0 B17R2.193 Cc1cc(c[nH]c1=O)C=Cc2ccccc2 AIFCHEM-94568533889 [0,0,0,0,0,0|2,0,2]=4 1 B17R2.193 Cc1cc(ccc1F)C=Cc2ccccc2 AIFCHEM-94596280873 [0,0,0,0,0,0|4,0,0]=4 2 B17R2.193 Cc1cc(ccc1N)C=Cc2ccccc2 AIFCHEM-6216095461 [0,0,0,0,0,0|4,0,0]=4 3 B17R2.193 Cc1cc(ccc1O)C=Cc2cccnc2 AIFCHEM-6333880606 [0,0,0,0,0,0|4,0,0]=4 4 B17R2.193 Cc1cc(ncc1N)C=Cc2ccccc2 AIFCHEM-6300490422 [0,0,0,0,0,0|3,0,1]=4 5 B17R2.193 Cc1nc(cnc1N)C=Cc2ccccc2 AIFCHEM-94568532100 [0,0,0,0,0,0|4,0,0]=4 6 B17R2.193 Nc1cc(cnc1N)C=Cc2cccnc2 AIFCHEM-6294555501 [0,0,0,0,0,0|4,0,0]=4 7 B17R2.193 Nc1ccc(cc1O)C=Cc2ccccc2 AIFCHEM-94568528578 [0,0,0,0,0,0|3,0,1]=4 8 B17R2.193 Nc1ncc([nH]c1=O)C=Cc2cccnc2 AIFCHEM-5973255718 [0,0,0,0,0,0|4,0,0]=4 9 B17R2.193 Nc1ncc(nc1N)C=Cc2ccccc2 AIFCHEM-6317692076 [0,0,0,0,0,0|4,0,0]=4 10 B17R2.193 Oc1cc(ccc1F)C=Cc2ccccc2 AIFCHEM-94568520450 [0,0,0,0,0,0|3,0,1]=4 11 B17R2.193 Oc1ccc(cc1O)C=Cc2ccccc2 AIFCHEM-94568524856 [0,0,0,0,0,0|2,0,1]=3 12 B17R2.193 Oc1ccc(cc1O)C=Cc2cccnc2 AIFCHEM-6335479309 [0,0,0,0,0,0|3,0,1]=4 13 B16R2.132 Cc1ccc(cn1)C=Cc2cccnc2 AIFCHEM-6480281978 [1,0,0,0,0,0|3,0,0]=4 14 B16R2.132 Cc1ccc(nn1)C=Cc2cccnc2 AIFCHEM-6359601016 [1,0,0,0,0,0|2,0,1]=4 15 B16R2.132 Nc1ncc(nn1)C=Cc2ccccc2 AIFCHEM-94568531651 [1,0,0,0,0,0|2,0,1]=4 16 B16R2.132 Oc1ccc(nc1)C=Cc2ccccc2 AIFCHEM-94596281893 [1,0,0,0,0,0|1,0,1]=3 17 B16R2.252 Cc1cccc(c1)C=Cc2ccccc2 AIFCHEM-94568530998 [1,0,0,0,0,0|3,0,0]=4 18 B16R2.252 O=c1cncc([nH]1)C=Cc2ccccc2 AIFCHEM-94596284652 [1,0,0,0,0,0|2,0,0]=3 19 B16R2.252 Oc1ccnc(c1)C=Cc2ccccc2 AIFCHEM-94596280028 [1,0,0,0,0,0|1,0,2]=4 20 B18R2.249 CC(=Cc1ccc(c(c1)C)O)c2ccccc2 AIFCHEM-94522752225 [0,1,0,0,0,0|3,0,0]=4 21 B18R2.249 CC(=Cc1ccc(c(c1)O)O)c2ccccc2 AIFCHEM-94522753687 [0,1,0,0,0,0|2,0,1]=4 22 B18R2.249 CC(=Cc1cnc(c(c1)C)C)c2ccccc2 AIFCHEM-94522748684 [0,1,0,0,0,0|3,0,0]=4 23 B18R2.249 CC(=Cc1cnc(c(n1)C)O)c2ccccc2 AIFCHEM-94522740785 [0,1,0,0,0,0|3,0,0]=4 24 B18R2.2562 CNc1ncc(cc1C)C=Cc2ccccc2 AIFCHEM-5913736297 [0,1,0,0,0,0|3,0,0]=4 25 B18R2.2686 CCc1cc(ccc1O)C=Cc2ccccc2 AIFCHEM-6332230801 [0,1,0,0,0,0|3,0,0]=4 26 B18R2.2686 NCc1cc(ccc1O)C=Cc2ccccc2 AIFCHEM-5659441225 [0,1,0,0,0,0|3,0,0]=4 27 B18R2.2686 Nc1ccc(cc1C=O)C=Cc2ccccc2 AIFCHEM-6031780101 [0,1,0,0,0,0|3,0,0]=4 28 B18R2.2686 Nc1ncc(cc1C=O)C=Cc2ccccc2 AIFCHEM-5643097187 [0,1,0,0,0,0|2,0,0]=3 29 B18R2.2686 O=Cc1cc(c[nH]c1=O)C=Cc2ccccc2 AIFCHEM-94568521765 [0,1,0,0,0,0|1,0,2]=4 30 B18R2.2686 O=Cc1cc(ccc1O)C=Cc2ccccc2 AIFCHEM-94596276520 [0,1,0,0,0,0|2,0,0]=3 31 B18R2.2686 O=Cc1cc(ncc1F)C=Cc2ccccc2 AIFCHEM-94568519424 [0,1,0,0,0,0|2,0,1]=4 32 B18R2.6533 Cc1nc(c(cc1C=Cc2ccccc2)N)N AIFCHEM-6431487260 [0,1,0,0,0,0|3,0,0]=4 33 B18R2.6533 Cc1nc(c(cc1C=Cc2ccccc2)N)O AIFCHEM-94596284565 [0,1,0,0,0,0|2,0,0]=3 34 B18R2.6533 Oc1cc(c(cc1F)C=Cc2ccccc2)F AIFCHEM-6309053538 [0,1,0,0,0,0|3,0,0]=4 35 B18R2.9259 Cc1ccc(cc1)C=Cc2ccc(c(c2)O)O AIFCHEM-6426905022 [0,1,0,0,0,0|2,0,1]=4 36 B18R2.9259 Cc1ccc(cc1)C=Cc2cnc(c(c2)C)C AIFCHEM-6301409528 [0,1,0,0,0,0|3,0,0]=4 37 B18R2.9259 Cc1ncc(cc1F)C=Cc2ccc(cc2)F AIFCHEM-94594911066 [0,1,0,0,0,0|3,0,0]=4 38 B18R2.9259 Nc1ncc(cc1F)C=Cc2ccc(cc2)F AIFCHEM-5971478117 [0,1,0,0,0,0|3,0,0]=4 39 B18R2.9259 Oc1cc(cnc1O)C=Cc2ccc(cc2)F AIFCHEM-6452788064 [0,1,0,0,0,0|1,0,1]=3 40 B18R2.9259 Oc1ccc(cc1O)C=Cc2ccc(cc2)F AIFCHEM-94594922496 [0,1,0,0,0,0|2,0,1]=4 41 B18R2.32351 Cc1c(ccc(c1C)C=Cc2ccccc2)O AIFCHEM-94596276655 [0,1,0,0,0,0|3,0,0]=4 42 B18R2.38706 Oc1cc(cc(c1O)F)C=Cc2ccccc2 AIFCHEM-6360903986 [0,1,0,0,0,0|2,0,1]=4 43 B18R2.38706 Oc1cc(cc(c1O)O)C=Cc2ccccc2 AIFCHEM-94596276145 [0,1,0,0,0,0|2,0,1]=4 44 B18R2.39765 Cc1cc(cnc1C)C=Cc2ccccc2F AIFCHEM-94569701255 [0,1,0,0,0,0|3,0,0]=4 45 B18R2.39765 Cc1ccccc1C=Cc2cc(=O)c(c[nH]2)C AIFCHEM-6433249529 [0,1,0,0,0,0|2,0,0]=3 46 B18R2.39765 Cc1ccccc1C=Cc2ccc(c(c2)F)O AIFCHEM-6372823632 [0,1,0,0,0,0|3,0,0]=4 47 B18R2.39765 Cc1ccccc1C=Cc2ccc(c(c2)O)O AIFCHEM-6423686647 [0,1,0,0,0,0|2,0,1]=4 48 B18R2.39765 Cc1ccccc1C=Cc2cnc(c(=O)[nH]2)N AIFCHEM-5905049668 [0,1,0,0,0,0|3,0,0]=4 49 B18R2.39765 Cc1ccccc1C=Cc2cnc(c(c2)C)C AIFCHEM-6307999589 [0,1,0,0,0,0|3,0,0]=4 50 B18R2.39765 Nc1cc(ncc1O)C=Cc2ccccc2F AIFCHEM-6482888769 [0,1,0,0,0,0|2,0,1]=4 51 B18R2.39765 Oc1ccc(cc1O)C=Cc2ccccc2F AIFCHEM-6296039646 [0,1,0,0,0,0|2,0,1]=4 52 B18R2.65908 Cc1ncc(cc1F)C=Cc2cccc(c2)F AIFCHEM-6381782283 [0,1,0,0,0,0|3,0,0]=4 53 B18R2.65908 Cc1ncc(cc1O)C=Cc2cccc(c2)F AIFCHEM-6339308386 [0,1,0,0,0,0|2,0,1]=4 54 B18R2.65908 Nc1ncc([nH]c1=O)C=Cc2cccc(c2)F AIFCHEM-5906772454 [0,1,0,0,0,0|3,0,0]=4 55 B18R2.65908 Nc1ncc(cc1F)C=Cc2cccc(c2)F AIFCHEM-6181836828 [0,1,0,0,0,0|3,0,0]=4 56 B18R2.65908 Oc1ccc(cc1O)C=Cc2cccc(c2)F AIFCHEM-6450556563 [0,1,0,0,0,0|2,0,1]=4 57 B16R2.2884 Cn1cc(nc1N)C=Cc2ccccc2 AIFCHEM-6278499003 [0,0,0,0,1,0|3,0,0]=4 58 B18R2.8976 Cc1cc(cnc1N)C=CCc2ccccc2 AIFCHEM-94567045934 [0,0,0,0,0,1|3,0,0]=4 59 B18R2.8976 Cc1ncc(cc1O)C=CCc2ccccc2 AIFCHEM-94567052044 [0,0,0,0,0,1|2,0,1]=4 60 B18R2.8976 Oc1ccc(cc1O)C=CCc2ccccc2 AIFCHEM-6454588995 [0,0,0,0,0,1|2,0,1]=4 61 B15R2.2195 C(=Cc1ccccn1)c2cccnc2 AIFCHEM-6376071272 [2,0,0,0,0,0|2,0,0]=4 62 B17R2.48 OCc1ccc(cc1)C=Cc2ccccc2 AIFCHEM-94596276901 [1,1,0,0,0,0|2,0,0]=4 63 B17R2.48 OCc1ncc(cn1)C=Cc2ccccc2 AIFCHEM-94596278141 [1,1,0,0,0,0|2,0,0]=4 64 B17R2.192 O=C(Nc1ccccc1)c2ccc(nn2)O AIFCHEM-94577034272 [1,1,0,0,0,0|1,0,1]=4 65 B17R2.207 Cc1ccc(cc1)C=Cc2ccc(cn2)O AIFCHEM-6485164297 [1,1,0,0,0,0|1,0,1]=4 66 B17R2.207 Cc1ccc(cc1)C=Cc2ccc(nn2)N AIFCHEM-6042008548 [1,1,0,0,0,0|1,0,1]=4 67 B17R2.207 Cc1ccc(cn1)C=Cc2ccc(cc2)F AIFCHEM-94594921923 [1,1,0,0,0,0|2,0,0]=4 68 B17R2.207 Oc1ccc(cn1)C=Cc2ccc(cc2)F AIFCHEM-94542528727 [1,1,0,0,0,0|1,0,0]=3 69 B17R2.207 Oc1cnc(cn1)C=Cc2ccc(cc2)F AIFCHEM-6324016679 [1,1,0,0,0,0|2,0,0]=4 70 B17R2.209 CC(=Cc1ccc(nc1)O)c2ccccc2 AIFCHEM-94542526566 [1,1,0,0,0,0|1,0,0]=3 71 B17R2.209 O=C(Nc1ccc(nc1)O)c2ccccc2 AIFCHEM-94565574026 [1,1,0,0,0,0|2,0,0]=4 72 B17R2.215 Cc1ccc(cn1)C=Cc2cccc(c2)F AIFCHEM-6486618047 [1,1,0,0,0,0|2,0,0]=4 73 B17R2.215 Nc1ccc(cn1)C=Cc2cccc(c2)F AIFCHEM-5779694007 [1,1,0,0,0,0|2,0,0]=4 74 B17R2.496 Cc1ccc(cn1)C=Cc2ccccc2C AIFCHEM-6314280251 [1,1,0,0,0,0|2,0,0]=4 75 B17R2.496 Cc1ccc(nn1)C=Cc2ccccc2F AIFCHEM-94569705308 [1,1,0,0,0,0|1,0,1]=4 76 B17R2.496 Nc1ccc(nn1)C=Cc2ccccc2F AIFCHEM-6060119150 [1,1,0,0,0,0|1,0,1]=4 77 B17R2.496 Oc1ccc(cn1)C=Cc2ccccc2F AIFCHEM-94569696860 [1,1,0,0,0,0|1,0,0]=3 78 B17R2.5360 Cc1cc(c(cn1)C=Cc2ccccc2)N AIFCHEM-94568532904 [1,1,0,0,0,0|2,0,0]=4 79 B17R2.5360 Cc1cc(cnc1C=Cc2ccccc2)O AIFCHEM-94568519411 [1,1,0,0,0,0|1,0,1]=4 80 B17R2.5360 Cc1ccc(c(n1)O)C=Cc2ccccc2 AIFCHEM-94596280068 [1,1,0,0,0,0|2,0,0]=4 81 B17R2.5360 Nc1cc(ccc1C=Cc2ccccc2)O AIFCHEM-94568519399 [1,1,0,0,0,0|2,0,0]=4 82 B17R2.5274 O=c1cc[nH]c(c1F)C=Cc2cccnc2 AIFCHEM-6393459825 [1,1,0,0,0,0|2,0,0]=4 83 B17R2.5293 CC(=Cc1cncc(=O)[nH]1)c2ccccc2 AIFCHEM-94522754494 [1,1,0,0,0,0|2,0,0]=4 84 B17R2.5293 CC(=Cc1cncc(c1)N)c2ccccc2 AIFCHEM-94522748450 [1,1,0,0,0,0|2,0,0]=4 85 B17R2.5300 Cc1cncc(c1)C=Cc2cccc(c2)F AIFCHEM-6293593901 [1,1,0,0,0,0|2,0,0]=4 86 B17R2.5300 Nc1cncc(c1)C=Cc2cccc(c2)F AIFCHEM-6195607798 [1,1,0,0,0,0|2,0,0]=4 87 B17R2.5300 Oc1cncc(c1)C=Cc2cccc(c2)F AIFCHEM-6471283784 [1,1,0,0,0,0|1,0,1]=4 88 B17R2.5365 Cc1ncc(cc1C=Cc2ccccc2)N AIFCHEM-94596277007 [1,1,0,0,0,0|2,0,0]=4 89 B17R2.41893 Cc1ccccc1C=Cc2cc(=O)cc[nH]2 AIFCHEM-6295849336 [1,1,0,0,0,0|1,0,0]=3 90 B17R2.41893 Oc1cncc(c1)C=Cc2ccccc2F AIFCHEM-6471310238 [1,1,0,0,0,0|1,0,1]=4 91 B17R2.2600 Cc1nc(sc1C=O)C=Cc2ccccc2 AIFCHEM-6349488164 [0,1,0,0,1,0|2,0,0]=4 92 B17R2.8653 CC(=Cc1[nH]nc(c1C)C)c2ccccc2 AIFCHEM-94522745524 [0,1,0,0,1,0|2,0,0]=4 93 B17R2.18173 Cc1c(n[nH]c1C=Cc2ccccc2)C#N AIFCHEM-94568524092 [0,1,0,0,1,0|2,0,0]=4 94 B19R2.2863 O=Cc1cc(ccc1O)C=CCc2ccccc2 AIFCHEM-6388272042 [0,1,0,0,0,1|2,0,0]=4 95 B19R2.7722 Cc1nc(c(cc1C=CCc2ccccc2)N)O AIFCHEM-94567050836 [0,1,0,0,0,1|2,0,0]=4 96 B19R2.28208 Cc1cc(cnc1CO)C=CCc2ccccc2 AIFCHEM-94567044773 [0,1,0,0,0,1|2,0,0]=4 97 B19R2.2682 COc1ncc(cc1F)C=C(C)c2ccccc2 AIFCHEM-94522743387 [0,2,0,0,0,0|2,0,0]=4 98 B19R2.2679 COc1ncc(cc1F)C=Cc2ccc(cc2)C AIFCHEM-6486066662 [0,2,0,0,0,0|2,0,0]=4 99 B19R2.2679 COc1ncc(cc1N)C=Cc2ccc(cc2)C AIFCHEM-5992445687 [0,2,0,0,0,0|2,0,0]=4 100 B19R2.2679 COc1ncc(cc1N)C=Cc2ccc(cc2)F AIFCHEM-5992443342 [0,2,0,0,0,0|2,0,0]=4 101 B19R2.2679 Cc1cc(cnc1CO)C=Cc2ccc(cc2)F AIFCHEM-6461163533 [0,2,0,0,0,0|2,0,0]=4 102 B19R2.2679 OCc1ncc(cc1F)C=Cc2ccc(cc2)F AIFCHEM-94594911543 [0,2,0,0,0,0|2,0,0]=4 103 B19R2.18959 COc1ncc(cc1F)C=Cc2ccccc2F AIFCHEM-94569695958 [0,2,0,0,0,0|2,0,0]=4 104 B19R2.18959 COc1ncc(cc1N)C=Cc2ccccc2F AIFCHEM-94569707537 [0,2,0,0,0,0|2,0,0]=4 105 B19R2.18959 COc1ncc(cc1O)C=Cc2ccccc2F AIFCHEM-6374084798 [0,2,0,0,0,0|1,0,1]=4 106 B19R2.28207 COc1c[nH]c(cc1=O)C=Cc2cccc(c2)F AIFCHEM-6310962805 [0,2,0,0,0,0|1,0,0]=3 107 B19R2.28207 OCc1ncc(cc1F)C=Cc2cccc(c2)F AIFCHEM-6362031140 [0,2,0,0,0,0|2,0,0]=4 108 B19R2.1025 O=Cc1cc(c(cc1O)F)C=Cc2ccccc2 AIFCHEM-94596280371 [0,2,0,0,0,0|2,0,0]=4 109 B19R2.2847 Cc1ccc(cc1)C=Cc2cnc(c(c2)C=O)N AIFCHEM-5934155446 [0,2,0,0,0,0|2,0,0]=4 110 B19R2.12418 Cc1ncc(cc1C(=O)O)C=Cc2ccccc2 AIFCHEM-6384807367 [0,2,0,0,0,0|2,0,0]=4 111 B19R2.4993 N#Cc1ccc(cc1)C=Cc2cnc(c(c2)O)O AIFCHEM-6421744563 [0,2,0,0,0,0|1,0,1]=4 112 B19R2.12343 Cc1c(cnc(c1N)O)C=Cc2ccc(cc2)F AIFCHEM-94594924046 [0,2,0,0,0,0|2,0,0]=4 113 B19R2.62015 Oc1cc(cnc1O)C=Cc2c(cccc2F)F AIFCHEM-94562169279 [0,2,0,0,0,0|1,0,1]=4 114 B19R2.191497 COc1cccc(c1)C=Cc2cnc(c(c2)O)O AIFCHEM-6452564670 [0,2,0,0,0,0|1,0,1]=4 115 B19R3.429 Cc1c[nH]c(cc1=O)c2c[nH]c3c2cccc3 AIFCHEM-6460902678 [0,0,0,1,0,1|2,0,0]=4 116 B19R3.19268 C(=Cc1cnc2occc2c1)c3ccccc3 AIFCHEM-6317095610 [0,1,0,1,0,0|2,0,0]=4 117 B15R2.283 Cc1nc(c[nH]1)C=Cc2ccccc2 AIFCHEM-94596276049 [1,0,0,0,1,0|2,0,0]=4 118 B17R2.216 Oc1ccc(cc1)C=CCc2ccccc2 AIFCHEM-94567047944 [1,0,0,0,0,1|2,0,0]=4 119 B17R2.5301 Fc1cncc(c1)C=CCc2ccccc2 AIFCHEM-6308343171 [1,0,0,0,0,1|2,0,0]=4