0 B13R2.3028 CN1c2cc(ccc2CC1=O)N PB27060 [0,0,0,0,0,0|3,0,0]=3 1 B12R2.18 Cn1c2ccccc2nc1Cl AB07066 [1,0,0,0,0,0|2,0,1]=4 2 B12R2.132 Cn1c2cc(ccc2cn1)F MB11451 [1,0,0,0,0,0|3,0,0]=4 3 B12R2.132 Cn1ccc2c1cc(cc2)N AB55988 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.132 c1cc2cnn(c2cc1Cl)O MB69250 [1,0,0,0,0,0|2,1,0]=4 5 B12R2.132 c1cc2cnn(c2cc1F)O MB69253 [1,0,0,0,0,0|2,0,0]=3 6 B12R2.606 Cc1ccc2=NC(=O)N=c2c1 AB07026 [1,0,0,0,0,0|1,0,2]=4 7 B12R2.606 Cc1ccc2c(n1)CC(=O)N2 AB66460 [1,0,0,0,0,0|3,0,0]=4 8 B12R2.606 Cc1ccc2c(n1)NC(=O)C2 AB73881 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.606 c1c(cnc2c1CC(=O)N2)Br PB18779 [1,0,0,0,0,0|2,1,0]=4 10 B12R2.606 c1c(cnc2c1CC(=O)N2)Cl PB30032 [1,0,0,0,0,0|2,1,0]=4 11 B12R2.606 c1c(cnc2c1CC(=O)N2)F PB30039 [1,0,0,0,0,0|2,0,0]=3 12 B12R2.606 c1c(cnc2c1NC(=O)C2)Br PB24075 [1,0,0,0,0,0|2,1,0]=4 13 B12R2.606 c1c(cnc2c1NC(=O)C2)Cl PB21798 [1,0,0,0,0,0|2,1,0]=4 14 B12R2.606 c1c(cnc2c1oc(=O)[nH]2)N AB65779 [1,0,0,0,0,0|3,0,0]=4 15 B12R2.606 c1c2c(cnc1Br)CC(=O)N2 AB71543 [1,0,0,0,0,0|2,1,0]=4 16 B12R2.606 c1c2c(cnc1Br)NC(=O)C2 PB28320 [1,0,0,0,0,0|2,1,0]=4 17 B12R2.606 c1c2c(cnc1Cl)CC(=O)N2 PB16060 [1,0,0,0,0,0|2,1,0]=4 18 B12R2.606 c1c2c(cnc1Cl)NC(=O)C2 PB31570 [1,0,0,0,0,0|2,1,0]=4 19 B12R2.606 c1cc(nc2c1CC(=O)N2)Br AB66483 [1,0,0,0,0,0|2,1,0]=4 20 B12R2.606 c1cc(nc2c1CC(=O)N2)Cl PB25399 [1,0,0,0,0,0|2,1,0]=4 21 B12R2.606 c1cc(nc2c1NC(=O)C2)Br PB10498 [1,0,0,0,0,0|2,1,0]=4 22 B12R2.606 c1cc(nc2c1NC(=O)C2)Cl PB22129 [1,0,0,0,0,0|2,1,0]=4 23 B12R2.606 c1cc2=NC(=O)N=c2cc1Br AB10496 [1,0,0,0,0,0|0,1,2]=4 24 B12R2.606 c1cc2=NC(=O)N=c2cc1F AB21861 [1,0,0,0,0,0|0,0,2]=3 25 B12R2.606 c1cc2=NC(=O)N=c2cc1I AB21858 [1,0,0,0,0,0|0,1,2]=4 26 B12R2.606 c1cc2c(cc1Br)CC(=O)C2 AB42440 [1,0,0,0,0,0|2,1,0]=4 27 B12R2.606 c1cc2c(cc1Br)CC(=O)N2 PB32208 [1,0,0,0,0,0|1,1,0]=3 28 B12R2.606 c1cc2c(cc1Br)NC(=O)C2 PB24760 [1,0,0,0,0,0|1,1,0]=3 29 B12R2.606 c1cc2c(cc1Cl)CC(=O)N2 AB04636 [1,0,0,0,0,0|1,1,0]=3 30 B12R2.606 c1cc2c(cc1Cl)NC(=O)C2 AB04797 [1,0,0,0,0,0|1,1,0]=3 31 B12R2.606 c1cc2c(cc1F)CC(=O)N2 AB11374 [1,0,0,0,0,0|1,0,0]=2 32 B12R2.606 c1cc2c(cc1F)NC(=O)C2 AB02036 [1,0,0,0,0,0|1,0,0]=2 33 B12R2.606 c1cc2c(cc1F)nc(o2)Cl AB65045 [1,0,0,0,0,0|2,0,1]=4 34 B12R2.606 c1cc2c(cc1F)nc(o2)N AB09694 [1,0,0,0,0,0|2,0,1]=4 35 B12R2.606 c1cc2c(cc1F)nc(s2)N MB03574 [1,0,0,0,0,0|2,0,1]=4 36 B12R2.606 c1cc2c(cc1I)CC(=O)N2 MB06441 [1,0,0,0,0,0|1,1,0]=3 37 B12R2.606 c1cc2c(cc1N)CC(=O)N2 PB27577 [1,0,0,0,0,0|2,0,0]=3 38 B12R2.606 c1cc2c(cc1N)NC(=O)C2 PB17556 [1,0,0,0,0,0|2,0,0]=3 39 B12R2.606 c1cc2c(cc1O)NC(=O)C2 AB21813 [1,0,0,0,0,0|2,0,0]=3 40 B14R2.3274 COc1ccc2c(c1)C(=O)C(=O)N2 MB00814 [0,1,0,0,0,0|2,0,1]=4 41 B14R2.4507 c1cc2c(cc1Br)C(C(=O)N2)(F)F AB84733 [0,1,0,0,0,0|2,1,0]=4 42 B14R2.4507 c1cc2c(cc1Cl)C(C(=O)N2)(F)F AB84730 [0,1,0,0,0,0|2,1,0]=4 43 B14R2.4507 c1cc2c(cc1F)C(C(=O)N2)(F)F AB84727 [0,1,0,0,0,0|2,0,0]=3 44 B14R2.4507 c1cc2c(cc1N)C(C(=O)N2)(F)F AB76552 [0,1,0,0,0,0|3,0,0]=4 45 B14R2.8716 Cc1ccc2c(c1)n(c(=O)n2C)C AB08012 [0,1,0,0,0,0|2,0,0]=3 46 B14R2.9184 Cc1cc2c(c(c1)Br)NC(=O)C2=O MB01226 [0,1,0,0,0,0|2,0,1]=4 47 B14R2.9184 c1c(cc(c2c1C(=O)C(=O)N2)F)F AB51119 [0,1,0,0,0,0|1,0,1]=3 48 B14R2.19008 Cc1ccc2c(c1)C(C(=O)N2)CN AB28141 [0,1,0,0,0,0|3,0,0]=4 49 B14R2.19008 c1cc2c(cc1F)C(C(=O)N2)CN AB28145 [0,1,0,0,0,0|2,0,0]=3 50 B12R1.225 c1cc(cc(c1)F)C(C(=O)O)N AB02084 [0,0,1,0,0,0|3,0,0]=4 51 B12R1.225 c1cc(cc(c1)F)C(C(=O)O)N AB24571 [0,0,1,0,0,0|3,0,0]=4 52 B12R1.225 c1cc(cc(c1)F)[C@@H](C(=O)O)N AB05384 [0,0,1,0,0,0|3,0,0]=4 53 B12R1.354 c1cc(c(cc1F)C(=O)C=O)F AB49787 [0,0,1,0,0,0|2,0,1]=4 54 B14R2.4513 Cn1c2cc(ccc2ncc1=O)Br AB56064 [0,0,0,0,0,1|1,1,1]=4 55 B14R2.8235 Cc1nc2ccc(cc2c(n1)O)F AB63026 [0,0,0,0,0,1|2,0,1]=4 56 B14R2.8235 c1cc2c(cc1F)c(=O)oc(=O)[nH]2 AB13979 [0,0,0,0,0,1|1,0,1]=3 57 B14R2.8235 c1cc2c(cc1F)c(nc(n2)O)O CB11607 [0,0,0,0,0,1|1,0,2]=4 58 B14R2.8235 c1cc2c(cc1O)c(=O)oc(=O)[nH]2 AB07204 [0,0,0,0,0,1|2,0,1]=4 59 B14R2.8239 CC1C(=O)Nc2ccc(cc2O1)N AB54532 [0,0,0,0,0,1|3,0,0]=4 60 B11R1.20 c1cc(ccc1CC(=N)N)F AB29082 [1,0,1,0,0,0|2,0,0]=4 61 B11R1.20 c1cc(ccc1CC(=O)O)Br AB00367 [1,0,1,0,0,0|1,1,0]=4 62 B11R1.20 c1cc(ncc1CC(=O)O)F AB55206 [1,0,1,0,0,0|2,0,0]=4 63 B11R1.20 c1cc(ncc1F)CC(=O)O AB55200 [1,0,1,0,0,0|2,0,0]=4 64 B11R1.37 CNc1cc(ccc1C=O)O MB38802 [1,0,1,0,0,0|2,0,0]=4 65 B11R1.37 c1cc(c(cc1F)C#N)C=O MB06069 [1,0,1,0,0,0|2,0,0]=4 66 B11R1.23 c1cc(cc(c1)F)C(=O)C=O AB29976 [1,0,1,0,0,0|1,0,1]=4 67 B11R1.157 CC(=O)Nc1cccc(c1)O AB00216 [1,0,1,0,0,0|2,0,0]=4 68 B11R1.157 Cc1cccc(c1)NC(=O)C AB01179 [1,0,1,0,0,0|2,0,0]=4 69 B11R1.157 c1cc(cc(c1)Br)CC(=O)N AB42612 [1,0,1,0,0,0|1,1,0]=4 70 B11R1.157 c1cc(cc(c1)Cl)NC(=N)N AB43838 [1,0,1,0,0,0|1,1,0]=4 71 B11R1.157 c1cc(cc(c1)F)CC(=N)N AB49997 [1,0,1,0,0,0|2,0,0]=4 72 B11R1.157 c1cc(cc(c1)F)CC(=O)O AB00361 [1,0,1,0,0,0|2,0,0]=4 73 B11R1.167 B(c1cc(ccc1N)F)(O)O AB13713 [1,0,1,0,0,0|1,0,1]=4 74 B11R1.167 c1c(c(cnc1F)N)C(=O)O PB14345 [1,0,1,0,0,0|2,0,0]=4 75 B11R1.167 c1c(cnc(c1C(=O)O)N)F AB70295 [1,0,1,0,0,0|2,0,0]=4 76 B11R1.167 c1cc(c(cc1F)C(=O)O)Br AB03824 [1,0,1,0,0,0|2,0,0]=4 77 B11R1.167 c1cc(c(cc1F)C(=O)O)Cl AB04161 [1,0,1,0,0,0|2,0,0]=4 78 B11R2.10 c1cc2c(nc1)CC(=O)N2 PB29192 [2,0,0,0,0,0|2,0,0]=4 79 B11R2.10 c1cc2c(nc1)NC(=O)C2 PB29419 [2,0,0,0,0,0|2,0,0]=4 80 B11R2.10 c1ccc2c(c1)CC(=O)N2 AB00523 [2,0,0,0,0,0|1,0,0]=3 81 B11R2.10 c1cncc2c1CC(=O)N2 PB19637 [2,0,0,0,0,0|2,0,0]=4 82 B11R2.10 c1cncc2c1NC(=O)C2 PB17659 [2,0,0,0,0,0|2,0,0]=4 83 B11R2.36 c1cc2c(cc1F)NCC2 AB01334 [2,0,0,0,0,0|1,0,1]=4 84 B11R2.36 c1cc2c(cc1F)nco2 AB45629 [2,0,0,0,0,0|1,0,1]=4 85 B11R2.36 c1cc2c(cc1F)ncs2 AB26031 [2,0,0,0,0,0|1,0,1]=4 86 B11R2.36 c1cc2c(cc1F)scn2 AB26019 [2,0,0,0,0,0|1,0,1]=4 87 B11R2.36 c1cc2c(cco2)cc1F AB43937 [2,0,0,0,0,0|2,0,0]=4 88 B13R2.135 c1ccc2c(c1)C(C(=O)N2)CN AB28484 [1,1,0,0,0,0|2,0,0]=4 89 B13R2.359 CC1(c2ccccc2NC1=O)C MB00789 [1,1,0,0,0,0|2,0,0]=4 90 B13R2.359 c1ccc2c(c1)C(C(=O)N2)(F)F AB75832 [1,1,0,0,0,0|2,0,0]=4 91 B13R2.4825 CN1c2cccc(c2CC1=O)Br PB19105 [1,1,0,0,0,0|2,0,0]=4 92 B13R2.4825 c1cc2c(c(c1)Br)NC(=O)C2=O AB07072 [1,1,0,0,0,0|1,0,1]=4 93 B13R2.4825 c1cc2c(c(c1)Cl)NC(=O)C2=O AB01335 [1,1,0,0,0,0|1,0,1]=4 94 B13R2.4825 c1cc2c(c(c1)F)NC(=O)C2=O AB09245 [1,1,0,0,0,0|1,0,1]=4 95 B13R2.4825 c1cc2c(c(c1)I)NC(=O)C2=O MB01744 [1,1,0,0,0,0|1,0,1]=4 96 B13R2.4856 c1cc2c(c(c1)Br)C(=O)C(=O)N2 AB15602 [1,1,0,0,0,0|1,0,1]=4 97 B13R2.4856 c1cc2c(c(c1)I)C(=O)C(=O)N2 MB02863 [1,1,0,0,0,0|1,0,1]=4 98 B13R2.5190 CN1c2ccc(cc2CC1=O)N PB12659 [1,1,0,0,0,0|2,0,0]=4 99 B13R2.5190 c1cc2c(cc1F)NC(=O)C2=O AB15604 [1,1,0,0,0,0|1,0,1]=4 100 B13R2.5190 c1cc2c(cc1I)NC(=O)C2=O MB02172 [1,1,0,0,0,0|1,0,1]=4 101 B13R2.43 c1cc2c(cc1F)nc(o2)C=O AB49178 [1,1,0,0,0,0|1,0,1]=4 102 B13R2.43 c1cc2c(cc1F)oc(n2)C=O AB49187 [1,1,0,0,0,0|1,0,1]=4 103 B13R2.2121 COc1ccc2c(c1)CC(=O)N2 AB10027 [1,1,0,0,0,0|2,0,0]=4 104 B13R2.2121 COc1ccc2c(c1)NC(=O)C2 AB05458 [1,1,0,0,0,0|2,0,0]=4 105 B13R2.2121 c1cc2c(cc1C#N)CC(=O)N2 AB11378 [1,1,0,0,0,0|2,0,0]=4 106 B13R2.2121 c1cc2c(cc1C#N)NC(=O)C2 AB11389 [1,1,0,0,0,0|2,0,0]=4 107 B13R2.3050 c1c(c(c2c(n1)NC(=O)C2)Cl)F PB22656 [1,1,0,0,0,0|2,0,0]=4 108 B13R2.3050 c1cc(c(c2c1NC(=O)C2)Cl)F MB12060 [1,1,0,0,0,0|1,0,0]=3 109 B13R2.3050 c1cc(c(c2c1NC(=O)C2)F)Cl MB69359 [1,1,0,0,0,0|1,1,0]=4 110 B13R2.3050 c1cc(c(c2c1NC(=O)C2)F)F AB17537 [1,1,0,0,0,0|1,0,0]=3 111 B13R2.5397 c1c(cc(c2c1NC(=O)C2)F)F MB01675 [1,1,0,0,0,0|1,0,0]=3 112 B13R2.13083 c1c2c(cc(c1Cl)Cl)NC(=O)C2 PB34325 [1,1,0,0,0,0|1,1,0]=4 113 B13R2.13083 c1c2c(cc(c1Cl)F)NC(=O)C2 MB15007 [1,1,0,0,0,0|1,0,0]=3 114 B13R2.13083 c1c2c(cc(c1F)Cl)NC(=O)C2 PB28055 [1,1,0,0,0,0|1,0,0]=3 115 B15R2.59732 c1c(cc(c2c1c(=O)oc(=O)[nH]2)F)F AB51178 [0,1,0,0,0,1|1,0,1]=4 116 B15R2.13982 CC1(C(=O)Nc2ccc(cc2O1)F)C AB72684 [0,1,0,0,0,1|2,0,0]=4 117 B15R2.14048 c1c2c(c(c(c1F)F)F)C(=O)C(=O)N2 AB51184 [0,2,0,0,0,0|1,0,1]=4 118 B13R2.3683 Cc1ccc2c(c1)OCC(=O)N2 AB12998 [0,0,1,1,0,0|2,0,0]=4 119 B13R2.3683 c1cc2c(cc1Br)OCC(=O)N2 AB42341 [0,0,1,1,0,0|1,1,0]=4 120 B13R2.3683 c1cc2c(cc1Cl)OCC(=O)N2 AB12999 [0,0,1,1,0,0|1,1,0]=4 121 B13R2.3683 c1cc2c(cc1F)OCC(=O)C2 AB56639 [0,0,1,1,0,0|2,0,0]=4 122 B13R2.3683 c1cc2c(cc1F)OCC(=O)N2 AB42343 [0,0,1,1,0,0|1,0,0]=3 123 B13R2.3683 c1cc2c(cc1I)OCC(=O)N2 MB04728 [0,0,1,1,0,0|1,1,0]=4 124 B13R2.3683 c1cc2c(cc1N)OCC(=O)N2 MB02829 [0,0,1,1,0,0|2,0,0]=4 125 B13R2.3683 c1cc2c(cc1O)OCC(=O)N2 MB11352 [0,0,1,1,0,0|2,0,0]=4 126 B11R1.22 CNC(=O)c1ccc(cc1)O MB02709 [0,0,1,0,1,0|2,0,0]=4 127 B11R1.22 c1cc(ccc1C(=O)C=O)F AB09010 [0,0,1,0,1,0|1,0,1]=4 128 B11R1.22 c1cc(ccc1C(=O)CO)F MB02453 [0,0,1,0,1,0|1,0,0]=3 129 B13R2.328 CC1CC(=O)Nc2c1cccc2 MB08925 [1,0,0,0,0,1|2,0,0]=4 130 B13R2.328 CN1CC(=O)Nc2c1cccc2 MB12301 [1,0,0,0,0,1|1,0,0]=3 131 B13R2.369 CC1C(=O)Nc2ccccc2N1 PB10143 [1,0,0,0,0,1|2,0,0]=4 132 B13R2.369 CC1Cc2ccccc2NC1=O MB08929 [1,0,0,0,0,1|2,0,0]=4