0 B9R1.41 Cc1cc[nH]c1C(=O)O ACT10555 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.41 Cn1ccnc1C(=O)O ACT07511 [0,0,0,0,0,0|2,0,0]=2 2 B9R1.41 Cn1cncc1C(=O)O ACT08098 [0,0,0,0,0,0|2,0,0]=2 3 B8R1.7 C1C=C[C@H](N1)C(=O)O ACT02240 [1,0,0,0,0,0|1,0,2]=4 4 B8R1.7 CC(=O)c1c[nH]nc1 ACT09404 [1,0,0,0,0,0|3,0,0]=4 5 B8R1.7 CC(=O)c1ccc[nH]1 ACT06589 [1,0,0,0,0,0|0,0,0]=1 6 B8R1.7 CC(=O)c1ccco1 ACT06495 [1,0,0,0,0,0|1,0,0]=2 7 B8R1.7 CC(=O)c1cccs1 ACT06591 [1,0,0,0,0,0|1,0,0]=2 8 B8R1.7 CC(=O)c1cnns1 ACT08408 [1,0,0,0,0,0|3,0,0]=4 9 B8R1.7 CC(=O)n1ccnc1 ACT07679 [1,0,0,0,0,0|3,0,0]=4 10 B8R1.7 c1c[nH]cc1C(=O)O ACT03128 [1,0,0,0,0,0|3,0,0]=4 11 B8R1.7 c1csc(n1)C(=O)O ACT11265 [1,0,0,0,0,0|2,0,1]=4 12 B8R1.11 Cn1ccnc1CO ACT04493 [1,0,0,0,0,0|1,0,2]=4 13 B10R1.59 Cc1cc(c(o1)C)C(=O)C ACT06514 [0,1,0,0,0,0|2,0,0]=3 14 B10R1.59 Cn1c(cc(n1)Cl)C(=O)O ACT09119 [0,1,0,0,0,0|2,0,0]=3 15 B10R1.61 CC(=O)c1ccccc1Cl ACT06884 [0,0,0,0,0,1|2,0,0]=3 16 B10R1.61 CC(=O)c1ccccc1F ACT10960 [0,0,0,0,0,1|2,0,0]=3 17 B10R1.61 CC(=O)c1ccccc1N ACT05476 [0,0,0,0,0,1|2,0,0]=3 18 B10R1.61 CC(=O)c1ccccc1O ACT05307 [0,0,0,0,0,1|2,0,0]=3 19 B10R1.61 CC(=O)c1cccnc1Cl ACT09849 [0,0,0,0,0,1|2,0,0]=3 20 B10R1.61 Cc1c(cccn1)C(=O)O ACT02414 [0,0,0,0,0,1|2,0,0]=3 21 B10R1.61 Cc1ccccc1C(=O)C ACT07828 [0,0,0,0,0,1|1,0,0]=2 22 B10R1.61 Cc1cccnc1[N+](=O)[O-] ACT04445 [0,0,0,0,0,1|3,0,0]=4 23 B10R1.61 Cc1ccncc1[N+](=O)[O-] ACT01361 [0,0,0,0,0,1|3,0,0]=4 24 B10R1.61 Cc1cnccc1[N+](=O)[O-] ACT04433 [0,0,0,0,0,1|3,0,0]=4 25 B10R1.61 c1cc(c(nc1)Br)C(=O)O ACT02431 [0,0,0,0,0,1|3,0,0]=4 26 B10R1.61 c1cc(c(nc1)C(=O)O)Cl ACT01564 [0,0,0,0,0,1|3,0,0]=4 27 B10R1.61 c1cc(c(nc1)C(=O)O)N ACT11742 [0,0,0,0,0,1|3,0,0]=4 28 B10R1.61 c1cc(c(nc1)Cl)C(=O)O ACT11057 [0,0,0,0,0,1|3,0,0]=4 29 B10R1.61 c1cc(c(nc1)F)C(=O)O ACT05346 [0,0,0,0,0,1|3,0,0]=4 30 B10R1.61 c1cc(c(nc1)N)C(=O)O ACT02423 [0,0,0,0,0,1|3,0,0]=4 31 B10R1.61 c1cc(c(nc1)O)C(=O)O ACT06968 [0,0,0,0,0,1|3,0,0]=4 32 B10R1.61 c1cc(c(nc1)S)C(=O)O ACT06873 [0,0,0,0,0,1|3,0,0]=4 33 B10R1.61 c1ccc(c(c1)C(=O)Cl)Br ACT05471 [0,0,0,0,0,1|3,0,0]=4 34 B10R1.61 c1ccc(c(c1)C(=O)O)I ACT05424 [0,0,0,0,0,1|3,0,0]=4 35 B10R1.61 c1cncc(c1C(=O)O)Cl ACT08980 [0,0,0,0,0,1|3,0,0]=4 36 B10R1.61 c1cncc(c1C(=O)O)F ACT11218 [0,0,0,0,0,1|3,0,0]=4 37 B10R1.61 c1cncc(c1C(=O)O)N ACT04453 [0,0,0,0,0,1|3,0,0]=4 38 B10R1.61 c1cncc(c1C(=O)O)N ACT11233 [0,0,0,0,0,1|3,0,0]=4 39 B10R1.61 c1cncc(c1C(=O)O)O ACT01569 [0,0,0,0,0,1|3,0,0]=4 40 B10R1.61 c1cncc(c1Cl)C(=O)O ACT02401 [0,0,0,0,0,1|3,0,0]=4 41 B10R1.61 c1cncc(c1N)C(=O)O ACT02435 [0,0,0,0,0,1|3,0,0]=4 42 B10R1.61 c1cncc(c1O)C(=O)O ACT07024 [0,0,0,0,0,1|3,0,0]=4 43 B10R1.113 CC(=O)c1cc(cnc1)Br ACT09658 [0,0,0,0,0,1|3,0,0]=4 44 B10R1.113 CC(=O)c1cccc(c1)F ACT04233 [0,0,0,0,0,1|2,0,0]=3 45 B10R1.113 CC(=O)c1cccc(n1)Br ACT09764 [0,0,0,0,0,1|2,0,0]=3 46 B10R1.113 Cc1cccc(n1)C(=O)O ACT04484 [0,0,0,0,0,1|2,0,0]=3 47 B10R1.113 Cc1ccnc(c1)C(=O)C ACT09887 [0,0,0,0,0,1|2,0,0]=3 48 B10R1.113 c1cc(cc(c1)I)C(=O)O ACT00798 [0,0,0,0,0,1|3,0,0]=4 49 B10R1.113 c1cc(cc(c1)O)C(=O)O ACT11902 [0,0,0,0,0,1|3,0,0]=4 50 B10R1.113 c1cc(nc(c1)Br)C(=O)O ACT01377 [0,0,0,0,0,1|3,0,0]=4 51 B10R1.113 c1cc(nc(c1)Cl)C(=O)O ACT04538 [0,0,0,0,0,1|3,0,0]=4 52 B7R0.1 CCC=CC=CC=O ACT06050 [1,0,1,0,0,0|1,0,0]=3 53 B7R1.1 CCc1ccco1 ACT06582 [2,0,0,0,0,0|1,0,1]=4 54 B7R1.1 COc1cccs1 ACT11607 [2,0,0,0,0,0|2,0,0]=4 55 B7R1.1 c1c(nc[nH]1)C=O ACT02030 [2,0,0,0,0,0|1,0,1]=4 56 B7R1.1 c1cc([nH]c1)C=O ACT05084 [2,0,0,0,0,0|0,0,0]=2 57 B7R1.1 c1cscc1C=O ACT02286 [2,0,0,0,0,0|2,0,0]=4 58 B7R1.4 Cc1ccnn1C ACT04243 [2,0,0,0,0,0|1,0,0]=3 59 B9R1.11 COC(=O)c1cc[nH]c1 ACT01694 [1,1,0,0,0,0|2,0,0]=4 60 B9R1.11 COC(=O)c1cscn1 ACT08439 [1,1,0,0,0,0|1,0,1]=4 61 B9R1.11 COC(=O)c1nccs1 ACT11267 [1,1,0,0,0,0|1,0,1]=4 62 B9R1.35 CC(=O)c1ccc(s1)Br ACT09817 [1,1,0,0,0,0|1,0,0]=3 63 B9R1.35 Cc1cc([nH]c1)C(=O)O ACT09177 [1,1,0,0,0,0|1,0,0]=3 64 B9R1.35 Cc1ccc(o1)C(=O)C ACT06497 [1,1,0,0,0,0|1,0,0]=3 65 B9R1.35 c1c(nc([nH]1)C(=O)O)N ACT07266 [1,1,0,0,0,0|2,0,0]=4 66 B9R1.35 c1cc(oc1C(=O)O)Br ACT11324 [1,1,0,0,0,0|2,0,0]=4 67 B11R1.53 CCc1ccccc1C(=O)O ACT08461 [0,1,0,0,0,1|2,0,0]=4 68 B11R1.53 COc1cnccc1C(=O)O ACT01562 [0,1,0,0,0,1|2,0,0]=4 69 B11R1.159 Cc1c(cccc1F)C(=O)O ACT11807 [0,1,0,0,0,1|2,0,0]=4 70 B11R1.166 CC(=O)c1ccc(cc1F)O ACT00564 [0,1,0,0,0,1|2,0,0]=4 71 B11R1.166 Cc1cc(cnc1C(=O)O)Br ACT11061 [0,1,0,0,0,1|2,0,0]=4 72 B11R1.167 CC(=O)c1cc(ccc1O)Br ACT06775 [0,1,0,0,0,1|2,0,0]=4 73 B11R1.167 CC(=O)c1cc(ccc1O)F ACT08250 [0,1,0,0,0,1|2,0,0]=4 74 B11R1.167 CC(=O)c1cc(cnc1F)Br ACT07318 [0,1,0,0,0,1|2,0,0]=4 75 B11R1.222 CCC(=O)c1ccccc1Cl ACT09952 [0,1,0,0,0,1|2,0,0]=4 76 B11R1.222 COC(=O)c1ccccc1I ACT05425 [0,1,0,0,0,1|2,0,0]=4 77 B11R1.222 COC(=O)c1cccnc1N ACT04509 [0,1,0,0,0,1|2,0,0]=4 78 B11R1.222 COC(=O)c1ccncc1I ACT11933 [0,1,0,0,0,1|2,0,0]=4 79 B11R1.222 COC(=O)c1ccncc1N ACT02409 [0,1,0,0,0,1|2,0,0]=4 80 B11R1.222 COC(=O)c1ccncc1O ACT11741 [0,1,0,0,0,1|2,0,0]=4 81 B11R1.222 COC(=O)c1cnccc1O ACT06909 [0,1,0,0,0,1|2,0,0]=4 82 B11R1.222 Cc1ccncc1C(=O)OC ACT03786 [0,1,0,0,0,1|1,0,0]=3 83 B11R1.222 c1ccc(c(c1)C(=O)CBr)Cl ACT00383 [0,1,0,0,0,1|2,0,0]=4 84 B11R1.21 Cc1cc(ccc1F)C(=O)O ACT11820 [0,1,0,0,0,1|2,0,0]=4 85 B11R1.23 COC(=O)c1cccc(n1)Cl ACT03638 [0,1,0,0,0,1|2,0,0]=4 86 B11R1.74 Cc1cc(cc(c1)Br)C(=O)O ACT11806 [0,1,0,0,0,1|2,0,0]=4 87 B11R1.266 CC(=O)c1cccc(c1)CCl ACT00880 [0,1,0,0,0,1|1,0,0]=3 88 B11R1.266 CC(=O)c1cccc(n1)OC ACT09231 [0,1,0,0,0,1|1,0,0]=3 89 B11R1.266 COc1cccc(n1)C(=O)O ACT11350 [0,1,0,0,0,1|2,0,0]=4 90 B11R1.199 CCOC(=O)c1c(cc[nH]1)C ACT09546 [0,2,0,0,0,0|2,0,0]=4 91 B11R1.199 CCOC(=O)c1nccn1C ACT07790 [0,2,0,0,0,0|1,0,0]=3 92 B9R1.2 Cc1cccc(c1)NN ACT08527 [0,0,1,1,0,0|2,0,0]=4 93 B9R1.6 CC(=O)c1ccccn1 ACT06583 [0,0,1,1,0,0|2,0,0]=4 94 B9R1.6 CC(=O)c1cccnc1 ACT09581 [0,0,1,1,0,0|0,0,2]=4 95 B9R1.15 COc1ccc[nH]c1=O ACT09226 [0,0,1,1,0,0|2,0,0]=4 96 B9R1.15 Cc1ccccc1NN ACT08523 [0,0,1,1,0,0|2,0,0]=4 97 B11R2.1 c1cc2c(nc1)COC2=O ACT04440 [0,0,0,1,0,1|2,0,0]=4 98 B11R1.86 Cc1cccnc1NC(=O)C ACT11134 [0,0,0,0,0,2|1,0,0]=3 99 B11R1.157 Cc1ccnc(c1)NC(=O)C ACT06900 [0,0,0,0,0,2|2,0,0]=4