0 B14R2.781 B(c1cc2ccccc2nc1)(O)O AB26441 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.781 B(c1cc2ccccc2nc1)(O)O PB21802 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.781 B(c1ccc2c(c1)cccn2)(O)O AB13210 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.781 B(c1ccc2ccccc2c1)(O)O AB05352 [0,0,0,0,0,0|2,0,1]=3 4 B14R2.781 B(c1ccc2ccccc2n1)(O)O AB13731 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.781 B(c1ccc2cccnc2c1)(O)O AB63153 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.781 B(c1ccc2ccncc2c1)(O)O PB15965 [0,0,0,0,0,0|3,0,1]=4 7 B14R2.781 B(c1ccc2cnccc2c1)(O)O PB22420 [0,0,0,0,0,0|3,0,1]=4 8 B14R2.781 CC(=O)C1COc2ccccc2O1 MB01186 [0,0,0,0,0,0|2,0,2]=4 9 B14R2.781 CC(=O)c1cc2ccccc2cn1 AB25777 [0,0,0,0,0,0|1,0,0]=1 10 B14R2.781 c1cc(cc2c1ccnc2)C(=O)O MB08772 [0,0,0,0,0,0|2,0,0]=2 11 B14R2.781 c1cc(nc2c1ccnc2)C(=O)O AB64278 [0,0,0,0,0,0|3,0,0]=3 12 B14R2.781 c1cc(nc2c1cncc2)C(=O)O AB04742 [0,0,0,0,0,0|3,0,0]=3 13 B14R2.781 c1cc2c(cc(cn2)C(=O)O)nc1 AB66652 [0,0,0,0,0,0|3,0,0]=3 14 B14R2.781 c1cc2c(cc1C(=O)O)C=CCO2 AB72151 [0,0,0,0,0,0|2,0,1]=3 15 B14R2.781 c1cc2c(cc1C(=O)O)cncn2 PB28286 [0,0,0,0,0,0|3,0,0]=3 16 B14R2.781 c1cc2c(ccc(n2)C(=O)O)nc1 PB30868 [0,0,0,0,0,0|3,0,0]=3 17 B14R2.781 c1cc2cc(cnc2nc1)C(=O)O AB23694 [0,0,0,0,0,0|3,0,0]=3 18 B14R2.781 c1cc2ccc(cc2nc1)C(=O)O MB00424 [0,0,0,0,0,0|2,0,0]=2 19 B14R2.781 c1cc2cnccc2cc1C(=O)O PB31447 [0,0,0,0,0,0|2,0,0]=2 20 B14R2.781 c1cc2cncnc2cc1C(=O)O PB31828 [0,0,0,0,0,0|3,0,0]=3 21 B14R2.781 c1ccc2c(c1)C=C(CO2)C(=O)O AB04721 [0,0,0,0,0,0|2,0,1]=3 22 B14R2.781 c1ccc2c(c1)cc(cn2)C(=N)N AB60891 [0,0,0,0,0,0|3,0,0]=3 23 B14R2.781 c1ccc2c(c1)ccc(n2)C(=O)O AB00802 [0,0,0,0,0,0|2,0,0]=2 24 B14R2.781 c1ccc2c(c1)ncc(n2)C(=O)O CB10089 [0,0,0,0,0,0|3,0,0]=3 25 B14R2.781 c1ccc2cnc(cc2c1)C(=O)O AB02856 [0,0,0,0,0,0|2,0,0]=2 26 B14R2.781 c1cncc2c1cc(nc2)C(=O)O PB22836 [0,0,0,0,0,0|3,0,0]=3 27 B13R2.57 C#Cc1cc2ccccc2nc1 AB13977 [1,0,0,0,0,0|1,0,2]=4 28 B13R2.57 C#Cc1ccc2c(c1)cccn2 AB69164 [1,0,0,0,0,0|1,0,2]=4 29 B13R2.57 C#Cc1ccc2ccccc2n1 AB48506 [1,0,0,0,0,0|1,0,2]=4 30 B13R2.57 CNc1cc2ccccc2nc1 AB60620 [1,0,0,0,0,0|2,0,0]=3 31 B13R2.57 CNc1ccc2ccccc2n1 AB60616 [1,0,0,0,0,0|2,0,0]=3 32 B13R2.57 COc1ccc2cnccc2c1 AB19119 [1,0,0,0,0,0|2,0,0]=3 33 B13R2.57 c1cc(cc2c1ccnc2)C#N MB08768 [1,0,0,0,0,0|2,0,1]=4 34 B13R2.57 c1cc(cc2c1ccnc2)C=O MB03744 [1,0,0,0,0,0|1,0,0]=2 35 B13R2.57 c1cc(cc2c1ccnc2)CO MB09768 [1,0,0,0,0,0|1,0,2]=4 36 B13R2.57 c1cc2c(cc1C=O)nccn2 AB07316 [1,0,0,0,0,0|2,0,0]=3 37 B13R2.57 c1cc2c(ccc(n2)C=O)nc1 AB64522 [1,0,0,0,0,0|2,0,0]=3 38 B13R2.57 c1cc2cc(ccc2nc1)C=O MB01484 [1,0,0,0,0,0|1,0,0]=2 39 B13R2.57 c1cc2cc(ccc2nc1)CO MB02978 [1,0,0,0,0,0|1,0,2]=4 40 B13R2.57 c1cc2cc(ccc2nc1)NN AB28072 [1,0,0,0,0,0|3,0,0]=4 41 B13R2.57 c1cc2cc(cnc2nc1)C=O AB68442 [1,0,0,0,0,0|2,0,0]=3 42 B13R2.57 c1cc2ccc(cc2nc1)C=O AB09099 [1,0,0,0,0,0|1,0,0]=2 43 B13R2.57 c1cc2ccc(nc2nc1)C=O CB10823 [1,0,0,0,0,0|2,0,0]=3 44 B13R2.57 c1cc2cnccc2cc1C#N MB08351 [1,0,0,0,0,0|2,0,1]=4 45 B13R2.57 c1cc2cnccc2cc1C=O MB03742 [1,0,0,0,0,0|1,0,0]=2 46 B13R2.57 c1cc2cnccc2cc1CN MB08771 [1,0,0,0,0,0|2,0,1]=4 47 B13R2.57 c1cc2cnccc2cc1CO MB09755 [1,0,0,0,0,0|1,0,2]=4 48 B13R2.57 c1ccc2c(c1)C=C(CO2)C=O AB09669 [1,0,0,0,0,0|1,0,1]=3 49 B13R2.57 c1ccc2c(c1)cc(cn2)C=O AB00811 [1,0,0,0,0,0|1,0,0]=2 50 B13R2.57 c1ccc2c(c1)cc(cn2)CCl AB14411 [1,0,0,0,0,0|2,0,1]=4 51 B13R2.57 c1ccc2c(c1)cc(cn2)CN AB06242 [1,0,0,0,0,0|2,0,1]=4 52 B13R2.57 c1ccc2c(c1)cc(cn2)CO MB02778 [1,0,0,0,0,0|1,0,2]=4 53 B13R2.57 c1ccc2c(c1)ccc(n2)CCl AB01399 [1,0,0,0,0,0|2,0,1]=4 54 B13R2.57 c1ccc2c(c1)ccc(n2)CN AB12710 [1,0,0,0,0,0|2,0,1]=4 55 B13R2.57 c1ccc2c(c1)cnc(n2)C=O AB60727 [1,0,0,0,0,0|2,0,0]=3 56 B13R2.57 c1ccc2c(c1)ncc(n2)C=O CB10349 [1,0,0,0,0,0|2,0,0]=3 57 B13R2.57 c1ccc2cc(ccc2c1)NN AB17521 [1,0,0,0,0,0|2,0,0]=3 58 B13R2.57 c1ccc2cnc(cc2c1)C=O AB23480 [1,0,0,0,0,0|1,0,0]=2 59 B13R2.57 c1ccc2cnc(cc2c1)CN AB23438 [1,0,0,0,0,0|2,0,1]=4 60 B15R2.627 Cc1c2ccccc2ncc1C(=O)C AB63872 [0,1,0,0,0,0|1,0,0]=2 61 B15R2.627 c1cc2c(c(cnc2nc1)C(=O)O)O AB55275 [0,1,0,0,0,0|3,0,0]=4 62 B15R2.627 c1cc2ccc(c(c2nc1)N)C(=O)O MB06511 [0,1,0,0,0,0|2,0,0]=3 63 B15R2.627 c1ccc2c(c1)c(c(cn2)C(=O)O)O AB06514 [0,1,0,0,0,0|2,0,0]=3 64 B15R2.627 c1ccc2c(c1)c(c(cn2)[N+](=O)[O-])N AB06714 [0,1,0,0,0,0|3,0,0]=4 65 B15R2.627 c1ccc2c(c1)c(c(cn2)[N+](=O)[O-])O AB05908 [0,1,0,0,0,0|3,0,0]=4 66 B15R2.627 c1ccc2c(c1)ccc(c2N)C(=O)O MB09442 [0,1,0,0,0,0|1,0,0]=2 67 B15R2.984 Cc1c(cc2ccccc2n1)C(=O)O AB06377 [0,1,0,0,0,0|2,0,0]=3 68 B15R2.984 c1cc2cc(c(=O)[nH]c2nc1)C(=O)O AB25887 [0,1,0,0,0,0|3,0,0]=4 69 B15R2.984 c1cc2cc(c(nc2nc1)N)C(=O)O AB25879 [0,1,0,0,0,0|3,0,0]=4 70 B15R2.984 c1ccc2=NC(=O)C(C=c2c1)C(=O)O PB12927 [0,1,0,0,0,0|2,0,1]=4 71 B15R2.984 c1ccc2c(c1)cc(c(n2)C(=O)O)N AB68884 [0,1,0,0,0,0|2,0,0]=3 72 B15R2.984 c1ccc2c(c1)nc(c(n2)Cl)C(=O)O AB53808 [0,1,0,0,0,0|3,0,0]=4 73 B15R2.1601 COC(=N)c1cc2ccccc2nc1 AB60996 [0,1,0,0,0,0|2,0,0]=3 74 B15R2.1601 COC(=O)C1=Cc2ccccc2OC1 AB04722 [0,1,0,0,0,0|1,0,1]=3 75 B15R2.1601 COC(=O)c1ccc2c(c1)cncn2 PB17151 [0,1,0,0,0,0|2,0,0]=3 76 B15R2.1601 COC(=O)c1ccc2ccncc2c1 MB09806 [0,1,0,0,0,0|1,0,0]=2 77 B15R2.1601 COC(=O)c1ccc2cnccc2c1 MB09804 [0,1,0,0,0,0|1,0,0]=2 78 B15R2.1601 c1ccc2cc(ccc2c1)C(=O)C=O AB44422 [0,1,0,0,0,0|0,0,1]=2 79 B15R2.4441 CC(C)(c1ccc2ccccc2c1)N AB48737 [0,1,0,0,0,0|1,0,1]=3 80 B15R2.4441 [B-](c1ccc2ccccc2c1)(F)(F)F AB26674 [0,1,0,0,0,0|3,0,0]=4 81 B15R2.4441 c1ccc2c(c1)cc(cn2)S(=O)(=O)Cl AB28633 [0,1,0,0,0,0|3,0,0]=4 82 B15R2.7174 Cc1ccc2c(c1)cc(cn2)C(=O)O AB52359 [0,1,0,0,0,0|2,0,0]=3 83 B15R2.7174 c1cc2c(cc1Br)C=C(CO2)C(=O)O AB16979 [0,1,0,0,0,0|2,0,1]=4 84 B15R2.7174 c1cc2c(cc1Br)cc(cn2)C(=O)O AB45078 [0,1,0,0,0,0|2,0,0]=3 85 B15R2.7174 c1cc2c(cc1Cl)cc(cn2)C(=O)O AB52327 [0,1,0,0,0,0|2,0,0]=3 86 B15R2.7174 c1cc2c(cc1F)cc(cn2)C(=O)O AB45133 [0,1,0,0,0,0|2,0,0]=3 87 B15R2.7180 B(c1ccc2cc(ccc2c1)O)(O)O AB03326 [0,1,0,0,0,0|2,0,1]=4 88 B15R2.7180 Cc1ccc2cc(cnc2c1)C(=O)O AB52449 [0,1,0,0,0,0|2,0,0]=3 89 B15R2.7180 c1cc(cc2c1cc(cn2)C(=O)O)Br AB45080 [0,1,0,0,0,0|2,0,0]=3 90 B15R2.7180 c1cc(cc2c1cc(cn2)C(=O)O)Cl AB45107 [0,1,0,0,0,0|2,0,0]=3 91 B15R2.7180 c1cc(cc2c1cc(cn2)C(=O)O)F AB52424 [0,1,0,0,0,0|2,0,0]=3 92 B15R2.7180 c1cc(nc2c1cc(cc2)Br)C(=O)O AB52745 [0,1,0,0,0,0|2,0,0]=3 93 B15R2.7180 c1cc(nc2c1cc(cc2)Cl)C(=O)O AB52747 [0,1,0,0,0,0|2,0,0]=3 94 B15R2.7180 c1cc(nc2c1cc(cc2)F)C(=O)O AB53376 [0,1,0,0,0,0|2,0,0]=3 95 B15R2.7180 c1cc(nc2c1cc(cc2)O)C(=O)O AB65039 [0,1,0,0,0,0|2,0,0]=3 96 B15R2.7180 c1cc2=NC(=O)CC=c2cc1C(=O)O AB16743 [0,1,0,0,0,0|2,0,1]=4 97 B15R2.13598 Cc1cccc2c1ncc(c2)C(=O)O AB45141 [0,1,0,0,0,0|2,0,0]=3 98 B15R2.13598 c1cc2c(cc[nH]c2=O)cc1[N+](=O)[O-] AB73856 [0,1,0,0,0,0|3,0,0]=4 99 B15R2.13598 c1cc2c(ccnc2Cl)cc1C(=O)O AB70670 [0,1,0,0,0,0|2,0,0]=3 100 B15R2.13598 c1cc2cc(ccc2c(c1)Br)C(=O)O AB43882 [0,1,0,0,0,0|1,0,0]=2 101 B15R2.13598 c1cc2cc(cnc2c(c1)Cl)C(=O)O AB45110 [0,1,0,0,0,0|2,0,0]=3 102 B15R2.13598 c1cc2cc(cnc2c(c1)F)C(=O)O MB09291 [0,1,0,0,0,0|2,0,0]=3 103 B15R2.14951 c1ccc2c(c1)c(=O)[nH]c(n2)C(=O)N AB17517 [0,1,0,0,0,0|3,0,0]=4 104 B15R2.14951 c1ccc2c(c1)c(nc(n2)C(=O)O)Cl AB59123 [0,1,0,0,0,0|3,0,0]=4 105 B15R2.61353 c1cc(cc2c1ccnc2O)[N+](=O)[O-] AB70072 [0,1,0,0,0,0|3,0,0]=4 106 B13R2.72 CC(=O)C1=c2ccccc2=NC1 AB00460 [0,0,0,0,1,0|1,0,1]=3 107 B13R2.72 CC(=O)C1=c2cccnc2=NC1 PB29657 [0,0,0,0,1,0|2,0,1]=4 108 B13R2.72 CC(=O)c1c2ccccn2cn1 AB29014 [0,0,0,0,1,0|2,0,0]=3 109 B13R2.72 CC(=O)n1c2ccccc2cn1 MB14951 [0,0,0,0,1,0|2,0,0]=3 110 B13R2.72 CC(=O)n1c2cccnc2cn1 AB76132 [0,0,0,0,1,0|3,0,0]=4 111 B13R2.72 c1ccc2c(c1)c(co2)C(=O)O AB07951 [0,0,0,0,1,0|2,0,0]=3 112 B13R2.72 c1ccc2c(c1)c(no2)C(=O)O AB26306 [0,0,0,0,1,0|3,0,0]=4 113 B13R2.72 c1ccc2c(c1)c(ns2)C(=O)O AB09662 [0,0,0,0,1,0|3,0,0]=4 114 B13R2.72 c1ccn2c(c1)c(cn2)C(=O)O PB19871 [0,0,0,0,1,0|3,0,0]=4 115 B13R2.72 c1ccn2c(c1)ncc2C(=O)O AB09861 [0,0,0,0,1,0|3,0,0]=4 116 B13R2.72 c1ccn2cnc(c2c1)C(=O)O PB32988 [0,0,0,0,1,0|3,0,0]=4 117 B13R2.430 C1C=C2C=CN=C2C=C1C(=O)O PB12137 [0,0,0,0,1,0|2,0,1]=4 118 B13R2.430 CC(=O)C1=CC2C=NN=C2C=C1 PB13459 [0,0,0,0,1,0|2,0,1]=4 119 B13R2.430 CC(=O)c1ccc2c(c1)N=NC2 PB25444 [0,0,0,0,1,0|2,0,1]=4 120 B13R2.430 CC(=O)c1ccc2nccn2c1 AB56966 [0,0,0,0,1,0|2,0,0]=3 121 B13R2.430 c1cc(cc2c1cco2)C(=O)O MB01639 [0,0,0,0,1,0|2,0,0]=3 122 B13R2.430 c1cc2c(cc1C(=O)O)cno2 AB70277 [0,0,0,0,1,0|3,0,0]=4 123 B13R2.430 c1cc2c(cc1C(=O)O)ncs2 AB29416 [0,0,0,0,1,0|3,0,0]=4 124 B13R2.430 c1cc2c(cc1C(=O)O)scn2 AB03450 [0,0,0,0,1,0|3,0,0]=4 125 B13R2.430 c1cc2c(cco2)cc1C(=O)O MB01638 [0,0,0,0,1,0|2,0,0]=3 126 B13R2.430 c1cc2c(cco2)cc1[N+](=O)[O-] AB06048 [0,0,0,0,1,0|3,0,0]=4 127 B13R2.430 c1cc2c(ccs2)cc1C(=O)O MB03434 [0,0,0,0,1,0|2,0,0]=3 128 B13R2.430 c1cc2nccn2cc1C(=O)O PB10400 [0,0,0,0,1,0|3,0,0]=4 129 B13R2.430 c1cn2ccnc2cc1C(=O)O PB29686 [0,0,0,0,1,0|3,0,0]=4 130 B13R2.430 c1csc2c1ncc(c2)C(=O)O PB25614 [0,0,0,0,1,0|3,0,0]=4 131 B13R2.435 C1=CC2C=C(N=C2C=C1)C(=O)O AB00454 [0,0,0,0,1,0|2,0,1]=4 132 B13R2.435 CC(=O)C1=NC2=C(=C1)C=CC=C2 AB10369 [0,0,0,0,1,0|1,0,1]=3 133 B13R2.435 c1cc2c(cc(s2)C(=O)O)nc1 PB10995 [0,0,0,0,1,0|3,0,0]=4 134 B13R2.435 c1cc2cc(sc2nc1)C(=O)O PB30897 [0,0,0,0,1,0|3,0,0]=4 135 B13R2.435 c1ccc2c(c1)cc(o2)C(=O)O AB00533 [0,0,0,0,1,0|2,0,0]=3 136 B13R2.435 c1ccc2c(c1)nc(o2)C(=O)O AB28059 [0,0,0,0,1,0|3,0,0]=4 137 B13R2.435 c1ccc2c(c1)nc(s2)C(=O)O PB19998 [0,0,0,0,1,0|3,0,0]=4 138 B13R2.435 c1ccn2c(c1)cc(n2)C(=O)N AB19632 [0,0,0,0,1,0|3,0,0]=4 139 B13R2.435 c1ccn2c(c1)cc(n2)C(=O)O AB28488 [0,0,0,0,1,0|3,0,0]=4 140 B13R2.435 c1ccn2cc(cc2c1)C(=O)O AB05495 [0,0,0,0,1,0|2,0,0]=3 141 B13R2.435 c1ccn2cc(nc2c1)C(=O)O AB14484 [0,0,0,0,1,0|3,0,0]=4 142 B12R2.24 Cc1ccc2c(n1)cccn2 PB12466 [2,0,0,0,0,0|2,0,0]=4 143 B12R2.24 Cc1ccc2cccnc2n1 AB17502 [2,0,0,0,0,0|2,0,0]=4 144 B12R2.24 Cc1cnc2ccccc2n1 CB10047 [2,0,0,0,0,0|2,0,0]=4 145 B12R2.24 c1cc(cc2c1ccnc2)Br PB34202 [2,0,0,0,0,0|2,0,0]=4 146 B12R2.24 c1cc(cc2c1ccnc2)Cl MB00648 [2,0,0,0,0,0|2,0,0]=4 147 B12R2.24 c1cc(cc2c1ccnc2)F MB09751 [2,0,0,0,0,0|2,0,0]=4 148 B12R2.24 c1cc(cc2c1ccnc2)I MB09748 [2,0,0,0,0,0|2,0,0]=4 149 B12R2.24 c1cc(cc2c1ccnc2)N MB06457 [2,0,0,0,0,0|2,0,0]=4 150 B12R2.24 c1cc(cc2c1ccnc2)O MB01177 [2,0,0,0,0,0|1,0,1]=4 151 B12R2.24 c1cc2cc(ccc2nc1)Br AB01417 [2,0,0,0,0,0|2,0,0]=4 152 B12R2.24 c1cc2ccc(=O)[nH]c2nc1 PB26329 [2,0,0,0,0,0|2,0,0]=4 153 B12R2.24 c1cc2ccc(cc2nc1)Br AB15717 [2,0,0,0,0,0|2,0,0]=4 154 B12R2.24 c1cc2cnccc2cc1Br PB29336 [2,0,0,0,0,0|2,0,0]=4 155 B12R2.24 c1cc2cnccc2cc1Cl MB08350 [2,0,0,0,0,0|2,0,0]=4 156 B12R2.24 c1cc2cnccc2cc1F MB09677 [2,0,0,0,0,0|2,0,0]=4 157 B12R2.24 c1cc2cnccc2cc1I MB09307 [2,0,0,0,0,0|2,0,0]=4 158 B12R2.24 c1cc2cnccc2cc1N AB19123 [2,0,0,0,0,0|2,0,0]=4 159 B12R2.24 c1cc2cnccc2cc1O AB19117 [2,0,0,0,0,0|1,0,1]=4 160 B12R2.24 c1ccc2c(c1)c[nH]c(=O)n2 MB05981 [2,0,0,0,0,0|2,0,0]=4 161 B12R2.24 c1ccc2c(c1)cc(cn2)Br AB00810 [2,0,0,0,0,0|2,0,0]=4 162 B12R2.24 c1ccc2c(c1)ccc(n2)Br MB01039 [2,0,0,0,0,0|2,0,0]=4 163 B12R2.24 c1ccc2c(c1)ccc(n2)Cl AB00798 [2,0,0,0,0,0|2,0,0]=4 164 B12R2.24 c1ccc2cnc(cc2c1)Br PB12162 [2,0,0,0,0,0|2,0,0]=4 165 B12R2.24 c1ccc2cnc(cc2c1)Cl PB18703 [2,0,0,0,0,0|2,0,0]=4 166 B12R2.24 c1ccc2cnc(cc2c1)N AB03416 [2,0,0,0,0,0|2,0,0]=4 167 B12R2.24 c1ccc2cnc(cc2c1)O PB24595 [2,0,0,0,0,0|1,0,1]=4 168 B14R2.92 c1cc2ccc(c(c2nc1)N)C=O CB11487 [1,1,0,0,0,0|1,0,0]=3 169 B14R2.92 c1ccc2c(c1)c(=O)c(co2)C=O CB10095 [1,1,0,0,0,0|1,0,0]=3 170 B14R2.112 CNCc1cc2ccccc2nc1 AB45811 [1,1,0,0,0,0|1,0,1]=4 171 B14R2.112 CNCc1ccc2c(c1)cccn2 AB28133 [1,1,0,0,0,0|1,0,1]=4 172 B14R2.112 CNCc1ccc2ccccc2n1 AB53825 [1,1,0,0,0,0|1,0,1]=4 173 B14R2.112 c1cc2cc(ccc2nc1)CC=O AB57659 [1,1,0,0,0,0|1,0,0]=3 174 B14R2.112 c1ccc2c(c1)cc(cn2)CC=O AB57656 [1,1,0,0,0,0|1,0,0]=3 175 B14R2.112 c1ccc2c(c1)cc(cn2)CCN AB45411 [1,1,0,0,0,0|1,0,1]=4 176 B14R2.112 c1ccc2c(c1)cc(cn2)N=C=O AB74233 [1,1,0,0,0,0|1,0,1]=4 177 B14R2.112 c1ccc2c(c1)ccc(n2)CC=O AB06466 [1,1,0,0,0,0|1,0,0]=3 178 B14R2.112 c1ccc2c(c1)ccc(n2)CCN AB45414 [1,1,0,0,0,0|1,0,1]=4 179 B14R2.112 c1ccc2cc(ccc2c1)CC=O AB11816 [1,1,0,0,0,0|0,0,0]=2 180 B14R2.112 c1ccc2cc(ccc2c1)CCN AB09173 [1,1,0,0,0,0|0,0,1]=3 181 B14R2.134 CNc1ccc2ccc(cc2n1)Br MB10582 [1,1,0,0,0,0|2,0,0]=4 182 B14R2.134 COc1ccc2c(c1)cc(cn2)Br AB49947 [1,1,0,0,0,0|2,0,0]=4 183 B14R2.134 COc1ccc2c(c1)cc(cn2)N AB42120 [1,1,0,0,0,0|2,0,0]=4 184 B14R2.134 COc1ccc2ccc(=O)[nH]c2c1 MB07766 [1,1,0,0,0,0|2,0,0]=4 185 B14R2.134 COc1ccc2ccc(cc2n1)Br MB10600 [1,1,0,0,0,0|2,0,0]=4 186 B14R2.134 Cc1ccc2ccc(cc2n1)OC AB52428 [1,1,0,0,0,0|2,0,0]=4 187 B14R2.134 c1cc(cc2c1ccc(c2)O)C#N MB06812 [1,1,0,0,0,0|1,0,1]=4 188 B14R2.134 c1cc2c(cc1Br)C=C(CO2)C=O AB09671 [1,1,0,0,0,0|1,0,1]=4 189 B14R2.134 c1cc2c(cc1Br)cc(cn2)C=O AB70021 [1,1,0,0,0,0|1,0,0]=3 190 B14R2.134 c1cc2c(cc1C=O)[nH]c(=O)cn2 MB69331 [1,1,0,0,0,0|2,0,0]=4 191 B14R2.134 c1cc2c(cc1Cl)C=C(CO2)C=O AB09675 [1,1,0,0,0,0|1,0,1]=4 192 B14R2.134 c1cc2c(cc1F)cc(cn2)C=O AB70025 [1,1,0,0,0,0|1,0,0]=3 193 B14R2.142 CCc1ccc2c(c1)c(ccn2)Cl AB52108 [1,1,0,0,0,0|1,0,1]=4 194 B14R2.142 CCc1ccc2c(c1)c(ccn2)N AB52071 [1,1,0,0,0,0|1,0,1]=4 195 B14R2.142 CCc1ccc2c(c1)c(ccn2)O AB11881 [1,1,0,0,0,0|1,0,1]=4 196 B14R2.142 COc1ccc2c(c1)c(ccn2)Br AB45030 [1,1,0,0,0,0|2,0,0]=4 197 B14R2.142 COc1ccc2c(c1)c(ccn2)Cl AB01409 [1,1,0,0,0,0|2,0,0]=4 198 B14R2.142 COc1ccc2c(c1)c(ccn2)N AB06274 [1,1,0,0,0,0|2,0,0]=4 199 B14R2.142 COc1ccc2c(c1)c(ccn2)O AB01174 [1,1,0,0,0,0|2,0,0]=4 200 B14R2.142 COc1ccc2cc[nH]c(=O)c2c1 AB62719 [1,1,0,0,0,0|2,0,0]=4 201 B14R2.142 COc1ccc2cccc(c2c1)Cl AB44054 [1,1,0,0,0,0|1,0,0]=3 202 B14R2.142 COc1ccc2cccc(c2c1)N AB44293 [1,1,0,0,0,0|1,0,0]=3 203 B14R2.142 COc1ccc2cccc(c2n1)Br MB10603 [1,1,0,0,0,0|2,0,0]=4 204 B14R2.142 COc1ccc2ccnc(c2c1)Br AB70051 [1,1,0,0,0,0|2,0,0]=4 205 B14R2.142 COc1ccc2ccnc(c2c1)Cl AB69421 [1,1,0,0,0,0|2,0,0]=4 206 B14R2.142 COc1ccc2ccnc(c2c1)N AB69424 [1,1,0,0,0,0|2,0,0]=4 207 B14R2.142 c1cc(cc2c1ccnc2Cl)C=O AB53309 [1,1,0,0,0,0|1,0,0]=3 208 B14R2.1019 COc1cc2cccnc2c(c1)N CB10417 [1,1,0,0,0,0|2,0,0]=4 209 B14R2.1019 c1ccc2c(c1)c(nc(n2)C=O)Cl AB59122 [1,1,0,0,0,0|2,0,0]=4 210 B14R2.1128 CCc1cc2ccccc2nc1N AB05805 [1,1,0,0,0,0|1,0,1]=4 211 B14R2.1128 c1ccc2c(c1)cc(c(n2)Br)C=O AB59869 [1,1,0,0,0,0|1,0,0]=3 212 B14R2.1128 c1ccc2c(c1)cc(c(n2)C=O)Br AB46109 [1,1,0,0,0,0|1,0,0]=3 213 B14R2.1128 c1ccc2c(c1)cc(c(n2)O)C=O AB11914 [1,1,0,0,0,0|1,0,0]=3 214 B14R2.1128 c1ccc2c(c1)nc(c(n2)Cl)C=O AB60408 [1,1,0,0,0,0|2,0,0]=4 215 B14R2.1801 COc1ccc2c(c1)cccc2Br MB03398 [1,1,0,0,0,0|1,0,0]=3 216 B14R2.1801 COc1ccc2c(c1)ccnc2Br AB70054 [1,1,0,0,0,0|2,0,0]=4 217 B14R2.1801 COc1ccc2c(c1)ccnc2Cl AB27579 [1,1,0,0,0,0|2,0,0]=4 218 B14R2.1801 COc1ccc2c(c1)ccnc2N AB69419 [1,1,0,0,0,0|2,0,0]=4 219 B14R2.1801 COc1ccc2c(c1)ccnc2O AB64610 [1,1,0,0,0,0|2,0,0]=4 220 B14R2.1801 COc1ccc2c(ccnc2c1)Cl PB12379 [1,1,0,0,0,0|2,0,0]=4 221 B14R2.1801 COc1ccc2c(ccnc2c1)N AB43461 [1,1,0,0,0,0|2,0,0]=4 222 B14R2.1801 COc1ccc2c(ccnc2c1)O AB04264 [1,1,0,0,0,0|2,0,0]=4 223 B14R2.1801 COc1ccc2c(n1)cccc2Br MB10596 [1,1,0,0,0,0|2,0,0]=4 224 B14R2.1801 c1cc2c(cc[nH]c2=O)cc1C=O AB65219 [1,1,0,0,0,0|1,0,0]=3 225 B14R2.1801 c1cc2c(ccnc2Cl)cc1C=O AB70668 [1,1,0,0,0,0|1,0,0]=3 226 B14R2.2332 CCc1ccc2c(c1)ccc(n2)C AB45128 [1,1,0,0,0,0|1,0,1]=4 227 B14R2.2332 COc1ccc2c(c1)ccc(n2)Cl AB07225 [1,1,0,0,0,0|2,0,0]=4 228 B14R2.2332 COc1ccc2cc(ccc2c1)Br AB00334 [1,1,0,0,0,0|1,0,0]=3 229 B14R2.2332 COc1ccc2cc(ccc2n1)Br MB10111 [1,1,0,0,0,0|2,0,0]=4 230 B14R2.2332 COc1ccc2cc(cnc2c1)Br MB10604 [1,1,0,0,0,0|2,0,0]=4 231 B14R2.2332 Cc1ccc2cc(cnc2c1)C=O AB57089 [1,1,0,0,0,0|1,0,0]=3 232 B14R2.2332 c1cc(cc2c1cc(cn2)C=O)Br AB70012 [1,1,0,0,0,0|1,0,0]=3 233 B14R2.2332 c1cc(cc2c1cc(cn2)C=O)O AB57090 [1,1,0,0,0,0|1,0,0]=3 234 B14R2.2332 c1cc2c(ccc(n2)Cl)cc1C=O AB43967 [1,1,0,0,0,0|1,0,0]=3 235 B14R2.2332 c1cc2cc(ccc2cc1CO)N AB50496 [1,1,0,0,0,0|0,0,2]=4 236 B14R2.95 C1=CC2C(=NC=C2C(=O)CN)C=C1 AB04255 [0,1,0,0,1,0|1,0,1]=4 237 B14R2.300 c1cc2c(cc1Br)occ2C(=O)O AB77119 [0,1,0,0,1,0|2,0,0]=4 238 B14R2.300 c1cc2c(cc1Cl)occ2C(=O)O AB77118 [0,1,0,0,1,0|2,0,0]=4 239 B14R2.300 c1cc2c(cc1F)occ2C(=O)O AB77115 [0,1,0,0,1,0|2,0,0]=4 240 B14R2.5816 c1cc2c(cc1Br)c(co2)C(=O)O AB76182 [0,1,0,0,1,0|2,0,0]=4 241 B14R2.5816 c1cc2c(cc1F)c(co2)C(=O)O AB76600 [0,1,0,0,1,0|2,0,0]=4 242 B14R2.25733 CC(=O)n1cc(c2c1cccc2)O AB02040 [0,1,0,0,1,0|1,0,0]=3 243 B14R2.601 CC(=O)c1ccc2=NC(=O)N=c2c1 AB45262 [0,1,0,0,1,0|2,0,0]=4 244 B14R2.601 CC(=O)c1ccc2c(c1)cn(n2)C PB20668 [0,1,0,0,1,0|2,0,0]=4 245 B14R2.601 CC(=O)c1ccc2cn(nc2c1)C PB28352 [0,1,0,0,1,0|2,0,0]=4 246 B14R2.966 COC(=O)C1=CC2C=CN=C2C=C1 PB29029 [0,1,0,0,1,0|1,0,1]=4 247 B14R2.966 COC(=O)c1ccc2c(c1)N=CC2 PB18468 [0,1,0,0,1,0|1,0,1]=4 248 B14R2.966 COC(=O)c1ccc2c(c1)ncs2 AB66619 [0,1,0,0,1,0|2,0,0]=4 249 B14R2.966 COC(=O)c1ccc2nccn2c1 PB14429 [0,1,0,0,1,0|2,0,0]=4 250 B14R2.966 COC(=O)c1ccn2ccnc2c1 PB10778 [0,1,0,0,1,0|2,0,0]=4 251 B14R2.972 COC(=O)C1=NC2=C(=C1)C=CC=C2 AB06098 [0,1,0,0,1,0|1,0,1]=4 252 B14R2.972 c1ccc2c(c1)cc(o2)C(=O)C=O AB48663 [0,1,0,0,1,0|1,0,1]=4 253 B14R2.972 c1ccc2c(c1)cc(o2)C(=O)C=O AB51076 [0,1,0,0,1,0|1,0,1]=4 254 B14R2.972 c1ccc2c(c1)cc(s2)C(=O)C=O AB48667 [0,1,0,0,1,0|1,0,1]=4 255 B14R2.4529 Cc1ccc2c(c1)cc(o2)C(=O)O MB02658 [0,1,0,0,1,0|2,0,0]=4 256 B14R2.4529 Cc1ccc2cc(oc2c1)C(=O)O MB05116 [0,1,0,0,1,0|2,0,0]=4 257 B14R2.4529 c1cc(cc2c1cc(o2)C(=O)O)Br MB02552 [0,1,0,0,1,0|2,0,0]=4 258 B14R2.4529 c1cc(cc2c1cc(s2)C(=O)O)Br PB14483 [0,1,0,0,1,0|2,0,0]=4 259 B14R2.4529 c1cc2c(cc1Br)cc(o2)C(=O)O MB00634 [0,1,0,0,1,0|2,0,0]=4 260 B14R2.4529 c1cc2c(cc1Cl)cc(o2)C(=O)O MB00499 [0,1,0,0,1,0|2,0,0]=4 261 B14R2.4529 c1cc2c(cc1F)cc(o2)C(=O)O MB06881 [0,1,0,0,1,0|2,0,0]=4 262 B14R2.7969 CC(=O)n1cc2c(n1)cccc2Br MB69229 [0,1,0,0,1,0|2,0,0]=4 263 B14R2.7969 Cc1cccc2c1oc(c2)C(=O)O MB09960 [0,1,0,0,1,0|2,0,0]=4 264 B14R2.7969 c1cc2c(cc(s2)C(=O)O)c(c1)Br PB18598 [0,1,0,0,1,0|2,0,0]=4 265 B14R2.7969 c1cc2cc(oc2c(c1)Br)C(=O)O MB08955 [0,1,0,0,1,0|2,0,0]=4 266 B14R2.7969 c1cc2cc(sc2c(c1)Br)C(=O)O PB28381 [0,1,0,0,1,0|2,0,0]=4 267 B16R2.5347 CC(CN)Oc1ccc2ccccc2c1 AB38915 [0,1,0,0,0,1|1,0,1]=4 268 B16R2.5347 COC(=O)Cc1ccc2c(n1)cccn2 PB13411 [0,1,0,0,0,1|2,0,0]=4 269 B16R2.6284 c1ccc2cc(ccc2c1)C(C(=O)O)N AB11993 [0,1,0,0,0,1|1,0,0]=3 270 B16R2.6284 c1ccc2cc(ccc2c1)C(C(=O)O)N AB23124 [0,1,0,0,0,1|1,0,0]=3 271 B16R2.6284 c1ccc2cc(ccc2c1)[C@@H](C(=O)O)N AB30494 [0,1,0,0,0,1|1,0,0]=3 272 B16R2.6284 c1ccc2cc(ccc2c1)[C@H](C(=O)O)N AB33270 [0,1,0,0,0,1|1,0,0]=3 273 B16R2.82802 CC(C)(Cc1ccc2ccccc2c1)N AB64209 [0,1,0,0,0,1|1,0,1]=4 274 B16R2.82802 c1ccc2cc(ccc2c1)CS(=O)(=O)Cl AB60378 [0,1,0,0,0,1|2,0,0]=4 275 B16R2.1229 COC(=O)c1ccc2ccccc2c1N MB11654 [0,2,0,0,0,0|0,0,0]=2 276 B16R2.1229 COC(=O)c1ccc2cccnc2c1N MB11656 [0,2,0,0,0,0|1,0,0]=3 277 B16R2.1229 COC(=O)c1ccc2cccnc2c1O AB64390 [0,2,0,0,0,0|1,0,0]=3 278 B16R2.1229 Cc1c2ccccc2ncc1C(=O)OC AB64417 [0,2,0,0,0,0|1,0,0]=3 279 B16R2.12044 Cc1ccc2c(c1)c(c(cn2)C(=O)O)O AB06027 [0,2,0,0,0,0|2,0,0]=4 280 B16R2.12044 c1cc2c(cc1Br)c(c(cn2)C(=O)O)O PB19923 [0,2,0,0,0,0|2,0,0]=4 281 B16R2.12044 c1cc2c(cc1Cl)c(c(cn2)C(=O)O)O AB02612 [0,2,0,0,0,0|2,0,0]=4 282 B16R2.12044 c1cc2c(cc1F)c(c(cn2)C(=O)O)O AB07867 [0,2,0,0,0,0|2,0,0]=4 283 B16R2.22861 Cc1cccc2c1ncc(c2O)C(=O)O AB10500 [0,2,0,0,0,0|2,0,0]=4 284 B16R2.22861 c1cc2c(c(c1)Br)ncc(c2O)C(=O)O AB11431 [0,2,0,0,0,0|2,0,0]=4 285 B16R2.22861 c1cc2c(c(c1)Cl)ncc(c2O)C(=O)O AB07866 [0,2,0,0,0,0|2,0,0]=4 286 B16R2.23372 Cc1c(c(c2ccccc2n1)Cl)C(=O)C AB50478 [0,2,0,0,0,0|1,0,0]=3 287 B16R2.23372 Cc1c(c(c2ccccc2n1)O)C(=O)C AB16228 [0,2,0,0,0,0|1,0,0]=3 288 B16R2.133456 Cc1ccc2c(c1)ncc(c2O)C(=O)O AB49452 [0,2,0,0,0,0|2,0,0]=4 289 B16R2.133456 c1cc2c(cc1F)ncc(c2O)C(=O)O AB52414 [0,2,0,0,0,0|2,0,0]=4 290 B16R2.23520 Cc1c(cc2ccc(cc2n1)Br)C(=O)O AB23690 [0,2,0,0,0,0|2,0,0]=4 291 B16R2.23520 Cc1c(cc2ccc(cc2n1)Cl)C(=O)O AB22507 [0,2,0,0,0,0|2,0,0]=4 292 B16R2.23520 Cc1c(cc2ccc(cc2n1)F)C(=O)O AB23701 [0,2,0,0,0,0|2,0,0]=4 293 B16R2.23520 Cc1ccc2cc(c(nc2c1)C)C(=O)O AB17024 [0,2,0,0,0,0|2,0,0]=4 294 B16R2.23520 c1cc2c(cc1Cl)cc(c(n2)C(=O)O)N AB68885 [0,2,0,0,0,0|2,0,0]=4 295 B16R2.23521 Cc1c(cc2cc(ccc2n1)Br)C(=O)O AB52296 [0,2,0,0,0,0|2,0,0]=4 296 B16R2.23521 Cc1c(cc2cc(ccc2n1)Cl)C(=O)O AB23703 [0,2,0,0,0,0|2,0,0]=4 297 B16R2.23521 Cc1c(cc2cc(ccc2n1)F)C(=O)O AB13077 [0,2,0,0,0,0|2,0,0]=4 298 B16R2.23521 Cc1ccc2c(c1)cc(c(n2)C)C(=O)O AB23668 [0,2,0,0,0,0|2,0,0]=4 299 B16R2.23521 c1cc(cc2c1cc(c(c2)C(=O)O)N)Br MB69037 [0,2,0,0,0,0|1,0,0]=3 300 B16R2.23521 c1cc(cc2c1cc(c(c2)C(=O)O)N)Cl MB69038 [0,2,0,0,0,0|1,0,0]=3 301 B16R2.23521 c1cc2c(cc1Br)cc(c(n2)O)C(=O)O CB10752 [0,2,0,0,0,0|2,0,0]=4 302 B16R2.33941 COC(=O)C1C=c2ccccc2=NC1=O PB34342 [0,2,0,0,0,0|1,0,1]=4 303 B16R2.33941 COC(=O)c1cc2ccccc2nc1Cl PB10336 [0,2,0,0,0,0|1,0,0]=3 304 B16R2.83668 c1ccc2c(c1)cc(c(c2Br)N)C(=O)O MB69040 [0,2,0,0,0,0|1,0,0]=3 305 B16R2.126889 Cc1cccc2c1nc(c(c2)C(=O)O)C AB06373 [0,2,0,0,0,0|2,0,0]=4 306 B16R2.767 CCOC(=O)C1=Cc2ccccc2OC1 AB18604 [0,2,0,0,0,0|1,0,1]=4 307 B16R2.767 c1ccc2cc(ccc2c1)C(CCO)N AB14419 [0,2,0,0,0,0|1,0,1]=4 308 B16R2.1205 COC(=O)C1=Cc2cc(ccc2OC1)Br AB18662 [0,2,0,0,0,0|1,0,1]=4 309 B16R2.1205 COC(=O)C1=Cc2cc(ccc2OC1)Cl AB04729 [0,2,0,0,0,0|1,0,1]=4 310 B16R2.1205 COC(=O)c1ccc2ccc(cc2c1)O MB09816 [0,2,0,0,0,0|0,0,0]=2 311 B16R2.1205 COC(=O)c1ccc2cnc(nc2c1)Cl PB29938 [0,2,0,0,0,0|2,0,0]=4 312 B16R2.1212 COC(=O)c1ccc2c(c1)c(ncn2)Cl PB22407 [0,2,0,0,0,0|2,0,0]=4 313 B16R2.1212 COC(=O)c1ccc2cc[nH]c(=O)c2c1 AB73876 [0,2,0,0,0,0|1,0,0]=3 314 B16R2.1212 COC(=O)c1ccc2ccnc(c2c1)Cl AB73874 [0,2,0,0,0,0|1,0,0]=3 315 B16R2.33799 COC(=O)c1ccc2c(c1)cnc(n2)Cl PB13723 [0,2,0,0,0,0|2,0,0]=4 316 B16R2.33799 COC(=O)c1ccc2cc(ccc2n1)Br MB06124 [0,2,0,0,0,0|1,0,0]=3 317 B16R2.33799 COC(=O)c1ccc2cc(ccc2n1)N MB06122 [0,2,0,0,0,0|1,0,0]=3 318 B16R2.33799 COC(=O)c1ccc2cc(ccc2n1)O PB27188 [0,2,0,0,0,0|1,0,0]=3 319 B16R2.33887 COC(=O)c1cc(=O)c2ccccc2o1 MB01087 [0,2,0,0,0,0|1,0,0]=3 320 B16R2.173132 COC(=O)c1ccc2c(c1)cccc2Br AB44559 [0,2,0,0,0,0|0,0,0]=2 321 B16R2.173132 COC(=O)c1ccc2c(c1)ncnc2Cl PB27921 [0,2,0,0,0,0|2,0,0]=4 322 B16R2.11987 c1cc(cc2c1cc(cc2)Cl)S(=O)(=O)Cl AB16983 [0,2,0,0,0,0|2,0,0]=4 323 B16R2.3885 Cc1cc2cc(cnc2cc1C)C(=O)O AB52272 [0,2,0,0,0,0|2,0,0]=4 324 B16R2.3885 c1c2cc(c(cc2ncc1C(=O)O)Cl)Cl AB52263 [0,2,0,0,0,0|2,0,0]=4 325 B16R2.7476 CCc1ccc2c(c1)cc(cn2)C(=O)O AB52350 [0,2,0,0,0,0|2,0,0]=4 326 B16R2.7476 COc1ccc2c(c1)cc(cn2)C(=O)N AB42147 [0,2,0,0,0,0|2,0,0]=4 327 B16R2.7476 COc1ccc2c(c1)cc(cn2)C(=O)O AB45135 [0,2,0,0,0,0|2,0,0]=4 328 B16R2.26103 Cc1cc(c2c(c1)cc(cn2)C(=O)O)C AB52292 [0,2,0,0,0,0|2,0,0]=4 329 B16R2.26103 Cc1cc(cc2c1ncc(c2)C(=O)O)Cl AB52317 [0,2,0,0,0,0|2,0,0]=4 330 B16R2.133406 Cc1ccc2c(=O)cc(oc2c1)C(=O)O MB01878 [0,2,0,0,0,0|2,0,0]=4 331 B16R2.133406 c1cc2c(=O)cc(oc2cc1Br)C(=O)O MB06503 [0,2,0,0,0,0|2,0,0]=4 332 B16R2.133406 c1cc2c(=O)cc(oc2cc1Cl)C(=O)O MB01526 [0,2,0,0,0,0|2,0,0]=4 333 B16R2.133406 c1cc2c(=O)cc(oc2cc1F)C(=O)O MB10449 [0,2,0,0,0,0|2,0,0]=4 334 B16R2.7486 CCc1ccc2cc(cnc2c1)C(=O)O AB52405 [0,2,0,0,0,0|2,0,0]=4 335 B16R2.7486 COc1ccc2c(c1)ccc(n2)C(=O)O AB45269 [0,2,0,0,0,0|2,0,0]=4 336 B16R2.7486 COc1ccc2cc(cnc2c1)C(=O)O AB52439 [0,2,0,0,0,0|2,0,0]=4 337 B16R2.11989 Cc1c(ccc2c1ncc(c2)C(=O)O)Cl AB52399 [0,2,0,0,0,0|2,0,0]=4 338 B16R2.11989 Cc1ccc2cc(cnc2c1C)C(=O)O AB52369 [0,2,0,0,0,0|2,0,0]=4 339 B16R2.23501 Cc1ccc2c(c1)c(=O)cc(o2)C(=O)O MB01075 [0,2,0,0,0,0|2,0,0]=4 340 B16R2.23501 c1cc2c(cc1Br)c(=O)cc(o2)C(=O)O MB01738 [0,2,0,0,0,0|2,0,0]=4 341 B16R2.23501 c1cc2c(cc1Cl)c(=O)cc(o2)C(=O)O MB01524 [0,2,0,0,0,0|2,0,0]=4 342 B16R2.23501 c1cc2c(cc1F)c(=O)cc(o2)C(=O)O MB02580 [0,2,0,0,0,0|2,0,0]=4 343 B16R2.23501 c1cc2c(cc1N)c(=O)cc(o2)C(=O)O MB06438 [0,2,0,0,0,0|2,0,0]=4 344 B16R2.23501 c1cc2c(cc1O)c(=O)cc(o2)C(=O)O MB10450 [0,2,0,0,0,0|2,0,0]=4 345 B16R2.26112 Cc1cc(c2cc(cnc2c1)C(=O)O)C AB52196 [0,2,0,0,0,0|2,0,0]=4 346 B16R2.26112 c1c(cc(c2c1ncc(c2)C(=O)O)Cl)Cl AB52186 [0,2,0,0,0,0|2,0,0]=4 347 B16R2.24425 Cc1ccc(c2c1cc(cn2)C(=O)O)C AB52216 [0,2,0,0,0,0|2,0,0]=4 348 B16R2.24425 Cc1ccc(c2c1ncc(c2)C(=O)O)Cl AB52243 [0,2,0,0,0,0|2,0,0]=4 349 B16R2.36806 CCc1cccc2c1ncc(c2)C(=O)O AB52484 [0,2,0,0,0,0|2,0,0]=4 350 B16R2.22890 Cc1cccc2c1oc(cc2=O)C(=O)O MB02536 [0,2,0,0,0,0|2,0,0]=4 351 B16R2.22890 c1cc2c(=O)cc(oc2c(c1)Br)C(=O)O MB10465 [0,2,0,0,0,0|2,0,0]=4 352 B16R2.22890 c1cc2c(=O)cc(oc2c(c1)Cl)C(=O)O MB10462 [0,2,0,0,0,0|2,0,0]=4 353 B16R2.22890 c1cc2c(=O)cc(oc2c(c1)F)C(=O)O MB10460 [0,2,0,0,0,0|2,0,0]=4 354 B16R2.22890 c1cc2c(=O)cc(oc2c(c1)O)C(=O)O MB10452 [0,2,0,0,0,0|2,0,0]=4 355 B14R2.768 CC(=O)Nc1cc2ccccc2o1 AB63465 [0,0,1,1,0,0|2,0,0]=4 356 B14R2.31359 CC(=O)c1c2ccccc2ccn1 AB43402 [0,0,1,1,0,0|1,0,0]=3 357 B14R2.31359 c1cc(c2cccnc2c1)C(=O)O AB02057 [0,0,1,1,0,0|2,0,0]=4 358 B14R2.31359 c1cc2ccncc2c(c1)C(=O)O AB28217 [0,0,1,1,0,0|2,0,0]=4 359 B14R2.31359 c1cc2cnccc2c(c1)C(=O)O AB16077 [0,0,1,1,0,0|2,0,0]=4 360 B14R2.31359 c1ccc2c(c1)cccc2C(=N)N AB18265 [0,0,1,1,0,0|2,0,0]=4 361 B14R2.31359 c1ccc2c(c1)cncc2C(=O)O AB03356 [0,0,1,1,0,0|2,0,0]=4 362 B16R3.335 CC1=Cc2ccc3ccccc3c2C1 CB10714 [0,0,0,1,0,1|1,0,0]=3 363 B16R3.335 c1ccc2c(c1)ccc3c2nc(s3)N CB10171 [0,0,0,1,0,1|2,0,0]=4 364 B12R1.75 CC(=O)Nc1ccccc1C=O AB29065 [0,0,1,0,1,0|2,0,0]=4 365 B12R2.1 c1ccc2c(c1)c(co2)C=O MB02776 [1,0,0,0,1,0|1,0,0]=3 366 B12R2.1 c1ccn2c(c1)c(cn2)C=O AB28440 [1,0,0,0,1,0|2,0,0]=4 367 B12R2.1 c1ccn2c(c1)ccc2C=O AB60669 [1,0,0,0,1,0|1,0,0]=3 368 B12R2.1 c1ccn2c(c1)cnc2C=O AB48941 [1,0,0,0,1,0|2,0,0]=4 369 B12R2.1 c1ccn2c(c1)ncc2C=O AB42413 [1,0,0,0,1,0|2,0,0]=4 370 B12R2.1 c1ccn2cnc(c2c1)C=O AB28965 [1,0,0,0,1,0|2,0,0]=4 371 B12R2.1 c1cn2ccncc2c1C=O CB11533 [1,0,0,0,1,0|2,0,0]=4 372 B12R2.32 C1=CC2C=C(N=C2C=C1)C=O AB12824 [1,0,0,0,1,0|1,0,1]=4 373 B12R2.32 c1ccc2c(c1)cc(o2)C=O CB10104 [1,0,0,0,1,0|1,0,0]=3 374 B12R2.32 c1ccc2c(c1)nc(s2)C=O AB06418 [1,0,0,0,1,0|2,0,0]=4 375 B12R2.32 c1ccn2c(c1)cc(n2)C=O AB19635 [1,0,0,0,1,0|2,0,0]=4 376 B12R2.32 c1ccn2cc(cc2c1)C=O AB60664 [1,0,0,0,1,0|1,0,0]=3 377 B12R2.44 C1C=C(C=C2C1=NC=C2)C=O AB10798 [1,0,0,0,1,0|1,0,1]=4 378 B12R2.44 C1C=C2C=CN=C2C=C1C=O AB11369 [1,0,0,0,1,0|1,0,1]=4 379 B12R2.44 c1cc(cc2c1cco2)C=O MB06876 [1,0,0,0,1,0|1,0,0]=3 380 B12R2.44 c1cc2c(cc1C=O)cno2 AB70274 [1,0,0,0,1,0|2,0,0]=4 381 B12R2.44 c1cc2c(cco2)cc1C=O MB02725 [1,0,0,0,1,0|1,0,0]=3 382 B12R2.44 c1cc2c(ccs2)cc1C=O MB03492 [1,0,0,0,1,0|1,0,0]=3 383 B12R2.44 c1cc2nccn2cc1C=O PB22050 [1,0,0,0,1,0|2,0,0]=4 384 B12R2.44 c1cn2ccnc2cc1C=O PB17705 [1,0,0,0,1,0|2,0,0]=4