0 B12R1.1703 C/C=C(\C)/c1ccc(cc1N)N AIFCHEM-94584220466 [0,1,0,0,0,0|3,0,0]=4 1 B12R1.1703 C/C=C(\C)/c1ncc(cc1C)O AIFCHEM-94584208856 [0,1,0,0,0,0|3,0,0]=4 2 B12R1.233 CC(=Cc1ccc(cc1C)N)C AIFCHEM-5668076152 [0,0,0,0,0,1|2,0,0]=3 3 B12R1.233 CC(=Cc1cnc(cc1C)C)C AIFCHEM-6470871539 [0,0,0,0,0,1|2,0,0]=3 4 B12R1.233 CC(=O)Nc1ccc(cc1Br)Br AIFCHEM-94544669425 [0,0,0,0,0,1|2,0,0]=3 5 B12R1.233 CC(=O)Nc1ccc(cc1Br)I AIFCHEM-6165339609 [0,0,0,0,0,1|2,0,0]=3 6 B12R1.233 CC(=O)Nc1ccc(cc1C)I AIFCHEM-6211268315 [0,0,0,0,0,1|1,0,0]=2 7 B12R1.233 CC(=O)Nc1ccc(cc1Cl)O AIFCHEM-94588750029 [0,0,0,0,0,1|2,0,0]=3 8 B12R1.233 CC(=O)Nc1ccc(cc1F)Br AIFCHEM-94536063608 [0,0,0,0,0,1|2,0,0]=3 9 B12R1.233 CC(=O)Nc1ccc(cc1F)O AIFCHEM-94576186146 [0,0,0,0,0,1|2,0,0]=3 10 B12R1.233 CC(=O)Nc1ccc(cc1I)Br AIFCHEM-6059213040 [0,0,0,0,0,1|2,0,0]=3 11 B12R1.233 CC(=O)Nc1ccc(cc1O)Cl AIFCHEM-94605351667 [0,0,0,0,0,1|2,0,0]=3 12 B12R1.233 CC(=O)Nc1cnc(nc1Cl)C AIFCHEM-94605348859 [0,0,0,0,0,1|3,0,0]=4 13 B12R1.233 CC(=O)Nc1ncc(cc1F)Br AIFCHEM-94535599263 [0,0,0,0,0,1|3,0,0]=4 14 B11R1.22 C/C=C(\C)/c1ccc(cc1)C AIFCHEM-94584220431 [1,1,0,0,0,0|1,0,0]=3 15 B11R1.22 CCN(C)c1ccc(cc1)C AIFCHEM-94537423659 [1,1,0,0,0,0|2,0,0]=4 16 B11R1.81 CC=Cc1c[nH]c(=O)cc1C AIFCHEM-6340030536 [1,1,0,0,0,0|2,0,0]=4 17 B11R1.81 CC=Cc1ccc(cc1C)C AIFCHEM-94527147474 [1,1,0,0,0,0|0,0,0]=2 18 B11R1.81 CC=Cc1ccc(cc1F)C AIFCHEM-6296674060 [1,1,0,0,0,0|1,0,0]=3 19 B11R1.81 CC=Cc1ccc(cc1F)O AIFCHEM-6364616607 [1,1,0,0,0,0|2,0,0]=4 20 B11R1.81 CC=Cc1ccc(nc1C)C AIFCHEM-6391640801 [1,1,0,0,0,0|1,0,0]=3 21 B11R1.81 CC=Cc1ccc(nc1C)O AIFCHEM-6342978081 [1,1,0,0,0,0|2,0,0]=4 22 B11R1.81 CC=Cc1ccc(nc1N)C AIFCHEM-5671941898 [1,1,0,0,0,0|2,0,0]=4 23 B11R1.81 CC=Cc1ncc(cc1F)C AIFCHEM-6395004856 [1,1,0,0,0,0|2,0,0]=4 24 B11R1.81 CC=Cc1ncc(cc1N)C AIFCHEM-6313178042 [1,1,0,0,0,0|2,0,0]=4 25 B11R1.81 CCNc1ccc(cc1C)Cl AIFCHEM-94537427516 [1,1,0,0,0,0|1,0,1]=4 26 B11R1.81 CCNc1ccc(cc1C)I AIFCHEM-94537414463 [1,1,0,0,0,0|1,0,1]=4 27 B11R1.81 CCNc1ccc(cc1I)C AIFCHEM-94537419831 [1,1,0,0,0,0|1,0,1]=4 28 B11R1.222 C/C=C(\C)/c1ccccc1O AIFCHEM-94584219423 [1,1,0,0,0,0|2,0,0]=4 29 B11R1.225 C/C=C(\C)/c1cc(sc1C)C AIFCHEM-94584217212 [0,1,0,0,1,0|2,0,0]=4 30 B11R1.225 C/C=C(\C)/c1sc(cc1C)C AIFCHEM-94539596697 [0,1,0,0,1,0|2,0,0]=4 31 B13R1.51 C#Cc1cc(ccc1NC(=O)C)Cl AIFCHEM-94535596343 [0,1,0,0,0,1|1,0,1]=4 32 B13R1.51 CC(=Cc1ccc(cc1CO)F)C AIFCHEM-6323844311 [0,1,0,0,0,1|2,0,0]=4 33 B13R1.51 CC(=Cc1ccc(cc1CO)N)C AIFCHEM-6396112265 [0,1,0,0,0,1|2,0,0]=4 34 B13R1.51 CC(=O)Nc1ccc(cc1C#N)Br AIFCHEM-94535596096 [0,1,0,0,0,1|1,0,1]=4 35 B13R1.51 CC(=O)Nc1ccc(cc1C#N)Cl AIFCHEM-94605354540 [0,1,0,0,0,1|1,0,1]=4 36 B13R1.51 CC(=O)Nc1ncc(cc1CO)F AIFCHEM-94535588720 [0,1,0,0,0,1|2,0,0]=4 37 B13R1.51 COc1cc(cnc1NC(=O)C)Br AIFCHEM-5777331689 [0,1,0,0,0,1|2,0,0]=4 38 B13R1.51 COc1nc(ccc1NC(=O)C)C AIFCHEM-5648553749 [0,1,0,0,0,1|1,0,0]=3 39 B13R1.51 CSc1cc(ccc1C=C(C)C)C AIFCHEM-6356939142 [0,1,0,0,0,1|1,0,0]=3 40 B13R1.653 CC(=Cc1ccc(cc1C)C=O)C AIFCHEM-6349792511 [0,1,0,0,0,1|1,0,1]=4 41 B13R1.653 CC(=Cc1ccc(cc1C)CN)C AIFCHEM-6244712306 [0,1,0,0,0,1|1,0,0]=3 42 B13R1.653 CC(=Cc1ccc(cc1F)CO)C AIFCHEM-6218832293 [0,1,0,0,0,1|2,0,0]=4 43 B13R1.653 COc1ccc(c(c1)Br)NC(=O)C AIFCHEM-94605352062 [0,1,0,0,0,1|1,0,0]=3 44 B13R1.653 COc1ccc(c(c1)C)NC(=O)C AIFCHEM-94555828642 [0,1,0,0,0,1|0,0,0]=2 45 B13R1.653 CSc1ccc(c(c1)C)C=C(C)C AIFCHEM-6391590429 [0,1,0,0,0,1|1,0,0]=3 46 B13R1.876 CC(=Cc1cc(c(cc1C)C)N)C AIFCHEM-6271034376 [0,1,0,0,0,1|1,0,0]=3 47 B13R1.876 CC(=Cc1cc(c(cc1C)F)C)C AIFCHEM-6311235041 [0,1,0,0,0,1|2,0,0]=4 48 B13R1.876 CC(=Cc1cc(c(cc1C)F)N)C AIFCHEM-5613826931 [0,1,0,0,0,1|2,0,0]=4 49 B13R1.876 CC(=Cc1cc(c(cc1C)N)F)C AIFCHEM-5874086043 [0,1,0,0,0,1|2,0,0]=4 50 B13R1.876 CC(=Cc1cc(c(cc1F)C)C)C AIFCHEM-6371680790 [0,1,0,0,0,1|2,0,0]=4 51 B13R1.876 CC(=O)Nc1cc(c(cc1Br)Br)F AIFCHEM-94605335321 [0,1,0,0,0,1|2,0,0]=4 52 B13R1.876 CC(=O)Nc1cc(c(cc1Br)C)F AIFCHEM-94535593524 [0,1,0,0,0,1|1,0,0]=3 53 B13R1.876 CC(=O)Nc1cc(c(cc1Br)F)Br AIFCHEM-94535592539 [0,1,0,0,0,1|2,0,0]=4 54 B13R1.876 CC(=O)Nc1cc(c(cc1Br)O)Br AIFCHEM-94605356952 [0,1,0,0,0,1|2,0,0]=4 55 B13R1.876 CC(=O)Nc1cc(c(cc1C)C)Br AIFCHEM-6235944589 [0,1,0,0,0,1|0,0,0]=2 56 B13R1.876 CC(=O)Nc1cc(c(cc1C)F)Br AIFCHEM-94535598199 [0,1,0,0,0,1|1,0,0]=3 57 B13R1.876 CC(=O)Nc1cc(c(cc1F)Br)F AIFCHEM-5801843501 [0,1,0,0,0,1|2,0,0]=4 58 B13R1.876 CC(=O)Nc1cc(c(cc1I)Br)C AIFCHEM-94605346368 [0,1,0,0,0,1|2,0,0]=4 59 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)Br AIFCHEM-94535592321 [0,1,0,0,0,1|1,0,0]=3 60 B13R1.876 CC(=O)Nc1cc(c(cc1I)C)C AIFCHEM-94535589288 [0,1,0,0,0,1|1,0,0]=3 61 B13R1.876 CC(=O)Nc1cc(c(cc1I)Cl)F AIFCHEM-94605339164 [0,1,0,0,0,1|2,0,0]=4 62 B13R1.876 CC(=O)Nc1cc(c(cc1O)Cl)Br AIFCHEM-94535588335 [0,1,0,0,0,1|2,0,0]=4 63 B13R1.876 CC(=O)Nc1cc(c(cc1O)F)F AIFCHEM-94605351671 [0,1,0,0,0,1|2,0,0]=4 64 B13R1.2679 C#CC(=O)Nc1ccc(cc1Br)C AIFCHEM-94525664765 [0,1,0,0,0,1|1,0,1]=4 65 B13R1.2679 CCC(=O)Nc1ccc(cc1Br)C AIFCHEM-94526508691 [0,1,0,0,0,1|1,0,0]=3 66 B13R1.2679 CCC(=O)Nc1ccc(cc1C)I AIFCHEM-94526501606 [0,1,0,0,0,1|1,0,0]=3 67 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)Br AIFCHEM-94526506963 [0,1,0,0,0,1|2,0,0]=4 68 B13R1.2679 CCC(=O)Nc1ccc(cc1Cl)F AIFCHEM-94526504704 [0,1,0,0,0,1|2,0,0]=4 69 B13R1.2679 CCC(=O)Nc1ccc(cc1F)O AIFCHEM-94576189038 [0,1,0,0,0,1|2,0,0]=4 70 B13R1.2679 CCC(=O)Nc1ccc(cc1O)Cl AIFCHEM-94526505891 [0,1,0,0,0,1|2,0,0]=4 71 B13R1.2679 CCC(=O)Nc1ccc(cc1O)F AIFCHEM-94526508230 [0,1,0,0,0,1|2,0,0]=4 72 B13R1.2679 CCC(=O)Nc1cnc(nc1C)C AIFCHEM-94526506665 [0,1,0,0,0,1|2,0,0]=4 73 B13R1.2679 CCC(=O)Nc1ncc(nc1C)C AIFCHEM-94526511836 [0,1,0,0,0,1|2,0,0]=4 74 B13R1.2679 Cc1ccc(c(c1)C)NC(=O)CO AIFCHEM-94585840423 [0,1,0,0,0,1|0,0,0]=2 75 B13R1.2679 Cc1ccc(c(c1)I)NC(=O)CO AIFCHEM-94532681192 [0,1,0,0,0,1|1,0,0]=3 76 B13R1.2679 Cc1ccc(c(n1)C)NC(=O)CO AIFCHEM-94532681687 [0,1,0,0,0,1|1,0,0]=3 77 B13R1.2679 Cc1ncc(c(n1)C)NC(=O)CO AIFCHEM-94532681870 [0,1,0,0,0,1|2,0,0]=4 78 B13R1.2679 O=C(CO)Nc1ccc(cc1Br)F AIFCHEM-94532674084 [0,1,0,0,0,1|2,0,0]=4 79 B13R1.2679 O=C(CO)Nc1ccc(cc1Cl)F AIFCHEM-94532679909 [0,1,0,0,0,1|2,0,0]=4 80 B13R1.2808 CC(=O)Nc1c(cc(cc1Br)C)Br AIFCHEM-94535598844 [0,1,0,0,0,1|1,0,0]=3 81 B13R1.2808 CC(=O)Nc1c(cc(cc1Br)C)C AIFCHEM-5942761152 [0,1,0,0,0,1|0,0,0]=2 82 B13R1.2808 CC(=O)Nc1c(cc(cc1Br)C)F AIFCHEM-5806936385 [0,1,0,0,0,1|1,0,0]=3 83 B13R1.2808 CC(=O)Nc1c(cc(cc1Br)Cl)F AIFCHEM-94535593291 [0,1,0,0,0,1|2,0,0]=4 84 B13R1.2808 CC(=O)Nc1c(cc(cc1C)Cl)C AIFCHEM-5875707264 [0,1,0,0,0,1|1,0,0]=3 85 B13R1.2808 CC(=O)Nc1c(cc(cc1Cl)F)F AIFCHEM-94535595837 [0,1,0,0,0,1|2,0,0]=4 86 B13R1.2808 CC(=O)Nc1c(cc(cc1I)F)F AIFCHEM-94605354458 [0,1,0,0,0,1|2,0,0]=4 87 B13R1.2808 CC(=O)Nc1c(cc(cc1I)I)F AIFCHEM-94535590559 [0,1,0,0,0,1|2,0,0]=4 88 B13R1.2808 CC(=O)Nc1c(cc(cc1O)Br)C AIFCHEM-94535589509 [0,1,0,0,0,1|1,0,0]=3 89 B13R1.3528 CC(=Cc1ccc(c(c1C)C)F)C AIFCHEM-6364371090 [0,1,0,0,0,1|2,0,0]=4 90 B13R1.3528 CC(=Cc1ccc(c(c1C)F)F)C AIFCHEM-6323834065 [0,1,0,0,0,1|2,0,0]=4 91 B13R1.3528 CC(=O)Nc1ccc(c(c1Br)F)F AIFCHEM-94535588683 [0,1,0,0,0,1|2,0,0]=4 92 B13R1.3528 CC(=O)Nc1ccc(c(c1C)Br)F AIFCHEM-94535592731 [0,1,0,0,0,1|1,0,0]=3 93 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)Br AIFCHEM-94605350183 [0,1,0,0,0,1|1,0,0]=3 94 B13R1.3528 CC(=O)Nc1ccc(c(c1C)C)F AIFCHEM-94535592571 [0,1,0,0,0,1|1,0,0]=3 95 B13R1.3528 CC(=O)Nc1ccc(c(c1F)Cl)F AIFCHEM-94605351223 [0,1,0,0,0,1|2,0,0]=4 96 B13R1.3528 CC(=O)Nc1ccc(c(c1F)F)Cl AIFCHEM-94605357042 [0,1,0,0,0,1|2,0,0]=4 97 B13R1.356 CCNc1cc(ccc1C(=O)N)C AIFCHEM-94537421138 [0,2,0,0,0,0|1,0,0]=3 98 B13R1.356 CCNc1cc(ccc1C(=O)N)F AIFCHEM-94537412979 [0,2,0,0,0,0|2,0,0]=4 99 B13R1.2065 C/C=C(\C)/c1ccc(cc1C#N)C AIFCHEM-94584218558 [0,2,0,0,0,0|1,0,1]=4 100 B13R1.2065 C/C=C(\C)/c1ccc(cc1CO)O AIFCHEM-94584216721 [0,2,0,0,0,0|2,0,0]=4 101 B13R1.1807 C/C=C(\C)/c1cc(c(cc1C)C)N AIFCHEM-94584221106 [0,2,0,0,0,0|1,0,0]=3 102 B13R1.1807 C/C=C(\C)/c1cc(c(cc1C)N)F AIFCHEM-94584218479 [0,2,0,0,0,0|2,0,0]=4 103 B13R1.1807 C/C=C(\C)/c1cc(c(cc1C)N)N AIFCHEM-94584209089 [0,2,0,0,0,0|2,0,0]=4 104 B13R1.95 C/C=C(\C)/c1ccc(cc1C)C=O AIFCHEM-94584221910 [0,2,0,0,0,0|1,0,1]=4 105 B13R1.95 C/C=C(\C)/c1ccc(cc1C)NC AIFCHEM-94584222064 [0,2,0,0,0,0|1,0,0]=3 106 B13R1.95 C/C=C(\C)/c1ccc(cc1F)OC AIFCHEM-94584218757 [0,2,0,0,0,0|2,0,0]=4 107 B13R1.95 C/C=C(\C)/c1ccc(cc1O)OC AIFCHEM-94584218405 [0,2,0,0,0,0|2,0,0]=4 108 B13R1.385 CC=Cc1ccc(c(c1)C)C(C)N AIFCHEM-94608824970 [0,2,0,0,0,0|1,0,1]=4 109 B13R1.385 CC=Cc1ccc(c(c1)N)C(=O)N AIFCHEM-5641436662 [0,2,0,0,0,0|2,0,0]=4 110 B13R1.385 CC=Cc1ccc(c(c1)O)C(=O)O AIFCHEM-6333078875 [0,2,0,0,0,0|2,0,0]=4 111 B13R1.385 CCNc1ccc(c(c1)C)N(C)C AIFCHEM-94537419620 [0,2,0,0,0,0|2,0,0]=4 112 B13R1.1808 C/C=C(\C)/c1ccc(c(c1C)N)C AIFCHEM-94584219504 [0,2,0,0,0,0|1,0,0]=3 113 B13R1.1808 C/C=C(\C)/c1ccc(c(c1F)F)C AIFCHEM-94584223627 [0,2,0,0,0,0|2,0,0]=4 114 B13R1.4656 C/C=C(\C)/c1c(cc(cc1F)C)F AIFCHEM-94584214583 [0,2,0,0,0,0|2,0,0]=4 115 B13R1.4656 C/C=C(\C)/c1c(cc(cc1F)C)N AIFCHEM-94584213424 [0,2,0,0,0,0|2,0,0]=4 116 B13R1.4656 C/C=C(\C)/c1c(cc(cc1F)C)O AIFCHEM-94584216236 [0,2,0,0,0,0|2,0,0]=4 117 B11R1.157 CC(=O)Nc1cccc(c1)C AIFCHEM-94605355038 [0,0,1,1,0,0|1,0,1]=4 118 B11R1.20 CC(=O)Nc1ccc(cn1)C AIFCHEM-5874295902 [1,0,0,0,0,1|1,0,0]=3 119 B11R1.20 CC(=O)Nc1cnc(nc1)C AIFCHEM-94535596160 [1,0,0,0,0,1|2,0,0]=4 120 B11R1.86 CC(=O)Nc1ccccc1C AIFCHEM-94578149958 [1,0,0,0,0,1|0,0,0]=2 121 B11R1.86 CC(=O)Nc1ccccc1F AIFCHEM-6022739701 [1,0,0,0,0,1|1,0,0]=3 122 B11R1.86 CC(=O)Nc1ccccc1I AIFCHEM-94605354755 [1,0,0,0,0,1|1,0,0]=3 123 B11R1.86 CC(=O)Nc1ccccc1O AIFCHEM-94605355387 [1,0,0,0,0,1|1,0,0]=3 124 B11R1.86 CC(=O)Nc1ccncc1C AIFCHEM-94535593404 [1,0,0,0,0,1|1,0,0]=3 125 B11R1.86 CC(=O)Nc1cnccc1I AIFCHEM-5844328599 [1,0,0,0,0,1|2,0,0]=4 126 B11R1.86 CC(=O)Nc1cnccc1O AIFCHEM-94605354960 [1,0,0,0,0,1|2,0,0]=4 127 B13R1.164 CC(=O)NCc1ccc(cc1C)Br AIFCHEM-94574541023 [0,0,0,0,0,2|1,0,0]=3 128 B13R1.164 CC(=O)NCc1ccc(cc1C)C AIFCHEM-94605357867 [0,0,0,0,0,2|0,0,0]=2 129 B13R1.164 CC(=O)NCc1ccc(cc1Cl)Cl AIFCHEM-94535599161 [0,0,0,0,0,2|2,0,0]=4 130 B13R1.164 CC(=O)NCc1ccc(cc1F)C AIFCHEM-94535599453 [0,0,0,0,0,2|1,0,0]=3 131 B13R1.164 CC(=O)NCc1ccc(cc1O)Br AIFCHEM-94605348591 [0,0,0,0,0,2|2,0,0]=4 132 B13R1.164 CC(=O)NCc1ccc(cc1O)F AIFCHEM-94535600212 [0,0,0,0,0,2|2,0,0]=4