0 B10R1.59 Cc1cc(n(n1)C)C(=O)O LS20296 [0,0,0,0,0,0|3,0,0]=3 1 B9R1.35 Cc1cc([nH]n1)C(=O)O LS20817 [1,0,0,0,0,0|3,0,0]=4 2 B9R1.35 Cc1cc(n[nH]1)C(=O)O LS20295 [1,0,0,0,0,0|3,0,0]=4 3 B9R1.35 Cc1ccc(s1)C(=O)O LS20662 [1,0,0,0,0,0|3,0,0]=4 4 B9R1.35 Cc1ncc(s1)C(=O)O LS21069 [1,0,0,0,0,0|3,0,0]=4 5 B9R1.41 Cc1c(con1)C(=O)O LS20143 [1,0,0,0,0,0|3,0,0]=4 6 B9R1.41 Cc1ccsc1C(=O)O LS20659 [1,0,0,0,0,0|3,0,0]=4 7 B9R1.41 Cn1c(ccn1)C(=O)O LS20083 [1,0,0,0,0,0|3,0,0]=4 8 B9R1.41 c1csc(c1C(=O)O)Br LS20833 [1,0,0,0,0,0|2,1,0]=4 9 B11R1.74 CC(=O)c1cc(cc(c1)F)F LS11171 [0,0,0,0,0,1|3,0,0]=4 10 B11R1.74 Cc1cc(cc(c1)N(C)C)C LS11804 [0,0,0,0,0,1|3,0,0]=4 11 B11R1.74 Cc1cc(cc(c1)N)C(=O)O LS10247 [0,0,0,0,0,1|3,0,0]=4 12 B11R1.166 CC(=O)c1c[nH]c(=O)[nH]c1=O LS20755 [0,0,0,0,0,1|3,0,0]=4 13 B11R1.166 CC(=O)c1ccc(cc1Cl)Br LS10361 [0,0,0,0,0,1|3,0,0]=4 14 B11R1.166 CC(=O)c1ccc(cc1F)Cl LS10306 [0,0,0,0,0,1|3,0,0]=4 15 B11R1.166 CC(=O)c1ccc(cc1O)F LS10126 [0,0,0,0,0,1|3,0,0]=4 16 B11R1.166 Cc1cc(ccc1C(=O)O)F LS10581 [0,0,0,0,0,1|3,0,0]=4 17 B11R1.166 Cc1ccc(c(c1)F)C(=O)O LS10521 [0,0,0,0,0,1|3,0,0]=4 18 B11R1.166 Cc1ccc(c(n1)Cl)C(=O)O LS20787 [0,0,0,0,0,1|3,0,0]=4 19 B11R1.167 CC(=O)c1cc(ccc1Br)Cl LS11579 [0,0,0,0,0,1|3,0,0]=4 20 B11R1.167 CC(=O)c1cc(ccc1Br)F LS10365 [0,0,0,0,0,1|3,0,0]=4 21 B11R1.167 CC(=O)c1cc(ccc1F)Br LS10106 [0,0,0,0,0,1|3,0,0]=4 22 B11R1.167 CC(=O)c1cc(ccc1I)F LS10113 [0,0,0,0,0,1|3,0,0]=4 23 B11R1.167 CC(=O)c1cc(ccc1O)O LS11715 [0,0,0,0,0,1|3,0,0]=4 24 B11R1.167 Cc1ccc(c(c1)C(=O)O)I LS10696 [0,0,0,0,0,1|3,0,0]=4 25 B11R1.167 Cc1ccc(cc1C(=O)O)Br LS10562 [0,0,0,0,0,1|3,0,0]=4 26 B11R1.167 Cc1ccc(cc1C(=O)O)F LS10582 [0,0,0,0,0,1|3,0,0]=4 27 B11R1.167 Cc1ccc(cc1C(=O)O)I LS11399 [0,0,0,0,0,1|3,0,0]=4 28 B8R1.1 Cc1ccc(s1)C=O LS20392 [2,0,0,0,0,0|2,0,0]=4 29 B8R1.11 Cc1ccsc1C=O LS20658 [2,0,0,0,0,0|2,0,0]=4 30 B8R1.11 Cn1c(ccn1)C=O LS20046 [2,0,0,0,0,0|2,0,0]=4 31 B8R1.18 Cc1c(oc(n1)C)C LS20281 [2,0,0,0,0,0|1,0,0]=3 32 B8R1.18 Cc1cc(=O)n([nH]1)C LS20878 [2,0,0,0,0,0|2,0,0]=4 33 B8R1.7 CC(=O)c1c[nH]cn1 LS20519 [2,0,0,0,0,0|2,0,0]=4 34 B8R1.7 CC(=O)c1cccs1 LS20643 [2,0,0,0,0,0|2,0,0]=4 35 B8R1.7 CC(=O)c1ccsc1 LS20391 [2,0,0,0,0,0|0,1,0]=3 36 B8R1.7 c1c(con1)C(=O)O LS20144 [2,0,0,0,0,0|2,0,0]=4 37 B8R1.7 c1c(nco1)C(=O)O LS41294 [2,0,0,0,0,0|2,0,0]=4 38 B8R1.7 c1conc1C(=O)O LS20146 [2,0,0,0,0,0|2,0,0]=4 39 B8R1.7 c1cscc1C(=O)Cl LS20651 [2,0,0,0,0,0|1,1,0]=4 40 B8R1.7 c1cscc1C(=O)O LS20647 [2,0,0,0,0,0|1,1,0]=4 41 B10R1.149 Cc1c(ccs1)C(=O)OC LS20060 [1,1,0,0,0,0|0,1,0]=3 42 B12R1.358 Cc1cc(cc(n1)Cl)C(=O)OC LS20027 [0,1,0,0,0,1|2,0,0]=4 43 B12R1.511 Cc1cc(c(c(c1)C(=O)O)N)C LS11350 [0,1,0,0,0,1|2,0,0]=4 44 B12R1.1005 Cc1cc(cc(c1Br)C)C(=O)O LS70017 [0,1,0,0,0,1|2,0,0]=4 45 B12R1.452 CC(=O)c1ccc(cc1F)OC LS11613 [0,1,0,0,0,1|2,0,0]=4 46 B12R1.1703 Cc1cc(cnc1C(=O)OC)Br LS20025 [0,1,0,0,0,1|2,0,0]=4 47 B12R1.354 Cc1ccc(c(c1)C(=O)OC)I LS10697 [0,1,0,0,0,1|2,0,0]=4 48 B12R1.354 Cc1ccc(cc1C(=O)OC)Br LS10769 [0,1,0,0,0,1|2,0,0]=4 49 B12R2.612 c1cc2c(cc1Cl)CCC2=O LS00023 [0,0,0,1,0,1|2,0,0]=4 50 B12R2.612 c1cc2c(cc1F)CCC2=O LS20516 [0,0,0,1,0,1|2,0,0]=4 51 B12R2.612 c1cc2c(cc1O)CCC2=O LS40251 [0,0,0,1,0,1|2,0,0]=4 52 B10R1.8 Cc1cc(cc(c1)Cl)C=O LS10080 [1,0,0,0,0,1|2,0,0]=4 53 B10R1.25 Cc1cc(ccc1C=O)F LS10500 [1,0,0,0,0,1|2,0,0]=4 54 B10R1.25 Cc1cc(ccc1C=O)O LS11394 [1,0,0,0,0,1|2,0,0]=4 55 B10R1.13 CC(=O)c1ccc(cc1)Br LS11874 [1,0,0,0,0,1|2,0,0]=4 56 B10R1.13 CC(=O)c1ccc(cc1)F LS11575 [1,0,0,0,0,1|2,0,0]=4 57 B10R1.13 CC(=O)c1ccc(cc1)N LS10360 [1,0,0,0,0,1|2,0,0]=4 58 B10R1.13 CC(=O)c1ccc(cc1)O LS10359 [1,0,0,0,0,1|2,0,0]=4 59 B10R1.13 CC(=O)c1ccc(cn1)Br LS20859 [1,0,0,0,0,1|2,0,0]=4 60 B10R1.13 CC(=O)c1ccc(nc1)Br LS21178 [1,0,0,0,0,1|2,0,0]=4 61 B10R1.13 Cc1ccc(cn1)C(=O)O LS20541 [1,0,0,0,0,1|2,0,0]=4 62 B10R1.13 Cc1ncc(cn1)C(=O)C LS20101 [1,0,0,0,0,1|1,0,0]=3 63 B10R1.13 Cc1ncc(cn1)C(=O)O LS20220 [1,0,0,0,0,1|2,0,0]=4 64 B12R1.127 Cc1ccc(c(c1)CC(=O)O)C LS10689 [0,0,0,0,0,2|2,0,0]=4