0 B12R2.24 c1cc2cc(ccc2nc1)N ES5 [0,0,0,0,0,0|1,0,0]=1 1 B12R2.24 c1ccc2c(c1)C=CC(=O)N2 OCH [0,0,0,0,0,0|3,0,0]=3 2 B12R2.24 c1ccc2c(c1)C=CC(=O)O2 COU [0,0,0,0,0,0|3,0,0]=3 3 B12R2.24 c1ccc2c(c1)cc(cn2)N 4FS [0,0,0,0,0,0|3,0,0]=3 4 B12R2.24 c1ccc2c(c1)ccc(n2)N 2AQ [0,0,0,0,0,0|3,0,0]=3 5 B12R2.24 c1ccc2cc(ccc2c1)O 03V [0,0,0,0,0,0|2,0,0]=2 6 B11R2.20 c1ccc2c(c1)cncn2 QUZ [1,0,0,0,0,0|1,0,0]=2 7 B11R2.20 c1ccc2ccccc2c1 NPY [1,0,0,0,0,0|1,0,0]=2 8 B11R2.20 c1ccc2cnccc2c1 ISQ [1,0,0,0,0,0|2,0,0]=3 9 B11R2.20 c1ccc2cnncc2c1 4FT [1,0,0,0,0,0|3,0,0]=4 10 B13R2.32 CN1c2ccccc2C=CC1=O 12Q [0,1,0,0,0,0|3,0,0]=4 11 B13R2.32 Cc1cnc2ccccc2c1N 7W1 [0,1,0,0,0,0|2,0,0]=3 12 B13R2.32 c1ccc2c(c1)C=CN(C2=S)O HQT [0,1,0,0,0,0|3,0,0]=4 13 B13R2.32 c1ccc2c(c1)c(c(cn2)Br)N 2NW [0,1,0,0,0,0|3,0,0]=4 14 B13R2.32 c1ccc2c(c1)ccc(c2O)O D1N [0,1,0,0,0,0|2,0,0]=3 15 B13R2.57 C=Nc1ccc2ccccc2c1 N2I [0,1,0,0,0,0|1,0,1]=3 16 B13R2.57 c1ccc2cc(ccc2c1)CO 2NA [0,1,0,0,0,0|1,0,0]=2 17 B13R2.155 c1cc2c(cc1O)OC(=O)C=C2 07L [0,1,0,0,0,0|3,0,0]=4 18 B13R2.162 Cc1ccc2c(c1)C(=O)NC=C2 KUF [0,1,0,0,0,0|2,0,0]=3 19 B13R2.162 Cc1ccc2c(c1)c(ncn2)N CWS [0,1,0,0,0,0|1,0,0]=2 20 B13R2.162 c1cc2c(c(c1)O)OC(=O)C=C2 8CM [0,1,0,0,0,0|3,0,0]=4 21 B13R2.162 c1cc2ccc(nc2c(c1)O)N 0P6 [0,1,0,0,0,0|3,0,0]=4 22 B13R2.328 CC1=CC(=O)Oc2c1cccc2 ZZ1 [0,1,0,0,0,0|3,0,0]=4 23 B13R2.328 CC1=Nc2ccccc2C(=O)N1 MEW [0,1,0,0,0,0|3,0,0]=4 24 B13R2.328 Cc1cc(c2ccccc2n1)N M4A [0,1,0,0,0,0|2,0,0]=3 25 B13R2.328 Cc1cc(nc2c1cccc2)N M5K [0,1,0,0,0,0|3,0,0]=4 26 B13R2.328 Cc1cc(nc2c1cccc2)O AJ2 [0,1,0,0,0,0|3,0,0]=4 27 B13R2.328 c1ccc2c(c1)C(=CC(=O)O2)O 4HC [0,1,0,0,0,0|3,0,0]=4 28 B13R2.369 CC1=Cc2ccccc2NC1=O J5I [0,1,0,0,0,0|2,0,0]=3 29 B13R2.369 C[C@@H]1C(=O)Nc2c(cccn2)N1 1JX [0,1,0,0,0,0|2,0,1]=4 30 B13R2.369 c1ccc2c(c1)C=C(C(=O)N2)O G3E [0,1,0,0,0,0|3,0,0]=4 31 B13R2.369 c1ccc2c(c1)C=C(C(=O)O2)O SE2 [0,1,0,0,0,0|3,0,0]=4 32 B13R2.3683 Cc1ccc2c(c1)C=CC(=O)O2 3AV [0,1,0,0,0,0|1,0,0]=2 33 B13R2.3683 Cc1ccc2c(c1)SCC(=O)N2 TGX [0,1,0,0,0,0|1,0,2]=4 34 B13R2.3683 Cc1ccc2cc(ccc2n1)N MQN [0,1,0,0,0,0|1,0,0]=2 35 B13R2.3683 c1cc2c(cc1Cl)C=CC(=O)N2 0TU [0,1,0,0,0,0|1,0,1]=3 36 B13R2.3683 c1cc2c(cc1N)C=CC(=O)O2 4JQ [0,1,0,0,0,0|2,0,0]=3 37 B13R2.3683 c1cc2c(cc1O)C=CC(=S)O2 FC5 [0,1,0,0,0,0|2,0,0]=3 38 B13R2.5179 Cc1ccc2c(c1)ncnc2N BBW [0,1,0,0,0,0|3,0,0]=4 39 B13R2.5179 c1cc2c(ccnc2cc1Cl)O MRW [0,1,0,0,0,0|3,0,0]=4 40 B13R2.5179 c1cc2cc(ccc2c(c1)O)O DIN [0,1,0,0,0,0|2,0,0]=3 41 B13R2.5179 c1cc2cc(cnc2c(c1)N)O A7W [0,1,0,0,0,0|3,0,0]=4 42 B11R1.91 c1ccc(cc1)/C=C/C(=O)O TCA [0,0,1,0,0,0|3,0,0]=4 43 B11R1.91 c1ccc(cc1)\C=C\C(=O)N DH6 [0,0,1,0,0,0|3,0,0]=4 44 B11R2.1 Cc1c2ccccc2n[nH]1 0RW [0,0,0,0,1,0|3,0,0]=4 45 B11R2.1 c1ccc2c(c1)c[nH]c2N F05 [0,0,0,0,1,0|3,0,0]=4 46 B11R2.1 c1cnc2c(n1)c(cs2)N SVN [0,0,0,0,1,0|3,0,0]=4 47 B11R2.10 Cc1cc2ccccc2[nH]1 2MI [0,0,0,0,1,0|2,0,0]=3 48 B11R2.36 Cc1ccc2c(c1)[nH]cn2 5MB [0,0,0,0,1,0|1,0,0]=2 49 B11R2.36 Cc1ccc2c(c1)cc[nH]2 5MI [0,0,0,0,1,0|0,0,1]=2 50 B11R2.36 c1cc(cc2c1cc[nH]2)Br FK1 [0,0,0,0,1,0|2,0,0]=3 51 B11R2.36 c1cc(cc2c1cc[nH]2)O F60 [0,0,0,0,1,0|2,0,0]=3 52 B11R2.36 c1cc2c(cc1Cl)nc[nH]2 ES9 [0,0,0,0,1,0|2,0,1]=4 53 B11R2.36 c1cc2c(cc1I)cn[nH]2 8NY [0,0,0,0,1,0|2,0,1]=4 54 B11R2.36 c1cc2c(cc1N)c[nH]n2 70S [0,0,0,0,1,0|2,0,0]=3 55 B11R2.36 c1cc2c(cc[nH]2)cc1Cl 11S [0,0,0,0,1,0|1,0,1]=3 56 B11R2.36 c1cc2c(cc[nH]2)cc1F 14O [0,0,0,0,1,0|1,0,1]=3 57 B11R2.36 c1cc2c(cc[nH]2)cc1O 5H1 [0,0,0,0,1,0|1,0,1]=3 58 B11R2.36 c1cc2cn[nH]c2cc1N 6AI [0,0,0,0,1,0|3,0,0]=4 59 B11R2.36 c1cc2cn[nH]c2cc1O 2K4 [0,0,0,0,1,0|3,0,0]=4 60 B11R2.36 c1cc2nccn2cc1N 1LY [0,0,0,0,1,0|2,0,0]=3 61 B10R1.17 C=CCNc1ccccc1 NYL [1,0,1,0,0,0|0,0,2]=4 62 B10R1.4 C=CCc1ccccc1O 2LP [1,0,1,0,0,0|1,0,1]=4 63 B12R1.43 C\C(=C/c1ccccc1)\C(=O)O 4LV [0,1,1,0,0,0|2,0,0]=4 64 B12R2.1081 c1cc2c(cccn2)c(c1)Br 4XH [1,1,0,0,0,0|0,0,0]=2 65 B12R2.1081 c1cc2c(cccn2)c(c1)O 5Q0 [1,1,0,0,0,0|0,0,0]=2 66 B12R2.1081 c1cc2cccnc2c(c1)N Q8A [1,1,0,0,0,0|0,0,0]=2 67 B12R2.1081 c1cc2cccnc2c(c1)O HQY [1,1,0,0,0,0|0,0,0]=2 68 B12R2.1081 c1cc2cnccc2c(c1)N 5IQ [1,1,0,0,0,0|2,0,0]=4 69 B12R2.1081 c1cc2cnccc2c(c1)O 5SG [1,1,0,0,0,0|2,0,0]=4 70 B12R2.1081 c1ccc2c(c1)C(=O)N=CN2 JPZ [1,1,0,0,0,0|1,0,1]=4 71 B12R2.1081 c1ccc2c(c1)C=CNC2=O 4YS [1,1,0,0,0,0|2,0,0]=4 72 B12R2.1081 c1ccc2c(c1)c(ccn2)N 1LM [1,1,0,0,0,0|0,0,0]=2 73 B12R2.1081 c1ccc2c(c1)c(ccn2)O ES1 [1,1,0,0,0,0|0,0,0]=2 74 B12R2.1081 c1ccc2c(c1)c(ncn2)N 1LQ [1,1,0,0,0,0|1,0,0]=3 75 B12R2.1081 c1ccc2c(c1)cccc2Cl 15O [1,1,0,0,0,0|1,0,0]=3 76 B12R2.1081 c1ccc2c(c1)cccc2O 1NP [1,1,0,0,0,0|1,0,0]=3 77 B12R2.1081 c1ccc2c(c1)cccc2S 2XH [1,1,0,0,0,0|1,0,0]=3 78 B12R2.1081 c1ccc2c(c1)ccnc2N 1SQ [1,1,0,0,0,0|2,0,0]=4 79 B12R2.1081 c1cncc2c1C(=O)NC=N2 N5J [1,1,0,0,0,0|2,0,0]=4 80 B12R2.1 c1cc2c(c[nH]c2nc1)C#N 42A [0,1,0,0,1,0|1,0,1]=4 81 B12R2.1 c1ccc2c(c1)c(cs2)CN K9S [0,1,0,0,1,0|2,0,0]=4 82 B12R2.1 c1ccc2c(c1)c(cs2)CO 4W1 [0,1,0,0,1,0|2,0,0]=4 83 B12R2.2028 Cn1cc(c2c1cccc2)O MHD [0,1,0,0,1,0|2,0,0]=4 84 B12R2.44 COc1ccc2c(c1)[nH]cn2 5OB [0,1,0,0,1,0|1,0,0]=3 85 B12R2.44 COc1ccc2c(c1)cc[nH]2 BZ3 [0,1,0,0,1,0|0,0,1]=3 86 B12R2.44 c1c[nH]c2c1ncc(c2)CO 1LZ [0,1,0,0,1,0|2,0,0]=4 87 B12R2.82 CN1C=Cc2cc[nH]c2C1=O 67N [0,1,0,0,1,0|2,0,0]=4 88 B12R2.100 Cc1cc2c(cc1C)nc[nH]2 DMD [0,1,0,0,1,0|1,0,0]=3 89 B12R2.100 c1c[nH]c2c1cc(c(c2)O)O 3ID [0,1,0,0,1,0|1,0,1]=4 90 B14R2.203 c1ccc2c(c1)ccc(c2C=O)O 7WO [0,2,0,0,0,0|2,0,0]=4 91 B14R2.7724 CC1=CC(=O)c2ccccc2C1=O VK3 [0,2,0,0,0,0|1,0,0]=3 92 B14R2.7724 Cc1cc(c2ccccc2c1O)O 17Z [0,2,0,0,0,0|1,0,0]=3 93 B14R2.7724 c1ccc2c(c1)C(=O)C=C(C2=O)O NQ [0,2,0,0,0,0|2,0,0]=4 94 B14R2.8188 CC1=C(C(=O)c2ccccc2N1)O HQD [0,2,0,0,0,0|2,0,0]=4 95 B14R2.29369 c1cc2c(c(c1N)I)C=CC(=O)O2 32Y [0,2,0,0,0,0|2,0,0]=4 96 B14R2.142 COc1ccc2c(c1)c(ncn2)N N8Y [0,2,0,0,0,0|1,0,0]=3 97 B14R2.781 N=C(/c1ccc2ccccc2c1)\N 2UP [0,2,0,0,0,0|1,0,1]=4 98 B14R2.781 c1ccc2cc(ccc2c1)C(=O)O FIV [0,2,0,0,0,0|1,0,1]=4 99 B14R2.1019 CCc1cc(c2ccccc2n1)O 6VD [0,2,0,0,0,0|2,0,0]=4 100 B14R2.8235 CC1=CC(=O)Nc2c1cc(cc2)Cl MVN [0,2,0,0,0,0|1,0,1]=4 101 B14R2.8235 Cc1cc(nc2c1cc(cc2)N)N OTW [0,2,0,0,0,0|1,0,0]=3 102 B14R2.8235 c1cc2c(cc1Br)C(=CC(=O)O2)O 0FO [0,2,0,0,0,0|2,0,0]=4 103 B14R2.8235 c1cc2c(cc1N)c(nc(n2)N)N TAQ [0,2,0,0,0,0|2,0,0]=4 104 B14R2.8235 c1cc2c(cc1N)c(nc(n2)N)O DQU [0,2,0,0,0,0|2,0,0]=4 105 B14R2.1146 COc1cc(cc2c1cccc2)N L8H [0,2,0,0,0,0|2,0,0]=4 106 B10R2.7 c1c[nH]c2c1nccn2 36N [1,0,0,0,1,0|2,0,0]=4 107 B10R2.7 c1cc2c(cc[nH]2)nc1 4JP [1,0,0,0,1,0|1,0,0]=3 108 B10R2.7 c1cc2cc[nH]c2nc1 GVH [1,0,0,0,1,0|1,0,0]=3 109 B10R2.7 c1cc[n+]2cc[nH]c2c1 MPI [1,0,0,0,1,0|1,0,1]=4 110 B10R2.7 c1ccc2c(c1)CC=C2 DEN [1,0,0,0,1,0|0,0,1]=3 111 B10R2.7 c1ccc2c(c1)[nH]cn2 BZI [1,0,0,0,1,0|1,0,0]=3 112 B10R2.7 c1ccc2c(c1)[nH]nn2 0CT [1,0,0,0,1,0|2,0,0]=4 113 B10R2.7 c1ccc2c(c1)cc[nH]2 IND [1,0,0,0,1,0|0,0,1]=3 114 B10R2.7 c1ccc2c(c1)cco2 BZF [1,0,0,0,1,0|1,0,0]=3 115 B10R2.7 c1ccc2c(c1)cn[nH]2 LZ1 [1,0,0,0,1,0|1,0,1]=4 116 B10R2.7 c1ccc2c(c1)cno2 0R1 [1,0,0,0,1,0|2,0,0]=4 117 B10R2.7 c1ccc2c(c1)ncs2 BOT [1,0,0,0,1,0|1,0,0]=3