 B9R1.69 C1=CC(=C(C=C1Cl)F)N 5025 [0,0,0,0,0,0|4,0,0]=4 37 B9R1.69 C1=CC(=C(C=C1Cl)F)O 8240 [0,0,0,0,0,0|3,0,1]=4 38 B9R1.69 C1=CC(=C(C=C1Cl)I)N 5011 [0,0,0,0,0,0|4,0,0]=4 39 B9R1.69 C1=CC(=C(C=C1Cl)N)Br 10527 [0,0,0,0,0,0|4,0,0]=4 40 B9R1.69 C1=CC(=C(C=C1Cl)N)F 5788 [0,0,0,0,0,0|4,0,0]=4 41 B9R1.69 C1=CC(=C(C=C1Cl)N)N 10655 [0,0,0,0,0,0|4,0,0]=4 42 B9R1.69 C1=CC(=C(C=C1F)Cl)Br 9301 [0,0,0,0,0,0|4,0,0]=4 43 B9R1.69 C1=CC(=C(C=C1F)Cl)N 6049 [0,0,0,0,0,0|4,0,0]=4 44 B9R1.69 C1=CC(=C(C=C1F)Cl)S 6413 [0,0,0,0,0,0|3,1,0]=4 45 B9R1.69 C1=CC(=C(C=C1F)F)Cl 6187 [0,0,0,0,0,0|4,0,0]=4 46 B9R1.69 C1=CC(=C(C=C1F)F)I 8762 [0,0,0,0,0,0|4,0,0]=4 47 B9R1.69 C1=CC(=C(C=C1F)F)N 5063 [0,0,0,0,0,0|4,0,0]=4 48 B9R1.69 C1=CC(=C(C=C1F)F)O 10593 [0,0,0,0,0,0|3,0,1]=4 49 B9R1.69 C1=CC(=C(C=C1F)I)N 6566 [0,0,0,0,0,0|4,0,0]=4 50 B9R1.69 C1=CC(=C(C=C1F)N)Br 5466 [0,0,0,0,0,0|4,0,0]=4 51 B9R1.69 C1=CC(=C(C=C1F)N)Cl 8573 [0,0,0,0,0,0|4,0,0]=4 52 B9R1.69 C1=CC(=C(C=C1F)N)F 5391 [0,0,0,0,0,0|4,0,0]=4 53 B9R1.69 C1=CC(=C(C=C1F)N)N 8159 [0,0,0,0,0,0|4,0,0]=4 54 B9R1.69 C1=CC(=C(C=C1F)N)O 9491 [0,0,0,0,0,0|3,0,1]=4 55 B9R1.69 C1=CC(=C(C=C1F)O)Br 6182 [0,0,0,0,0,0|3,0,0]=3 56 B9R1.69 C1=CC(=C(C=C1F)O)N 5456 [0,0,0,0,0,0|3,0,0]=3 57 B9R1.69 C1=CC(=C(C=C1I)Cl)Br 9399 [0,0,0,0,0,0|4,0,0]=4 58 B9R1.69 C1=CC(=C(C=C1I)Cl)F 8917 [0,0,0,0,0,0|4,0,0]=4 59 B9R1.69 C1=CC(=C(C=C1I)Cl)N 5567 [0,0,0,0,0,0|4,0,0]=4 60 B9R1.69 C1=CC(=C(C=C1I)F)Br 6412 [0,0,0,0,0,0|4,0,0]=4 61 B9R1.69 C1=CC(=C(C=C1I)F)F 8933 [0,0,0,0,0,0|4,0,0]=4 62 B9R1.69 C1=CC(=C(C=C1I)F)I 8788 [0,0,0,0,0,0|4,0,0]=4 63 B9R1.69 C1=CC(=C(C=C1I)F)N 5568 [0,0,0,0,0,0|4,0,0]=4 64 B9R1.69 C1=CC(=C(C=C1N)Br)Cl 8804 [0,0,0,0,0,0|4,0,0]=4 65 B9R1.69 C1=CC(=C(C=C1N)Br)F 9837 [0,0,0,0,0,0|4,0,0]=4 66 B9R1.69 C1=CC(=C(C=C1N)Cl)Cl 6584 [0,0,0,0,0,0|4,0,0]=4 67 B9R1.69 C1=CC(=C(C=C1N)Cl)F 6046 [0,0,0,0,0,0|4,0,0]=4 68 B9R1.69 C1=CC(=C(C=C1N)Cl)F 9805 [0,0,0,0,0,0|4,0,0]=4 69 B9R1.69 C1=CC(=C(C=C1N)F)F 6033 [0,0,0,0,0,0|4,0,0]=4 70 B9R1.69 C1=CC(=C(C=C1N)F)O 6473 [0,0,0,0,0,0|3,0,1]=4 71 B9R1.69 C1=CC(=C(C=C1O)F)Cl 6195 [0,0,0,0,0,0|4,0,0]=4 72 B9R1.69 C1=CC(=C(C=C1O)F)F 10058 [0,0,0,0,0,0|4,0,0]=4 73 B9R1.69 C1=CC(=C(C=C1O)N)F 8132 [0,0,0,0,0,0|4,0,0]=4 74 B9R1.69 CC1=C(C=C(C=C1)Br)Br 8117 [0,0,0,0,0,0|4,0,0]=4 75 B9R1.69 CC1=C(C=C(C=C1)Br)F 5338 [0,0,0,0,0,0|4,0,0]=4 76 B9R1.69 CC1=C(C=C(C=C1)Br)O 8476 [0,0,0,0,0,0|3,0,0]=3 77 B9R1.69 CC1=C(C=C(C=C1)Cl)Br 10285 [0,0,0,0,0,0|4,0,0]=4 78 B9R1.69 CC1=C(C=C(C=C1)Cl)I 8997 [0,0,0,0,0,0|4,0,0]=4 79 B9R1.69 CC1=C(C=C(C=C1)Cl)S 9802 [0,0,0,0,0,0|3,1,0]=4 80 B9R1.69 CC1=C(C=C(C=C1)F)Br 9373 [0,0,0,0,0,0|4,0,0]=4 81 B9R1.69 CC1=C(C=C(C=C1)F)C 6113 [0,0,0,0,0,0|4,0,0]=4 82 B9R1.69 CC1=C(C=C(C=C1)F)N 6050 [0,0,0,0,0,0|4,0,0]=4 83 B9R1.69 CC1=C(C=C(C=C1)N)F 6047 [0,0,0,0,0,0|4,0,0]=4 84 B9R1.69 CC1=C(C=C(C=C1)N)O 10159 [0,0,0,0,0,0|3,0,0]=3 85 B9R1.69 CC1=C(C=CC(=C1)Br)Br 8391 [0,0,0,0,0,0|4,0,0]=4 86 B9R1.69 CC1=C(C=CC(=C1)Br)Cl 5543 [0,0,0,0,0,0|4,0,0]=4 87 B9R1.69 CC1=C(C=CC(=C1)Br)F 6043 [0,0,0,0,0,0|4,0,0]=4 88 B9R1.69 CC1=C(C=CC(=C1)Br)I 10304 [0,0,0,0,0,0|4,0,0]=4 89 B9R1.69 CC1=C(C=CC(=C1)Br)I 6526 [0,0,0,0,0,0|4,0,0]=4 90 B9R1.69 CC1=C(C=CC(=C1)Br)N 9725 [0,0,0,0,0,0|4,0,0]=4 91 B9R1.69 CC1=C(C=CC(=C1)Br)O 5111 [0,0,0,0,0,0|3,0,1]=4 92 B9R1.69 CC1=C(C=CC(=C1)Cl)Br 9792 [0,0,0,0,0,0|4,0,0]=4 93 B9R1.69 CC1=C(C=CC(=C1)Cl)I 8729 [0,0,0,0,0,0|4,0,0]=4 94 B9R1.69 CC1=C(C=CC(=C1)F)Br 5273 [0,0,0,0,0,0|4,0,0]=4 95 B9R1.69 CC1=C(C=CC(=C1)F)Br 6041 [0,0,0,0,0,0|4,0,0]=4 96 B9R1.69 CC1=C(C=CC(=C1)F)F 5294 [0,0,0,0,0,0|4,0,0]=4 97 B9R1.69 CC1=C(C=CC(=C1)F)F 8711 [0,0,0,0,0,0|4,0,0]=4 98 B9R1.69 CC1=C(C=CC(=C1)F)I 5554 [0,0,0,0,0,0|4,0,0]=4 99 B9R1.69 CC1=C(C=CC(=C1)F)N 5346 [0,0,0,0,0,0|4,0,0]=4 100 B9R1.69 CC1=C(C=CC(=C1)I)F 6231 [0,0,0,0,0,0|4,0,0]=4 101 B9R1.69 CC1=C(C=CC(=C1)I)N 5381 [0,0,0,0,0,0|4,0,0]=4 102 B9R1.69 CC1=C(C=CC(=C1)N)Br 10225 [0,0,0,0,0,0|4,0,0]=4 103 B9R1.69 CC1=C(C=CC(=C1)N)F 5275 [0,0,0,0,0,0|4,0,0]=4 104 B9R1.69 CC1=C(C=CC(=C1)O)Br 10033 [0,0,0,0,0,0|4,0,0]=4 105 B9R1.69 CC1=C(C=CC(=C1)O)F 6307 [0,0,0,0,0,0|4,0,0]=4 106 B9R1.69 CC1=C(C=CC(=C1)O)N 10166 [0,0,0,0,0,0|4,0,0]=4 107 B9R1.69 CC1=CC(=C(C=C1)Br)Cl 8156 [0,0,0,0,0,0|3,0,0]=3 108 B9R1.69 CC1=CC(=C(C=C1)Br)F 6101 [0,0,0,0,0,0|3,0,0]=3 109 B9R1.69 CC1=CC(=C(C=C1)C)Br 8829 [0,0,0,0,0,0|3,0,0]=3 110 B9R1.69 CC1=CC(=C(C=C1)C)I 8028 [0,0,0,0,0,0|3,0,0]=3 111 B9R1.69 CC1=CC(=C(C=C1)C)N 5322 [0,0,0,0,0,0|3,0,0]=3 112 B9R1.69 CC1=CC(=C(C=C1)C)O 6763 [0,0,0,0,0,0|2,0,0]=2 113 B9R1.69 CC1=CC(=C(C=C1)Cl)Br 5106 [0,0,0,0,0,0|3,0,0]=3 114 B9R1.69 CC1=CC(=C(C=C1)F)Br 6183 [0,0,0,0,0,0|3,0,0]=3 115 B9R1.69 CC1=CC(=C(C=C1)F)Cl 6423 [0,0,0,0,0,0|3,0,0]=3 116 B9R1.69 CC1=CC(=C(C=C1)F)I 6427 [0,0,0,0,0,0|3,0,0]=3 117 B9R1.69 CC1=CC(=C(C=C1)F)N 6577 [0,0,0,0,0,0|3,0,0]=3 118 B9R1.69 CC1=CC(=C(C=C1)F)O 5573 [0,0,0,0,0,0|2,0,0]=2 119 B9R1.69 CC1=CC(=C(C=C1)I)Br 5051 [0,0,0,0,0,0|3,0,0]=3 120 B9R1.69 CC1=CC(=C(C=C1)I)C 9318 [0,0,0,0,0,0|3,0,0]=3 121 B9R1.69 CC1=CC(=C(C=C1)N)F 6048 [0,0,0,0,0,0|3,0,0]=3 122 B9R1.69 CC1=CC(=C(C=C1)N)N 6659 [0,0,0,0,0,0|3,0,0]=3 123 B9R1.69 CC1=CC(=C(C=C1)O)Cl 10579 [0,0,0,0,0,0|2,0,1]=3 124 B9R1.69 CC1=CC(=C(C=C1)O)N 8098 [0,0,0,0,0,0|2,0,1]=3 125 B9R1.69 CC1=CC(=C(N=C1)Br)N 8112 [0,0,0,0,0,0|2,0,1]=3 126 B9R1.69 CC1=CC(=C(N=C1)Cl)Br 8055 [0,0,0,0,0,0|2,0,1]=3 127 B9R1.69 CC1=CC(=C(N=C1)Cl)F 10553 [0,0,0,0,0,0|2,0,1]=3 128 B9R1.69 CC1=CC(=C(N=C1)Cl)N 8400 [0,0,0,0,0,0|2,0,1]=3 129 B9R1.69 CC1=CC(=C(N=C1)F)Br 9709 [0,0,0,0,0,0|2,0,1]=3 130 B9R1.69 CC1=CC(=CN=C1Br)Br 5235 [0,0,0,0,0,0|3,0,1]=4 131 B9R1.69 CC1=CC(=CN=C1Cl)N 9387 [0,0,0,0,0,0|3,0,1]=4 132 B9R1.69 CC1=CC(=CN=C1F)Br 5236 [0,0,0,0,0,0|3,0,1]=4 133 B9R1.69 CC1=CC(=CN=C1N)Br 5024 [0,0,0,0,0,0|3,0,1]=4 134 B9R1.69 CC1=CC(=CN=C1N)I 6628 [0,0,0,0,0,0|3,0,1]=4 135 B9R1.69 CC1=NC(=C(C=C1)Br)C 6834 [0,0,0,0,0,0|4,0,0]=4 136 B9R1.69 CC1=NC(=C(C=C1)N)Br 6720 [0,0,0,0,0,0|4,0,0]=4 137 B9R1.69 CC1=NC(=C(C=C1)N)Cl 8825 [0,0,0,0,0,0|4,0,0]=4 138 B9R1.69 Cc1ccc(c(c1)O)N A0481 [0,0,0,0,0,0|2,0,0]=2 139 B9R1.69 c1cc(c(cc1Cl)N)N C0263 [0,0,0,0,0,0|4,0,0]=4 140 B8R1.3 C1=C(C=NC(=O)N1)Br 10164 [1,0,0,0,0,0|2,0,0]=3 141 B8R1.3 C1=CC(=CC=C1F)Br 6014 [1,0,0,0,0,0|3,0,0]=4 142 B8R1.3 C1=CC(=CC=C1F)Cl 9763 [1,0,0,0,0,0|3,0,0]=4 143 B8R1.3 C1=CC(=CC=C1F)F 10591 [1,0,0,0,0,0|3,0,0]=4 144 B8R1.3 C1=CC(=CC=C1N)Cl 6700 [1,0,0,0,0,0|3,0,0]=4 145 B8R1.3 C1=CC(=CC=C1N)F 5032 [1,0,0,0,0,0|3,0,0]=4 146 B8R1.3 C1=CC(=CC=C1N)I 8418 [1,0,0,0,0,0|3,0,0]=4 147 B8R1.3 C1=CC(=NC=C1Br)Br 5443 [1,0,0,0,0,0|2,0,1]=4 148 B8R1.3 C1=CC(=NC=C1Br)Cl 9228 [1,0,0,0,0,0|2,0,1]=4 149 B8R1.3 C1=CC(=NC=C1Br)I 9334 [1,0,0,0,0,0|2,0,1]=4 150 B8R1.3 C1=CC(=NC=C1Br)N 10514 [1,0,0,0,0,0|2,0,1]=4 151 B8R1.3 C1=CC(=NC=C1Cl)Br 6467 [1,0,0,0,0,0|2,0,1]=4 152 B8R1.3 C1=CC(=NC=C1Cl)N 8218 [1,0,0,0,0,0|2,0,1]=4 153 B8R1.3 C1=CC(=NC=C1F)Br 10006 [1,0,0,0,0,0|2,0,1]=4 154 B8R1.3 C1=CC(=NC=C1F)Br 6615 [1,0,0,0,0,0|2,0,1]=4 155 B8R1.3 C1=CC(=NC=C1F)Cl 9957 [1,0,0,0,0,0|2,0,1]=4 156 B8R1.3 C1=CC(=NC=C1F)F 5247 [1,0,0,0,0,0|2,0,1]=4 157 B8R1.3 C1=CC(=NC=C1F)N 10320 [1,0,0,0,0,0|2,0,1]=4 158 B8R1.3 C1=CC(=NC=C1I)Br 9940 [1,0,0,0,0,0|2,0,1]=4 159 B8R1.3 C1=CC(=NC=C1I)Cl 5225 [1,0,0,0,0,0|2,0,1]=4 160 B8R1.3 C1=CC(=NC=C1I)N 5110 [1,0,0,0,0,0|2,0,1]=4 161 B8R1.3 C1=CC(=NC=C1O)Br 10436 [1,0,0,0,0,0|2,0,1]=4 162 B8R1.3 C1=CC(=NC=C1O)Cl 9958 [1,0,0,0,0,0|2,0,1]=4 163 B8R1.3 C1=CC(=O)NC=C1Br 8266 [1,0,0,0,0,0|1,0,0]=2 164 B8R1.3 C1=CC(=O)NC=C1Cl 10450 [1,0,0,0,0,0|1,0,0]=2 165 B8R1.3 C1=CC(=O)NC=C1F 8617 [1,0,0,0,0,0|1,0,0]=2 166 B8R1.3 CC1=CN=C(C=C1)Br 9393 [1,0,0,0,0,0|1,0,1]=3 167 B8R1.3 CC1=CN=C(C=C1)F 5449 [1,0,0,0,0,0|1,0,1]=3 168 B8R1.3 CC1=CNC(=O)C=C1 9951 [1,0,0,0,0,0|0,0,0]=1 169 B8R1.3 CC1=NC=C(C=C1)Br 5076 [1,0,0,0,0,0|2,0,1]=4 170 B8R1.3 CC1=NC=C(C=C1)N 10240 [1,0,0,0,0,0|2,0,1]=4 171 B8R1.3 c1cc(ccc1F)Br B0238 [1,0,0,0,0,0|3,0,0]=4 172 B8R1.3 c1cc(ccc1N)F F0045 [1,0,0,0,0,0|3,0,0]=4 173 B8R1.4 C1=C(C=NC=C1Br)Br 5217 [1,0,0,0,0,0|2,0,1]=4 174 B8R1.4 C1=C(C=NC=C1Br)F 5671 [1,0,0,0,0,0|2,0,1]=4 175 B8R1.4 C1=C(C=NC=C1Br)O 10431 [1,0,0,0,0,0|1,0,1]=3 176 B8R1.4 C1=C(C=NC=C1Cl)Cl 10175 [1,0,0,0,0,0|2,0,1]=4 177 B8R1.4 C1=C(C=NC=C1Cl)F 8265 [1,0,0,0,0,0|2,0,1]=4 178 B8R1.4 C1=C(C=NC=C1F)F 5685 [1,0,0,0,0,0|2,0,1]=4 179 B8R1.4 C1=C(C=NC=C1F)N 6698 [1,0,0,0,0,0|2,0,1]=4 180 B8R1.4 C1=CC(=CC(=C1)Br)Br 5153 [1,0,0,0,0,0|3,0,0]=4 181 B8R1.4 C1=CC(=CC(=C1)Br)N 8582 [1,0,0,0,0,0|3,0,0]=4 182 B8R1.4 C1=CC(=CC(=C1)Br)N 8583 [1,0,0,0,0,0|3,0,0]=4 183 B8R1.4 C1=CC(=CC(=C1)Br)S 5283 [1,0,0,0,0,0|2,1,0]=4 184 B8R1.4 C1=CC(=CC(=C1)Cl)O 10156 [1,0,0,0,0,0|2,0,0]=3 185 B8R1.4 C1=CC(=CC(=C1)F)F 6015 [1,0,0,0,0,0|3,0,0]=4 186 B8R1.4 C1=CC(=CC(=C1)I)Br 5550 [1,0,0,0,0,0|3,0,0]=4 187 B8R1.4 C1=CC(=CC(=C1)I)F 8911 [1,0,0,0,0,0|3,0,0]=4 188 B8R1.4 C1=CC(=CC(=C1)I)O 9915 [1,0,0,0,0,0|2,0,0]=3 189 B8R1.4 C1=CNC(=O)C=C1O 10547 [1,0,0,0,0,0|3,0,0]=4 190 B8R1.4 CC1=CC(=CC=C1)Br 9432 [1,0,0,0,0,0|2,0,0]=3 191 B8R1.4 CC1=CC(=CC=C1)I 8771 [1,0,0,0,0,0|2,0,0]=3 192 B8R1.4 CC1=CC(=CN=C1)N 8645 [1,0,0,0,0,0|1,0,1]=3 193 B8R1.4 CC1=CC(=NC=C1)Br 9012 [1,0,0,0,0,0|3,0,0]=4 194 B8R1.4 CC1=CC(=NC=C1)Cl 5069 [1,0,0,0,0,0|3,0,0]=4 195 B8R1.4 CC1=CC(=NC=C1)F 5561 [1,0,0,0,0,0|3,0,0]=4 196 B8R1.4 CC1=CC(=NC=C1)F 6308 [1,0,0,0,0,0|3,0,0]=4 197 B8R1.4 CC1=NC(=CC=C1)Br 5660 [1,0,0,0,0,0|3,0,0]=4 198 B8R1.4 CC1=NC(=CC=C1)Cl 5070 [1,0,0,0,0,0|3,0,0]=4 199 B8R1.4 CC1=NC(=CC=C1)F 9658 [1,0,0,0,0,0|3,0,0]=4 200 B8R1.4 CC1=NC=CC(=C1)N 6613 [1,0,0,0,0,0|3,0,0]=4 201 B8R1.4 Cc1ccnc(n1)O H0124 [1,0,0,0,0,0|3,0,0]=4 202 B8R1.4 c1cc(cc(c1)Br)F B0235 [1,0,0,0,0,0|3,0,0]=4 203 B8R1.5 C1=CC(=C(N=C1)Br)Br 9457 [1,0,0,0,0,0|2,0,1]=4 204 B8R1.5 C1=CC(=C(N=C1)Cl)Br 9039 [1,0,0,0,0,0|2,0,1]=4 205 B8R1.5 C1=CC(=C(N=C1)Cl)Cl 5463 [1,0,0,0,0,0|2,0,1]=4 206 B8R1.5 C1=CC(=C(N=C1)Cl)Cl 6656 [1,0,0,0,0,0|2,0,1]=4 207 B8R1.5 C1=CC(=C(N=C1)Cl)F 5206 [1,0,0,0,0,0|2,0,1]=4 208 B8R1.5 C1=CC(=C(N=C1)Cl)I 8613 [1,0,0,0,0,0|2,0,1]=4 209 B8R1.5 C1=CC(=C(N=C1)Cl)N 6694 [1,0,0,0,0,0|2,0,1]=4 210 B8R1.5 C1=CC(=C(N=C1)Cl)O 6690 [1,0,0,0,0,0|1,0,1]=3 211 B8R1.5 C1=CC(=C(N=C1)F)Cl 8500 [1,0,0,0,0,0|2,0,1]=4 212 B8R1.5 C1=CC(=C(N=C1)F)F 5471 [1,0,0,0,0,0|2,0,1]=4 213 B8R1.5 C1=CC(=C(N=C1)N)Br 6715 [1,0,0,0,0,0|2,0,1]=4 214 B8R1.5 C1=CC(=C(N=C1)N)Cl 10389 [1,0,0,0,0,0|2,0,1]=4 215 B8R1.5 C1=CC(=C(N=C1)N)F 10619 [1,0,0,0,0,0|2,0,1]=4 216 B8R1.5 C1=CC(=C(N=C1)N)N 9712 [1,0,0,0,0,0|2,0,1]=4 217 B8R1.5 C1=CC=C(C(=C1)Br)Br 5382 [1,0,0,0,0,0|3,0,0]=4 218 B8R1.5 C1=CC=C(C(=C1)Br)I 6003 [1,0,0,0,0,0|3,0,0]=4 219 B8R1.5 C1=CC=C(C(=C1)Cl)Br 9010 [1,0,0,0,0,0|3,0,0]=4 220 B8R1.5 C1=CC=C(C(=C1)Cl)Cl 5752 [1,0,0,0,0,0|3,0,0]=4 221 B8R1.5 C1=CC=C(C(=C1)F)Br 6002 [1,0,0,0,0,0|3,0,0]=4 222 B8R1.5 C1=CC=C(C(=C1)F)Cl 10274 [1,0,0,0,0,0|3,0,0]=4 223 B8R1.5 C1=CC=C(C(=C1)F)Cl 6006 [1,0,0,0,0,0|3,0,0]=4 224 B8R1.5 C1=CC=C(C(=C1)F)F 6007 [1,0,0,0,0,0|3,0,0]=4 225 B8R1.5 C1=CC=C(C(=C1)F)F 8369 [1,0,0,0,0,0|3,0,0]=4 226 B8R1.5 C1=CC=C(C(=C1)N)Br 5510 [1,0,0,0,0,0|3,0,0]=4 227 B8R1.5 C1=CC=C(C(=C1)N)F 6030 [1,0,0,0,0,0|3,0,0]=4 228 B8R1.5 C1=CC=C(C(=C1)N)I 9774 [1,0,0,0,0,0|3,0,0]=4 229 B8R1.5 C1=CC=C(C(=C1)O)Br 8498 [1,0,0,0,0,0|2,0,0]=3 230 B8R1.5 C1=CNC=C(C1=O)N 9533 [1,0,0,0,0,0|3,0,0]=4 231 B8R1.5 CC1=C(C=CC=N1)Br 5675 [1,0,0,0,0,0|2,0,1]=4 232 B8R1.5 CC1=C(C=CC=N1)N 10626 [1,0,0,0,0,0|2,0,1]=4 233 B8R1.5 CC1=C(N=CC=C1)Br 8086 [1,0,0,0,0,0|2,0,1]=4 234 B8R1.5 CC1=CC=CC=C1Cl 5808 [1,0,0,0,0,0|3,0,0]=4 235 B8R1.5 CC1=CC=CC=C1I 5298 [1,0,0,0,0,0|3,0,0]=4 236 B8R1.5 c1ccc(c(c1)N)F F0011 [1,0,0,0,0,0|3,0,0]=4 237 B10R1.22 C1=C(C=C(C(=C1F)F)O)Br 8561 [0,1,0,0,0,0|3,0,0]=4 238 B10R1.22 CC1=CC(=C(C(=C1)Br)N)Br 6657 [0,1,0,0,0,0|3,0,0]=4 239 B10R1.22 CC1=CC(=C(C(=C1)C)I)C 5640 [0,1,0,0,0,0|3,0,0]=4 240 B10R1.22 CC1=CC(=C(C(=C1)O)C)C 9036 [0,1,0,0,0,0|2,0,0]=3 241 B10R1.25 C1=CC(=C(C=C1Br)O)C#N 8623 [0,1,0,0,0,0|3,0,0]=4 242 B10R1.25 C1=CC(=C(C=C1F)Br)C=O 5308 [0,1,0,0,0,0|3,0,0]=4 243 B10R1.25 C1=CC(=C(C=C1F)F)C=O 8215 [0,1,0,0,0,0|3,0,0]=4 244 B10R1.25 C1=CC(=C(C=C1O)O)C=O 10275 [0,1,0,0,0,0|2,0,0]=3 245 B10R1.25 CC1=C(C=CC(=C1)Br)C=O 9443 [0,1,0,0,0,0|3,0,0]=4 246 B10R1.25 CC1=CC(=C(C=C1)C#N)F 6654 [0,1,0,0,0,0|3,0,0]=4 247 B10R1.25 CC1=CC(=C(C=C1)OC)I 6862 [0,1,0,0,0,0|2,0,1]=4 248 B10R1.25 COC1=C(C=C(C=C1)Br)O 6683 [0,1,0,0,0,0|2,0,1]=4 249 B10R1.25 COC1=C(C=C(C=C1)F)O 6489 [0,1,0,0,0,0|2,0,1]=4 250 B10R1.25 c1cc(c(cc1F)F)C=O D0156 [0,1,0,0,0,0|3,0,0]=4 251 B10R1.30 C1=CC(=C(C=C1F)CO)Br 8036 [0,1,0,0,0,0|3,0,0]=4 252 B10R1.30 C1=CC(=C(C=C1F)CO)F 6070 [0,1,0,0,0,0|3,0,0]=4 253 B10R1.30 CC1=CC(=C(C=C1)C)C#N 6545 [0,1,0,0,0,0|3,0,0]=4 254 B10R1.30 CC1=CC(=C(C=C1)F)C#N 6447 [0,1,0,0,0,0|3,0,0]=4 255 B10R1.30 COC1=C(C=CC(=C1)Br)Cl 9742 [0,1,0,0,0,0|3,0,0]=4 256 B10R1.30 COC1=C(C=CC(=C1)Br)F 5237 [0,1,0,0,0,0|3,0,0]=4 257 B10R1.30 COC1=C(C=CC(=C1)Br)N 5264 [0,1,0,0,0,0|3,0,0]=4 258 B10R1.30 COC1=C(C=CC(=C1)Br)O 6868 [0,1,0,0,0,0|2,0,1]=4 259 B10R1.30 COC1=C(C=CC(=C1)F)F 8359 [0,1,0,0,0,0|3,0,0]=4 260 B10R1.118 C1=C(C(=CC(=C1Cl)Cl)Cl)O 6798 [0,1,0,0,0,0|3,0,0]=4 261 B10R1.118 CC1=CC(=C(C=C1Br)C)N 8537 [0,1,0,0,0,0|3,0,0]=4 262 B10R1.118 CC1=CC(=C(C=C1Cl)C)N 6620 [0,1,0,0,0,0|3,0,0]=4 263 B10R1.118 CC1=CC(=C(C=C1Cl)Cl)F 6167 [0,1,0,0,0,0|3,0,0]=4 264 B10R1.118 CC1=CC(=C(C=C1N)Cl)Br 6611 [0,1,0,0,0,0|3,0,0]=4 265 B10R1.119 C1=CC(=C(C(=C1F)O)Cl)F 9245 [0,1,0,0,0,0|3,0,0]=4 266 B10R1.119 C1=CC(=C(C(=C1F)O)F)Cl 6248 [0,1,0,0,0,0|3,0,0]=4 267 B10R1.119 C1=CC(=C(C(=C1F)O)F)F 5590 [0,1,0,0,0,0|3,0,0]=4 268 B10R1.119 CC1=C(C(=C(C=C1)Cl)O)F 6260 [0,1,0,0,0,0|2,0,0]=3 269 B10R1.119 CC1=C(C(=C(C=C1)F)O)Cl 6259 [0,1,0,0,0,0|2,0,0]=3 270 B10R1.119 CC1=C(C(=C(C=C1)F)O)F 6277 [0,1,0,0,0,0|2,0,0]=3 271 B10R1.119 CC1=C(C(=C(C=C1)O)F)F 6276 [0,1,0,0,0,0|2,0,1]=4 272 B10R1.176 C1=CC(=C(C=C1C=O)O)O 6767 [0,1,0,0,0,0|1,0,2]=4 273 B10R1.176 C1=CC(=C(C=C1CBr)Cl)Cl 6739 [0,1,0,0,0,0|3,0,0]=4 274 B10R1.176 C1=CC(=C(C=C1CBr)F)Cl 6576 [0,1,0,0,0,0|3,0,0]=4 275 B10R1.176 C1=CC(=C(C=C1CCl)F)F 5398 [0,1,0,0,0,0|3,0,0]=4 276 B10R1.176 C1=CC(=C(C=C1CN)Cl)F 8697 [0,1,0,0,0,0|3,0,0]=4 277 B10R1.176 C1=CC(=C(C=C1CO)Br)O 9541 [0,1,0,0,0,0|2,0,1]=4 278 B10R1.176 C1=CC(=C(C=C1CO)Cl)F 5350 [0,1,0,0,0,0|3,0,0]=4 279 B10R1.176 C1=CC(=C(C=C1CO)F)Cl 6586 [0,1,0,0,0,0|3,0,0]=4 280 B10R1.176 C1=CC(=C(C=C1CO)F)F 5618 [0,1,0,0,0,0|3,0,0]=4 281 B10R1.176 CC1=C(C=C(C=C1)CBr)F 8915 [0,1,0,0,0,0|3,0,0]=4 282 B10R1.176 CC1=C(C=C(C=C1)CN)C 6547 [0,1,0,0,0,0|3,0,0]=4 283 B10R1.176 CC1=C(C=C(C=C1)CN)F 8324 [0,1,0,0,0,0|3,0,0]=4 284 B10R1.176 CC1=C(C=C(C=C1)CO)F 8904 [0,1,0,0,0,0|3,0,0]=4 285 B10R1.176 CC1=C(C=C(C=C1)OC)Cl 8676 [0,1,0,0,0,0|3,0,0]=4 286 B10R1.176 CC1=C(C=CC(=C1)CBr)F 9893 [0,1,0,0,0,0|3,0,0]=4 287 B10R1.176 CC1=C(C=CC(=C1)CN)F 8722 [0,1,0,0,0,0|3,0,0]=4 288 B10R1.176 COC1=CC(=C(C=C1)Br)F 5203 [0,1,0,0,0,0|3,0,0]=4 289 B10R1.176 COC1=CC(=C(C=C1)Cl)Br 8084 [0,1,0,0,0,0|3,0,0]=4 290 B10R1.176 COC1=CC(=C(C=C1)F)F 5159 [0,1,0,0,0,0|3,0,0]=4 291 B10R1.176 COC1=CC(=C(C=C1)O)Br 8831 [0,1,0,0,0,0|2,0,1]=4 292 B10R1.176 c1cc(c(cc1CN)F)Cl C0229 [0,1,0,0,0,0|3,0,0]=4 293 B7R0.6 C(=C/C(=O)O)/C(=O)N 5513 [1,0,1,0,0,0|2,0,0]=4 294 B7R1.3 C1=CC(=CN=C1)N 9511 [2,0,0,0,0,0|1,0,1]=4 295 B7R1.3 C1=CC(=CN=C1)O 6695 [2,0,0,0,0,0|0,0,1]=3 296 B7R1.3 C1=CC(=CN=C1)O 6696 [2,0,0,0,0,0|0,0,1]=3 297 B7R1.3 C1=CC=C(C=C1)F 5387 [2,0,0,0,0,0|2,0,0]=4 298 B7R1.3 C1=CC=C(C=C1)O 5847 [2,0,0,0,0,0|1,0,0]=3 299 B7R1.3 C1=CC=NC(=C1)Br 6647 [2,0,0,0,0,0|1,0,1]=4 300 B7R1.3 CC1=CN=CC=C1 8633 [2,0,0,0,0,0|0,0,1]=3 301 B7R1.3 c1ccc(cc1)F B0042 [2,0,0,0,0,0|2,0,0]=4 302 B7R1.3 c1ccnc(c1)Br B0025 [2,0,0,0,0,0|1,0,1]=4 303 B9R1.1 C1=CC(=CC=C1C=O)F 6034 [1,1,0,0,0,0|2,0,0]=4 304 B9R1.1 C1=CC(=CC=C1C=O)I 5018 [1,1,0,0,0,0|2,0,0]=4 305 B9R1.1 C1=CC(=CC=C1C=O)O 5740 [1,1,0,0,0,0|2,0,0]=4 306 B9R1.1 C1=CC(=CC=C1CBr)Br 10348 [1,1,0,0,0,0|2,0,0]=4 307 B9R1.1 C1=CC(=CC=C1CCl)Cl 6806 [1,1,0,0,0,0|2,0,0]=4 308 B9R1.1 C1=CC(=CC=C1CN)Br 8072 [1,1,0,0,0,0|2,0,0]=4 309 B9R1.1 C1=CC(=CC=C1CN)F 5139 [1,1,0,0,0,0|2,0,0]=4 310 B9R1.1 C1=CC(=CC=C1CN)O 8602 [1,1,0,0,0,0|1,0,1]=4 311 B9R1.1 C1=CC(=CC=C1CS)Cl 6134 [1,1,0,0,0,0|2,0,0]=4 312 B9R1.1 C1=CC(=NC=C1Br)C=O 5008 [1,1,0,0,0,0|1,0,1]=4 313 B9R1.1 C1=CC(=NC=C1CCl)Cl 5674 [1,1,0,0,0,0|1,0,1]=4 314 B9R1.1 CC1=CC=C(C=C1)C#N 6644 [1,1,0,0,0,0|2,0,0]=4 315 B9R1.1 CC1=CC=C(C=C1)CBr 9734 [1,1,0,0,0,0|2,0,0]=4 316 B9R1.1 CC1=CC=C(C=C1)CN 9612 [1,1,0,0,0,0|2,0,0]=4 317 B9R1.1 CC1=CN=C(C=C1)C#N 6614 [1,1,0,0,0,0|1,0,1]=4 318 B9R1.1 COC1=CC=C(C=C1)Br 6813 [1,1,0,0,0,0|2,0,0]=4 319 B9R1.1 COC1=CC=C(C=C1)F 5383 [1,1,0,0,0,0|2,0,0]=4 320 B9R1.1 COC1=CC=C(C=C1)N 8631 [1,1,0,0,0,0|2,0,0]=4 321 B9R1.1 COC1=CC=C(C=C1)S 8726 [1,1,0,0,0,0|1,1,0]=4 322 B9R1.1 CSC1=CC=C(C=C1)F 9086 [1,1,0,0,0,0|2,0,0]=4 323 B9R1.2 C1=CC(=CC(=C1)Br)CN 9996 [1,1,0,0,0,0|2,0,0]=4 324 B9R1.2 C1=CC(=CC(=C1)F)CO 6086 [1,1,0,0,0,0|2,0,0]=4 325 B9R1.2 CC1=CC(=CC=C1)CBr 8441 [1,1,0,0,0,0|2,0,0]=4 326 B9R1.2 CC1=CC=CC(=C1)C=O 8187 [1,1,0,0,0,0|1,0,1]=4 327 B9R1.2 COC1=CC(=CC=C1)F 5384 [1,1,0,0,0,0|2,0,0]=4 328 B9R1.2 COC1=CC(=CC=C1)S 5358 [1,1,0,0,0,0|1,1,0]=4 329 B9R1.2 COC1=CC(=CN=C1)Br 10627 [1,1,0,0,0,0|1,0,1]=4 330 B9R1.2 COC1=CC(=CN=C1)Br 5648 [1,1,0,0,0,0|1,0,1]=4 331 B9R1.2 COC1=CC=CC(=C1)N 9172 [1,1,0,0,0,0|2,0,0]=4 332 B9R1.2 COc1cccc(c1)Br B0420 [1,1,0,0,0,0|2,0,0]=4 333 B9R1.2 COc1cccc(c1)Cl C0028 [1,1,0,0,0,0|2,0,0]=4 334 B9R1.2 CSC1=CC(=CC=C1)Cl 5596 [1,1,0,0,0,0|2,0,0]=4 335 B9R1.2 CSC1=CC=CC(=C1)F 9504 [1,1,0,0,0,0|2,0,0]=4 336 B9R1.2 CSC1=CC=CC(=C1)N 6516 [1,1,0,0,0,0|2,0,0]=4 337 B9R1.3 C1=C(C(=O)C(=CN1)Br)Br 8526 [1,1,0,0,0,0|2,0,0]=4 338 B9R1.3 C1=CC(=C(C(=C1)Cl)F)O 5115 [1,1,0,0,0,0|2,0,0]=4 339 B9R1.3 C1=CC(=C(C(=C1)F)O)O 6478 [1,1,0,0,0,0|2,0,0]=4 340 B9R1.3 C1=CC(=C(C(=C1)O)O)O 6821 [1,1,0,0,0,0|2,0,0]=4 341 B9R1.3 CC1=C(C(=CC=C1)Br)F 8654 [1,1,0,0,0,0|2,0,0]=4 342 B9R1.3 CC1=C(C(=CC=C1)C)Br 8575 [1,1,0,0,0,0|2,0,0]=4 343 B9R1.3 CC1=C(C(=CC=C1)C)O 5710 [1,1,0,0,0,0|2,0,0]=4 344 B9R1.3 CC1=C(C(=CC=C1)F)Br 10618 [1,1,0,0,0,0|2,0,0]=4 345 B9R1.3 CC1=C(C(=CC=C1)F)C 6112 [1,1,0,0,0,0|2,0,0]=4 346 B9R1.3 CC1=C(C(=CC=C1)F)F 9232 [1,1,0,0,0,0|2,0,0]=4 347 B9R1.3 CC1=C(C(=CC=C1)N)F 5245 [1,1,0,0,0,0|2,0,0]=4 348 B9R1.3 CC1=C(C=CC=C1Cl)O 8169 [1,1,0,0,0,0|2,0,0]=4 349 B9R1.3 CC1=C(C=CC=C1F)O 9587 [1,1,0,0,0,0|2,0,0]=4 350 B9R1.34 C1=C(C=C(C=C1Br)Br)O 8530 [1,1,0,0,0,0|2,0,0]=4 351 B9R1.34 C1=C(C=C(C=C1F)F)O 5292 [1,1,0,0,0,0|2,0,0]=4 352 B9R1.34 CC1=CC(=CC(=C1)Br)Br 10173 [1,1,0,0,0,0|2,0,0]=4 353 B9R1.34 CC1=CC(=CC(=C1)Br)C 6396 [1,1,0,0,0,0|2,0,0]=4 354 B9R1.34 CC1=CC(=CC(=C1)Br)C 8945 [1,1,0,0,0,0|2,0,0]=4 355 B9R1.34 CC1=CC(=CC(=C1)C)C 5777 [1,1,0,0,0,0|2,0,0]=4 356 B9R1.34 CC1=CC(=CC(=C1)I)C 9209 [1,1,0,0,0,0|2,0,0]=4 357 B9R1.15 C1=CC(=C(N=C1)Cl)CO 6736 [1,1,0,0,0,0|1,0,1]=4 358 B9R1.15 C1=CC=C(C(=C1)C#N)O 9517 [1,1,0,0,0,0|2,0,0]=4 359 B9R1.15 C1=CC=C(C(=C1)C=O)O 5096 [1,1,0,0,0,0|1,0,0]=3 360 B9R1.15 C1=CC=C(C(=C1)CO)Cl 5137 [1,1,0,0,0,0|2,0,0]=4 361 B9R1.15 C1=CC=C(C(=C1)CO)F 6299 [1,1,0,0,0,0|2,0,0]=4 362 B9R1.15 C1=CC=C(C(=C1)CO)O 10170 [1,1,0,0,0,0|1,0,1]=4 363 B9R1.15 C1=CC=C(C(=C1)CO)O 8851 [1,1,0,0,0,0|1,0,1]=4 364 B9R1.15 CC1=CC=CC=C1CO 6723 [1,1,0,0,0,0|2,0,0]=4 365 B9R1.15 COC1=C(N=CC=C1)Cl 9004 [1,1,0,0,0,0|1,0,1]=4 366 B9R1.15 COC1=CC=CC=C1Br 6133 [1,1,0,0,0,0|2,0,0]=4 367 B9R1.15 COC1=CC=CC=C1F 6115 [1,1,0,0,0,0|2,0,0]=4 368 B9R1.15 COC1=CC=CC=C1I 9182 [1,1,0,0,0,0|2,0,0]=4 369 B9R1.15 COC1=CC=CC=C1N 6674 [1,1,0,0,0,0|2,0,0]=4 370 B9R1.15 COc1ccccc1Br B0022 [1,1,0,0,0,0|2,0,0]=4 371 B9R1.15 CSC1=CC=CC=C1O 8029 [1,1,0,0,0,0|1,1,0]=4 372 B11R1.464 CC1=CC(=C(C(=C1)C)C=O)C 9200 [0,2,0,0,0,0|2,0,0]=4 373 B11R1.37 COC1=C(C=CC(=C1)O)C=O 5482 [0,2,0,0,0,0|2,0,0]=4 374 B11R1.166 C1=CC(=C(C=C1Cl)O)C(=O)O 5117 [0,2,0,0,0,0|2,0,0]=4 375 B11R1.166 C1=CC(=C(C=C1F)O)[N+](=O)[O-] 5234 [0,2,0,0,0,0|2,0,0]=4 376 B11R1.166 C1=CC(=C(C=C1F)O)[N+](=O)[O-] 5557 [0,2,0,0,0,0|2,0,0]=4 377 B11R1.166 C1=CC(=C(C=C1N)O)C(=O)O 6786 [0,2,0,0,0,0|2,0,0]=4 378 B11R1.166 CC(=O)C1=C(C=C(C=C1)F)O 9883 [0,2,0,0,0,0|2,0,0]=4 379 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O 6607 [0,2,0,0,0,0|1,0,0]=3 380 B11R1.166 CC1=CC(=C(C=C1)C(=O)O)O 6608 [0,2,0,0,0,0|1,0,0]=3 381 B11R1.278 CC1=C(C(=C(C=C1)C=O)F)F 5389 [0,2,0,0,0,0|2,0,0]=4 382 B11R1.279 COC1=CC(=C(C=C1)C=O)F 6304 [0,2,0,0,0,0|2,0,0]=4 383 B11R1.72 CC1=C(C(=C(C=C1)Cl)CO)F 9661 [0,2,0,0,0,0|2,0,0]=4 384 B11R1.72 CC1=C(C(=C(C=C1)F)CO)Cl 8181 [0,2,0,0,0,0|2,0,0]=4 385 B11R1.72 CC1=C(C(=C(C=C1)F)CO)F 10055 [0,2,0,0,0,0|2,0,0]=4 386 B11R1.72 CC1=C(C(=C(C=C1)F)OC)Cl 8179 [0,2,0,0,0,0|2,0,0]=4 387 B11R1.167 B(C1=C(C=CC(=C1)C)C)(O)O 8553 [0,2,0,0,0,0|2,0,0]=4 388 B11R1.167 C1=C(C(=O)NC=C1Br)C(=O)O 8259 [0,2,0,0,0,0|1,0,0]=3 389 B11R1.167 CC1=CC(=C(C=C1)Cl)C(=O)O 8528 [0,2,0,0,0,0|2,0,0]=4 390 B11R1.167 CC1=CC(=C(C=C1)F)C(=O)O 5026 [0,2,0,0,0,0|2,0,0]=4 391 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O 5607 [0,2,0,0,0,0|2,0,0]=4 392 B11R1.167 CC1=CC(=C(C=C1)I)C(=O)O 6864 [0,2,0,0,0,0|2,0,0]=4 393 B11R1.167 CC1=CC(=C(C=C1)N)C(=O)O 5694 [0,2,0,0,0,0|2,0,0]=4 394 B11R1.280 COC1=CC(=C(C=C1)I)OC 8019 [0,2,0,0,0,0|2,0,0]=4 395 B11R1.280 COC1=CC(=C(C=C1)S)OC 10443 [0,2,0,0,0,0|1,1,0]=4 396 B7R1.2 CC1=CC(=NN1)C 10496 [1,0,0,0,1,0|2,0,0]=4 397 B7R1.2 CC1=CC(=O)NO1 9631 [1,0,0,0,1,0|1,0,0]=3 398 B7R1.2 CC1=CC=C(S1)Br 6601 [1,0,0,0,1,0|2,0,0]=4 399 B7R1.2 Cc1cc(n[nH]1)C D0196 [1,0,0,0,1,0|2,0,0]=4