0 B12R2.24 c1cc2cc(ccc2nc1)N ES5 [0,0,0,0,0,0|2,0,0]=2 1 B12R2.24 c1ccc2c(c1)C=CC(=O)N2 OCH [0,0,0,0,0,0|1,1,0]=2 2 B12R2.24 c1ccc2c(c1)C=CC(=O)O2 COU [0,0,0,0,0,0|1,1,0]=2 3 B12R2.24 c1ccc2c(c1)N=C(CS2)N 4JT [0,0,0,0,0,0|3,0,1]=4 4 B12R2.24 c1ccc2c(c1)cc(cn2)N 4FS [0,0,0,0,0,0|2,0,0]=2 5 B12R2.24 c1ccc2c(c1)ccc(n2)N 2AQ [0,0,0,0,0,0|2,0,0]=2 6 B12R2.24 c1ccc2cc(ccc2c1)O 03V [0,0,0,0,0,0|0,1,0]=1 7 B11R2.20 c1ccc2c(c1)cncn2 QUZ [1,0,0,0,0,0|2,0,0]=3 8 B11R2.20 c1ccc2ccccc2c1 NPY [1,0,0,0,0,0|0,0,0]=1 9 B11R2.20 c1ccc2cnccc2c1 ISQ [1,0,0,0,0,0|1,0,0]=2 10 B11R2.20 c1ccc2cnncc2c1 4FT [1,0,0,0,0,0|2,0,0]=3 11 B13R2.32 CN1c2ccccc2C=CC1=O 12Q [0,1,0,0,0,0|1,1,0]=3 12 B13R2.32 Cc1cnc2ccccc2c1N 7W1 [0,1,0,0,0,0|2,0,0]=3 13 B13R2.32 c1ccc2c(c1)C=CN(C2=S)O HQT [0,1,0,0,0,0|1,1,0]=3 14 B13R2.32 c1ccc2c(c1)C=C[C@@H]([C@@H]2O)O NDH [0,1,0,0,0,0|0,1,2]=4 15 B13R2.32 c1ccc2c(c1)c(c(cn2)Br)N 2NW [0,1,0,0,0,0|2,0,0]=3 16 B13R2.32 c1ccc2c(c1)ccc(c2O)O D1N [0,1,0,0,0,0|0,1,0]=2 17 B13R2.57 C=Nc1ccc2ccccc2c1 N2I [0,1,0,0,0,0|1,0,0]=2 18 B13R2.57 c1ccc2cc(ccc2c1)CO 2NA [0,1,0,0,0,0|0,1,0]=2 19 B13R2.155 c1cc2c(cc1O)OC(=O)C=C2 07L [0,1,0,0,0,0|1,1,0]=3 20 B13R2.162 Cc1ccc2c(c1)C(=O)NC=C2 KUF [0,1,0,0,0,0|2,0,0]=3 21 B13R2.162 Cc1ccc2c(c1)c(ncn2)N CWS [0,1,0,0,0,0|3,0,0]=4 22 B13R2.162 c1cc2c(c(c1)O)OC(=O)C=C2 8CM [0,1,0,0,0,0|1,1,0]=3 23 B13R2.162 c1cc2ccc(nc2c(c1)O)N 0P6 [0,1,0,0,0,0|2,0,0]=3 24 B13R2.328 CC1=CC(=O)Oc2c1cccc2 ZZ1 [0,1,0,0,0,0|1,1,0]=3 25 B13R2.328 CC1=Nc2ccccc2C(=O)N1 MEW [0,1,0,0,0,0|3,0,0]=4 26 B13R2.328 Cc1cc(c2ccccc2n1)N M4A [0,1,0,0,0,0|2,0,0]=3 27 B13R2.328 Cc1cc(nc2c1cccc2)N M5K [0,1,0,0,0,0|2,0,0]=3 28 B13R2.328 Cc1cc(nc2c1cccc2)O AJ2 [0,1,0,0,0,0|1,1,0]=3 29 B13R2.328 c1ccc2c(c1)C(=CC(=O)O2)O 4HC [0,1,0,0,0,0|1,1,0]=3 30 B13R2.328 c1ccc2c(c1)C(=O)NC(=N2)N AQO [0,1,0,0,0,0|3,0,0]=4 31 B13R2.328 c1ccc2c(c1)C(=O)NC(=N2)S D1V [0,1,0,0,0,0|2,0,0]=3 32 B13R2.328 c1ccc2c(c1)c(nc(n2)N)N Q24 [0,1,0,0,0,0|3,0,0]=4 33 B13R2.369 CC1=Cc2ccccc2NC1=O J5I [0,1,0,0,0,0|1,1,0]=3 34 B13R2.369 c1ccc2c(c1)C=C(C(=O)N2)O G3E [0,1,0,0,0,0|1,1,0]=3 35 B13R2.369 c1ccc2c(c1)C=C(C(=O)O2)O SE2 [0,1,0,0,0,0|1,1,0]=3 36 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)O2 3AV [0,1,0,0,0,0|1,1,0]=3 37 B13R2.3683 Cc1ccc2cc(ccc2n1)N MQN [0,1,0,0,0,0|2,0,0]=3 38 B13R2.3683 c1cc2c(cc1Cl)C=CC(=O)N2 0TU [0,1,0,0,0,0|1,1,0]=3 39 B13R2.3683 c1cc2c(cc1N)C=CC(=O)O2 4JQ [0,1,0,0,0,0|1,1,0]=3 40 B13R2.3683 c1cc2c(cc1O)C=CC(=S)O2 FC5 [0,1,0,0,0,0|1,0,1]=3 41 B13R2.5179 Cc1ccc2c(c1)ncnc2N BBW [0,1,0,0,0,0|3,0,0]=4 42 B13R2.5179 c1cc2c(ccnc2cc1Cl)O MRW [0,1,0,0,0,0|2,0,0]=3 43 B13R2.5179 c1cc2cc(ccc2c(c1)O)O DIN [0,1,0,0,0,0|0,1,0]=2 44 B13R2.5179 c1cc2cc(cnc2c(c1)N)O A7W [0,1,0,0,0,0|1,1,0]=3 45 B11R1.91 c1ccc(cc1)/C=C/C(=O)O TCA [0,0,1,0,0,0|1,1,0]=3 46 B11R1.91 c1ccc(cc1)\C=C\C(=O)N DH6 [0,0,1,0,0,0|1,1,0]=3 47 B11R1.91 c1ccc(cc1)\C=C\[N+](=O)[O-] NS8 [0,0,1,0,0,0|2,1,0]=4 48 B11R1.91 c1cnccc1/C=C/C(=O)O XIZ [0,0,1,0,0,0|2,1,0]=4 49 B11R2.1 Cc1c2ccccc2n[nH]1 0RW [0,0,0,0,1,0|3,0,0]=4 50 B11R2.1 c1ccc2c(c1)CCC2=O 1ON [0,0,0,0,1,0|0,1,2]=4 51 B11R2.1 c1ccc2c(c1)c(n[nH]2)N JNZ [0,0,0,0,1,0|3,0,0]=4 52 B11R2.1 c1ccc2c(c1)c(no2)N HLR [0,0,0,0,1,0|3,0,0]=4 53 B11R2.1 c1ccc2c(c1)c[nH]c2N F05 [0,0,0,0,1,0|2,0,0]=3 54 B11R2.10 Cc1cc2ccccc2[nH]1 2MI [0,0,0,0,1,0|2,0,0]=3 55 B11R2.10 c1ccc2c(c1)[nH]c(n2)N AX7 [0,0,0,0,1,0|3,0,0]=4 56 B11R2.10 c1ccc2c(c1)nc(s2)N ABV [0,0,0,0,1,0|3,0,0]=4 57 B11R2.36 Cc1ccc2c(c1)[nH]cn2 5MB [0,0,0,0,1,0|3,0,0]=4 58 B11R2.36 Cc1ccc2c(c1)cc[nH]2 5MI [0,0,0,0,1,0|2,0,0]=3 59 B11R2.36 c1cc(cc2c1cc[nH]2)Br FK1 [0,0,0,0,1,0|2,0,0]=3 60 B11R2.36 c1cc(cc2c1cc[nH]2)O F60 [0,0,0,0,1,0|1,1,0]=3 61 B11R2.36 c1cc2c(cc1Cl)nc[nH]2 ES9 [0,0,0,0,1,0|3,0,0]=4 62 B11R2.36 c1cc2c(cc1I)cn[nH]2 8NY [0,0,0,0,1,0|3,0,0]=4 63 B11R2.36 c1cc2c(cc1N)c[nH]n2 70S [0,0,0,0,1,0|3,0,0]=4 64 B11R2.36 c1cc2c(cc[nH]2)cc1Cl 11S [0,0,0,0,1,0|2,0,0]=3 65 B11R2.36 c1cc2c(cc[nH]2)cc1F 14O [0,0,0,0,1,0|2,0,0]=3 66 B11R2.36 c1cc2c(cc[nH]2)cc1O 5H1 [0,0,0,0,1,0|1,1,0]=3 67 B11R2.36 c1cc2cn[nH]c2cc1N 6AI [0,0,0,0,1,0|3,0,0]=4 68 B11R2.36 c1cc2cn[nH]c2cc1O 2K4 [0,0,0,0,1,0|2,1,0]=4 69 B11R2.36 c1cc2nccn2cc1N 1LY [0,0,0,0,1,0|3,0,0]=4 70 B10R1.17 C=CCNc1ccccc1 NYL [1,0,1,0,0,0|1,0,1]=4 71 B10R1.4 C=CCc1ccccc1O 2LP [1,0,1,0,0,0|1,0,1]=4 72 B12R1.21 c1cc(ccc1/C=C/C(=O)O)O HC4 [0,1,1,0,0,0|1,1,0]=4 73 B12R1.125 c1ccc(c(c1)/C=C/C(=O)O)O 2HC [0,1,1,0,0,0|1,1,0]=4 74 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O 4LV [0,1,1,0,0,0|2,0,0]=4 75 B12R1.43 c1ccc(cc1)/C=C(/C(=O)O)\N 23F [0,1,1,0,0,0|2,0,0]=4 76 B12R1.43 c1ccc(cc1)\C=C(\C(=O)O)/F 4LW [0,1,1,0,0,0|2,0,0]=4 77 B12R2.1081 c1cc2c(cccn2)c(c1)Br 4XH [1,1,0,0,0,0|1,0,0]=3 78 B12R2.1081 c1cc2c(cccn2)c(c1)O 5Q0 [1,1,0,0,0,0|1,0,0]=3 79 B12R2.1081 c1cc2cccnc2c(c1)N Q8A [1,1,0,0,0,0|1,0,0]=3 80 B12R2.1081 c1cc2cccnc2c(c1)O HQY [1,1,0,0,0,0|1,0,0]=3 81 B12R2.1081 c1cc2cnccc2c(c1)N 5IQ [1,1,0,0,0,0|1,0,0]=3 82 B12R2.1081 c1cc2cnccc2c(c1)O 5SG [1,1,0,0,0,0|1,0,0]=3 83 B12R2.1081 c1ccc2c(c1)C(=O)N=CN2 JPZ [1,1,0,0,0,0|2,0,0]=4 84 B12R2.1081 c1ccc2c(c1)C=CNC2=O 4YS [1,1,0,0,0,0|1,0,0]=3 85 B12R2.1081 c1ccc2c(c1)c(ccn2)N 1LM [1,1,0,0,0,0|1,0,0]=3 86 B12R2.1081 c1ccc2c(c1)c(ccn2)O ES1 [1,1,0,0,0,0|1,0,0]=3 87 B12R2.1081 c1ccc2c(c1)c(ncn2)N 1LQ [1,1,0,0,0,0|2,0,0]=4 88 B12R2.1081 c1ccc2c(c1)cccc2Cl 15O [1,1,0,0,0,0|0,0,0]=2 89 B12R2.1081 c1ccc2c(c1)cccc2O 1NP [1,1,0,0,0,0|0,0,0]=2 90 B12R2.1081 c1ccc2c(c1)cccc2S 2XH [1,1,0,0,0,0|0,0,0]=2 91 B12R2.1081 c1ccc2c(c1)ccnc2N 1SQ [1,1,0,0,0,0|1,0,0]=3 92 B12R2.1 c1ccc2c(c1)c(c[nH]2)C=O I3A [0,1,0,0,1,0|1,1,0]=4 93 B12R2.1 c1ccc2c(c1)c(cs2)CN K9S [0,1,0,0,1,0|2,0,0]=4 94 B12R2.1 c1ccc2c(c1)c(cs2)CO 4W1 [0,1,0,0,1,0|1,1,0]=4 95 B12R2.18 c1ccc2c(c1)C(=O)C(=O)N2 ISN [0,1,0,0,1,0|1,1,0]=4 96 B12R2.2028 Cn1cc(c2c1cccc2)O MHD [0,1,0,0,1,0|1,1,0]=4 97 B12R2.2028 c1ccc2c(c1)c([nH]c2N)N 1XN [0,1,0,0,1,0|2,0,0]=4 98 B12R2.32 c1ccc2c(c1)[nH]c(n2)CS 2XO [0,1,0,0,1,0|2,0,0]=4 99 B12R2.44 COc1ccc2c(c1)cc[nH]2 BZ3 [0,1,0,0,1,0|1,1,0]=4 100 B12R2.100 c1c[nH]c2c1cc(c(c2)O)O 3ID [0,1,0,0,1,0|1,1,0]=4 101 B14R2.203 c1ccc2c(c1)ccc(c2C=O)O 7WO [0,2,0,0,0,0|0,1,0]=3 102 B14R2.7724 CC1=CC(=O)N(c2c1cccc2)C ZXZ [0,2,0,0,0,0|1,1,0]=4 103 B14R2.7724 CC1=CC(=O)c2ccccc2C1=O VK3 [0,2,0,0,0,0|1,0,0]=3 104 B14R2.7724 Cc1cc(c2ccccc2c1O)O 17Z [0,2,0,0,0,0|1,0,0]=3 105 B14R2.7724 c1cc2c(cc(c(c2nc1)O)I)Cl CQL [0,2,0,0,0,0|2,0,0]=4 106 B14R2.7724 c1ccc2c(c1)C(=C(OC2=O)Cl)Cl DIC [0,2,0,0,0,0|2,0,0]=4 107 B14R2.7724 c1ccc2c(c1)C(=O)C(=O)NC2=O RXA [0,2,0,0,0,0|1,1,0]=4 108 B14R2.7724 c1ccc2c(c1)C(=O)C=C(C2=O)O NQ [0,2,0,0,0,0|0,1,0]=3 109 B14R2.8188 CC1=C(C(=O)c2ccccc2N1)O HQD [0,2,0,0,0,0|1,1,0]=4 110 B14R2.29369 c1cc2c(c(c1N)I)C=CC(=O)O2 32Y [0,2,0,0,0,0|1,1,0]=4 111 B14R2.781 N=C(/c1ccc2ccccc2c1)\N 2UP [0,2,0,0,0,0|1,0,0]=3 112 B14R2.781 c1ccc2c(c1)cc(cn2)C(=O)O Q3C [0,2,0,0,0,0|1,1,0]=4 113 B14R2.781 c1ccc2c(c1)ccc(n2)C(=O)O QNC [0,2,0,0,0,0|1,1,0]=4 114 B14R2.781 c1ccc2c(c1)ccc(n2)C(=O)O QND [0,2,0,0,0,0|1,1,0]=4 115 B14R2.781 c1ccc2cc(ccc2c1)C(=O)O FIV [0,2,0,0,0,0|0,1,0]=3 116 B14R2.781 c1ccc2cnc(cc2c1)C(=O)O 4K8 [0,2,0,0,0,0|1,1,0]=4 117 B14R2.1019 CCc1cc(c2ccccc2n1)O 6VD [0,2,0,0,0,0|2,0,0]=4 118 B14R2.29365 CC1=CC(=O)Oc2c1ccc(c2)N MCM [0,2,0,0,0,0|1,1,0]=4 119 B14R2.29365 CC1=CC(=O)Oc2c1ccc(c2)O 4MU [0,2,0,0,0,0|1,1,0]=4 120 B14R2.8235 CC1=CC(=O)Nc2c1cc(cc2)Cl MVN [0,2,0,0,0,0|1,1,0]=4 121 B14R2.8235 Cc1cc(nc2c1cc(cc2)N)N OTW [0,2,0,0,0,0|2,0,0]=4 122 B14R2.8235 c1cc2c(cc1Br)C(=CC(=O)O2)O 0FO [0,2,0,0,0,0|1,1,0]=4 123 B14R2.1146 COc1cc(cc2c1cccc2)N L8H [0,2,0,0,0,0|1,0,0]=3 124 B14R2.1073 c1cc(c2ccc(nc2c1)N)CN RP8 [0,2,0,0,0,0|2,0,0]=4 125 B10R2.7 c1cc2c(cc[nH]2)nc1 4JP [1,0,0,0,1,0|2,0,0]=4 126 B10R2.7 c1cc2cc[nH]c2nc1 GVH [1,0,0,0,1,0|2,0,0]=4 127 B10R2.7 c1cc[n+]2cc[nH]c2c1 MPI [1,0,0,0,1,0|2,0,0]=4 128 B10R2.7 c1ccc2c(c1)CC=C2 DEN [1,0,0,0,1,0|0,0,1]=3 129 B10R2.7 c1ccc2c(c1)[nH]cn2 BZI [1,0,0,0,1,0|2,0,0]=4 130 B10R2.7 c1ccc2c(c1)cc[nH]2 IND [1,0,0,0,1,0|1,0,0]=3 131 B10R2.7 c1ccc2c(c1)cco2 BZF [1,0,0,0,1,0|1,0,0]=3 132 B10R2.7 c1ccc2c(c1)cn[nH]2 LZ1 [1,0,0,0,1,0|2,0,0]=4 133 B10R2.7 c1ccc2c(c1)cno2 0R1 [1,0,0,0,1,0|2,0,0]=4 134 B10R2.7 c1ccc2c(c1)ncs2 BOT [1,0,0,0,1,0|2,0,0]=4 135 B12R1.252 c1ccc(cc1)SC=CC(=O)O 4ZD [0,0,1,0,0,1|1,1,0]=4